data_2j48_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 2j48 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -96.09 135.18 38.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.789 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 57.5 mt -118.87 134.11 63.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.193 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 27.1 tp -107.21 131.67 53.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.097 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 4.6 tp -133.06 127.36 33.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.889 0.376 . . . . 0.0 111.877 -178.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.4 ' N ' HD11 ' A' ' 633' ' ' LEU . 7.9 mp -109.68 119.12 38.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.535 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 83.9 tt0 -159.06 156.97 30.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.012 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.65 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 85.3 tt0 -115.59 138.17 51.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.65 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 69.1 tt0 103.56 113.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.512 ' O ' ' OG1' ' A' ' 641' ' ' THR . 62.1 t0 -57.54 -36.04 71.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.333 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.4 -44.47 82.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.664 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -70.58 -43.2 69.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.832 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.35 87.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 86.9 m -62.22 -44.28 96.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.686 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 56.6 t -57.75 -53.73 40.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.46 -46.26 92.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.149 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.578 ' O ' ' OG1' ' A' ' 648' ' ' THR . 73.2 m -61.46 -35.74 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.031 -179.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -62.48 -40.32 96.3 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.913 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 89.5 mtp -67.36 -51.61 50.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.944 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . 0.43 ' N ' HD13 ' A' ' 647' ' ' LEU . 6.6 mp -67.89 -42.68 80.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.675 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.578 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 87.1 m -55.64 -42.08 74.5 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.759 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.06 -29.57 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.029 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.31 -6.65 47.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.735 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.25 2.4 73.98 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -96.88 145.15 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.122 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -93.43 128.92 39.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.689 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 71.8 t -124.61 138.01 55.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.552 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . 0.404 HD11 HG22 ' A' ' 655' ' ' ILE . 53.3 mt -105.66 130.74 56.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 0.0 110.495 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.535 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 24.4 t90 -96.66 111.51 23.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.424 ' CD1' ' HA ' ' A' ' 663' ' ' ALA . 64.6 mt -116.4 141.86 47.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.708 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 18.4 t -101.35 2.28 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.936 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.491 ' CG ' ' HG ' ' A' ' 661' ' ' SER . 56.8 t0 -148.42 136.33 20.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 0.0 110.879 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . 0.456 ' H ' ' HB2' ' A' ' 685' ' ' SER . . . -61.48 -37.9 94.9 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 661' ' ' SER . . . . . 0.491 ' HG ' ' CG ' ' A' ' 659' ' ' ASP . 90.0 p -60.02 -34.98 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.832 0.349 . . . . 0.0 110.229 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 19.2 m -64.75 -39.6 93.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.642 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.87 -43.61 95.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.043 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.72 -39.31 84.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.37 . . . . 0.0 110.834 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . 0.576 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 23.4 t70 -62.43 -41.52 98.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.949 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -90.08 -45.23 9.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.126 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.52 ' O ' ' N ' ' A' ' 671' ' ' GLN . 0.9 OUTLIER -44.56 -44.64 8.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.2 -179.132 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.576 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 30.1 p-10 -61.81 -35.74 79.08 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.45 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . 0.482 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 65.3 mt -78.23 -48.16 16.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.933 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.62 -29.32 30.2 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.527 -179.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.52 ' N ' ' O ' ' A' ' 667' ' ' LEU . 6.6 mt-30 45.56 81.17 0.26 Allowed Pre-proline 0 C--N 1.329 -0.321 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.115 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.69 157.19 18.69 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 123.028 2.485 . . . . 0.0 112.427 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . 0.405 HD11 HG22 ' A' ' 673' ' ' ILE . 26.3 pt -94.02 -10.7 9.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.69 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 83.4 t -139.7 134.05 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.54 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 62.2 mt -128.93 119.54 49.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.05 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 3.5 mp -107.68 137.68 45.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.071 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.531 ' SD ' ' SG ' ' A' ' 686' ' ' CYS . 74.8 mtm -138.17 133.44 33.31 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.197 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . 0.587 ' O ' ' OD2' ' A' ' 683' ' ' ASP . . . -67.51 145.05 55.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.248 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.767 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 32.9 t-105 -113.21 -15.1 0.11 Allowed Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.767 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 75.4 Cg_exo -46.6 162.79 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.711 1.607 . . . . 0.0 112.296 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.519 ' N ' ' HD2' ' A' ' 682' ' ' PRO . 23.8 Cg_exo -50.47 -49.99 14.91 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.678 2.252 . . . . 0.0 114.112 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 10.7 Cg_endo -55.79 -6.12 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 121.51 1.474 . . . . 0.0 111.234 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.587 ' OD2' ' O ' ' A' ' 678' ' ' ALA . 27.3 t0 -83.53 155.23 23.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.96 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -179.09 -31.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.508 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 685' ' ' SER . . . . . 0.456 ' HB2' ' H ' ' A' ' 660' ' ' GLY . 83.7 p -66.3 -28.31 68.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.592 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.531 ' SG ' ' SD ' ' A' ' 677' ' ' MET . 1.6 t -61.25 -22.25 64.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 88.1 mt -64.79 -34.61 78.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.913 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.2 -39.86 86.4 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.968 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.402 HD12 ' SD ' ' A' ' 677' ' ' MET . 7.3 tt -61.85 -40.88 96.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.022 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.26 -38.56 83.89 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.335 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . 0.465 ' HA ' ' NH1' ' A' ' 694' ' ' ARG . 60.8 tt0 -61.01 -42.14 97.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.978 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -58.36 -49.35 77.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.105 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.53 -38.77 69.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.523 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . 0.465 ' NH1' ' HA ' ' A' ' 691' ' ' GLN . 34.0 ttm105 -65.24 -37.57 87.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -68.41 -37.79 80.66 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.738 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.428 179.878 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 703' ' ' PRO . 11.8 Cg_endo . . . . . 0 N--CA 1.494 1.512 0 CA-C-O 120.492 0.121 . . . . 0.0 112.4 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 702' ' ' PRO . 46.5 Cg_exo -51.35 -149.61 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 94.8 mt -154.25 123.25 6.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.328 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.573 ' O ' ' OG ' ' A' ' 722' ' ' SER . 21.1 t -107.36 127.17 63.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.17 0.509 . . . . 0.0 111.499 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 5.2 mp -121.35 139.37 53.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.363 179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -106.78 128.79 54.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.105 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.6 mt -93.71 146.79 23.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.598 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 86.66 -126.04 7.7 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -90.26 159.44 41.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 110.779 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.04 149.05 22.23 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.787 2.324 . . . . 0.0 112.338 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -64.92 145.61 86.09 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.71 2.274 . . . . 0.0 112.052 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 79.7 t -80.13 -37.68 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . 0.636 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.3 OUTLIER -71.98 139.57 82.7 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.494 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.28 -17.01 21.88 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.599 2.199 . . . . 0.0 112.925 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 21.3 tp -70.05 -38.93 75.95 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.829 -0.349 . . . . 0.0 111.015 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.513 ' CD1' ' CH2' ' A' ' 679' ' ' TRP . 48.5 mt -77.06 -34.86 57.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 61.0 m -64.98 -41.14 95.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.922 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.89 96.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.429 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -82.76 -8.22 59.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.56 131.66 41.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.573 ' OG ' ' O ' ' A' ' 705' ' ' VAL . 83.4 p -86.42 -29.18 23.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.667 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.08 131.77 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 60.9 mt -93.16 128.48 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.119 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 33.8 mt -107.79 148.48 29.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.387 . . . . 0.0 111.252 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.5 t -167.42 -66.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.517 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . 0.43 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 0.7 OUTLIER -135.06 59.74 35.72 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.207 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 63.5 Cg_endo -79.72 141.14 15.19 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.915 2.41 . . . . 0.0 112.295 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.517 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.2 OUTLIER -67.01 109.3 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.771 179.698 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.517 ' O ' ' O ' ' A' ' 729' ' ' LEU . 31.1 m-20 54.85 147.84 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.39 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -63.32 0.25 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 123.083 2.522 . . . . 0.0 111.898 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 730' ' ' ASP . 95.0 mt-30 -68.13 -29.95 68.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.581 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.8 tp -63.71 -42.86 97.89 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.55 -43.65 89.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.193 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.53 -36.9 81.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.168 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.7 m -58.9 -42.26 89.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.331 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.8 m -62.0 -42.78 99.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.609 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.5 tt -64.78 -43.95 91.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.668 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 741' ' ' LEU . 96.9 mm-40 -66.53 -32.33 73.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.889 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.39 -5.93 0.37 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.145 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 739' ' ' GLN . 38.7 tp . . . . . 0 C--N 1.328 -0.337 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.783 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.78 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -93.98 135.64 35.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . 0.423 HG12 ' CG1' ' A' ' 674' ' ' VAL . 59.1 mt -115.82 135.93 54.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.366 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 16.3 tp -111.0 130.41 55.6 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.868 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.432 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 19.0 tp -116.09 125.65 52.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.771 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.419 HD22 ' SG ' ' A' ' 686' ' ' CYS . 14.7 tp -118.37 112.93 20.65 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.575 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 84.2 tt0 -160.35 164.96 32.06 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.719 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.505 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 77.5 mm-40 -106.07 168.2 9.29 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.3 tp10 67.7 110.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.42 . . . . 0.0 110.48 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.604 ' O ' ' OG1' ' A' ' 641' ' ' THR . 63.0 t0 -56.99 -36.02 69.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.292 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -62.67 -42.13 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.353 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.32 -45.99 57.53 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.563 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.1 -36.39 84.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.576 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.604 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 77.2 m -63.34 -46.55 86.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.646 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 41.7 t -54.69 -50.25 61.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.515 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 98.8 t -58.92 -43.52 88.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.87 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.54 ' O ' ' OG1' ' A' ' 648' ' ' THR . 71.1 m -67.34 -37.51 83.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.796 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -62.25 -39.48 93.01 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.352 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.6 mtm -65.8 -49.75 67.14 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.942 -0.703 . . . . 0.0 109.855 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 42.0 mt -70.52 -43.58 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.663 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.54 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 85.0 m -55.83 -42.36 75.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.938 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.91 -33.79 76.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -76.14 -5.46 46.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.43 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.74 14.8 66.91 Favored Glycine 0 CA--C 1.53 1.023 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -91.33 143.68 26.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . 0.432 ' HG2' ' HZ1' ' A' ' 653' ' ' LYS . 58.4 mttm -91.37 114.54 27.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . 0.432 ' CG1' ' HB2' ' A' ' 632' ' ' LEU . 61.1 t -128.82 134.25 64.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.095 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 53.0 mt -112.49 125.02 69.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.403 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.575 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 22.6 t90 -94.53 119.92 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 52.8 mt -119.58 149.31 42.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.992 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . 0.574 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 30.6 m -113.38 10.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.635 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 85.5 m-20 -149.86 121.06 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.271 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.92 -42.29 99.62 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 79.9 p -58.93 -37.67 77.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.074 0.464 . . . . 0.0 110.22 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 29.0 m -65.27 -39.69 92.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.103 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.593 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -64.62 -41.78 95.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.184 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . 0.443 HD11 ' HD1' ' A' ' 692' ' ' HIS . 89.8 mt -59.19 -46.12 89.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 111.446 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -61.78 -40.38 94.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.022 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -88.61 -54.79 4.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.476 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.593 ' N ' ' O ' ' A' ' 663' ' ' ALA . 10.3 tt -48.32 -35.19 11.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.484 -178.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -53.55 -40.61 65.68 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.193 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 57.0 mt -79.51 -24.98 41.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.724 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 32.3 mt -71.57 -35.61 70.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.801 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.499 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.2 mm-40 47.23 63.87 9.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 5.9 Cg_exo -73.11 160.02 46.38 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 123.178 2.586 . . . . 0.0 112.857 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 81.1 mt -94.53 -23.1 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.992 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . 0.423 ' CG1' HG12 ' A' ' 630' ' ' ILE . 10.5 p -145.82 141.07 21.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.067 0.461 . . . . 0.0 111.13 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 79.0 mt -124.32 119.35 56.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.192 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 70.2 mt -105.5 131.44 52.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.36 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 7.2 ptm -145.83 138.29 25.58 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.99 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.38 149.31 48.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.702 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 28.3 t-105 -110.63 -34.33 0.13 Allowed Pre-proline 0 C--N 1.328 -0.334 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.993 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.702 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 39.0 Cg_exo -52.56 -41.48 67.99 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.23 1.954 . . . . 0.0 112.762 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 24.0 Cg_exo -59.63 134.52 58.32 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.133 1.889 . . . . 0.0 112.094 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.35 33.33 0.52 Allowed 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.883 2.389 . . . . 0.0 112.437 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -81.45 111.76 18.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.153 0.502 . . . . 0.0 110.873 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -61.04 -24.94 66.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.68 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 38.6 m -59.95 -36.54 77.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.511 ' O ' ' CD1' ' A' ' 690' ' ' LEU . 73.6 m -59.97 -34.55 73.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.58 -34.91 79.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.416 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.57 ' CD1' ' C ' ' A' ' 688' ' ' LEU . 0.3 OUTLIER -70.48 -35.65 73.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.24 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.479 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 4.9 tp -60.47 -43.71 96.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.71 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.511 ' CD1' ' O ' ' A' ' 686' ' ' CYS . 7.0 mp -61.94 -38.89 90.18 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.857 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -60.13 -41.98 93.84 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.206 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.443 ' HD1' HD11 ' A' ' 664' ' ' LEU . 3.5 t-160 -61.6 -54.63 40.46 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.575 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . 0.557 ' N ' ' CD2' ' A' ' 693' ' ' LEU . 1.7 mm? -55.17 -37.66 67.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.124 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -60.37 -37.16 79.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.263 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -68.44 -40.89 80.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.164 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.625 ' C ' ' ND1' ' A' ' 696' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.236 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 N--CA 1.488 1.177 0 CA-C-O 120.764 0.235 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -69.59 149.16 67.65 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.721 2.281 . . . . 0.0 111.914 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 37.1 mt -78.71 141.35 37.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.498 ' O ' ' N ' ' A' ' 722' ' ' SER . 59.8 t -121.84 125.96 73.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.309 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.458 HD11 ' N ' ' A' ' 706' ' ' LEU . 5.4 mp -131.2 138.17 49.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.072 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . 0.465 ' CE2' ' HB3' ' A' ' 721' ' ' ALA . 13.0 m-85 -113.37 130.31 56.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.505 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . 0.459 ' CD1' ' N ' ' A' ' 708' ' ' LEU . 5.4 mp -94.88 148.72 22.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.408 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . 0.581 ' O ' ' O ' ' A' ' 725' ' ' LEU . . . 101.83 -134.93 11.94 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.36 154.09 48.73 Favored Pre-proline 0 CA--C 1.529 0.173 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -81.87 131.83 7.24 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 C-N-CA 122.655 2.236 . . . . 0.0 112.586 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -52.17 152.01 15.75 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.106 1.871 . . . . 0.0 111.636 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 76.9 t -80.99 -21.9 10.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.868 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -72.53 132.27 83.81 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.678 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -74.45 -30.22 8.41 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.281 1.987 . . . . 0.0 111.886 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . 0.497 ' HG ' ' N ' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -75.69 -32.18 60.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.957 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.497 ' N ' ' HG ' ' A' ' 716' ' ' LEU . 42.3 tp -76.78 -42.91 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 30.4 m -64.4 -39.41 93.79 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.72 -32.1 73.46 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -71.06 -31.43 67.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.853 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . 0.465 ' HB3' ' CE2' ' A' ' 707' ' ' PHE . . . -70.87 150.46 45.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.683 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.498 ' N ' ' O ' ' A' ' 705' ' ' VAL . 74.2 m -84.18 -26.95 28.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.148 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 159.45 5.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.359 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 73.9 mt -142.45 131.99 22.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.157 -179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.581 ' O ' ' O ' ' A' ' 709' ' ' GLY . 5.3 mp -102.93 148.43 25.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.242 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 20.6 p -165.71 6.63 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.128 0.49 . . . . 0.0 110.06 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -139.22 64.12 31.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.953 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -55.91 126.4 22.3 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.269 1.979 . . . . 0.0 112.477 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.469 ' CD1' ' O ' ' A' ' 729' ' ' LEU . 0.3 OUTLIER 178.49 -14.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.907 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -143.87 75.23 16.08 Favored Pre-proline 0 CA--C 1.528 0.12 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.378 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -56.52 -9.89 4.34 Favored 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.621 2.214 . . . . 0.0 111.408 179.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.671 ' O ' ' NE2' ' A' ' 732' ' ' GLN . 0.0 OUTLIER -72.64 -22.48 60.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.438 -179.462 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.71 -47.63 68.81 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 66.9 tp -59.97 -43.96 94.75 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.676 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 24.4 tp -59.06 -38.46 79.47 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 94.1 m -60.45 -37.1 79.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.505 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 57.7 m -59.85 -47.72 84.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.418 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.73 -38.77 87.34 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.504 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.632 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.4 mm-40 -64.61 -28.92 69.95 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.916 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -55.11 3.21 0.02 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.632 ' H ' ' C ' ' A' ' 739' ' ' GLN . 39.6 tp . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.805 0.336 . . . . 0.0 110.906 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.671 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -88.0 136.21 33.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.968 0.414 . . . . 0.0 110.925 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 78.6 mt -115.69 140.17 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.459 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 63.2 tp -108.76 132.08 54.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.964 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 8.4 tt -135.19 123.32 22.88 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.189 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 633' ' ' LEU . 9.6 mp -107.59 115.48 30.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.094 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.463 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.9 tt0 -159.92 157.59 29.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.886 0.374 . . . . 0.0 111.177 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.654 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.1 tt0 -115.37 144.52 43.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.394 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.654 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 42.6 tp10 110.96 109.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.724 0.64 . . . . 0.0 110.338 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.702 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.0 p30 -66.62 -34.42 77.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.745 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.702 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.8 mt-10 -67.43 -50.7 58.25 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.679 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -68.23 -36.14 79.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.171 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.483 ' HA ' ' CZ2' ' A' ' 656' ' ' TRP . . . -68.85 -40.15 79.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.23 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 62.4 m -60.89 -47.63 85.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.023 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 92.0 t -58.11 -53.37 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.467 . . . . 0.0 110.439 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.96 -46.43 94.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.252 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.578 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.7 t -56.09 -39.96 72.9 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.574 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -61.38 -37.32 82.97 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.95 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.1 mtt -66.12 -54.18 28.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.324 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.05 -43.68 78.13 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.539 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.578 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 29.3 m -55.86 -42.38 75.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.251 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.92 64.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.758 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -68.99 -4.93 18.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.611 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.35 -0.85 78.62 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -98.19 137.3 37.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.164 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -93.6 126.91 39.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.866 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 10.5 m -126.04 151.59 32.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 110.986 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 19.1 mm -108.91 127.48 65.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.62 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.483 ' CZ2' ' HA ' ' A' ' 640' ' ' ALA . 3.6 t-105 -96.16 119.3 34.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.05 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.507 ' HG ' ' H ' ' A' ' 659' ' ' ASP . 16.7 tp -132.62 139.08 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.969 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 17.6 m -99.13 -7.81 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.143 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.507 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 93.0 m-20 -98.39 155.15 17.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -97.24 -64.14 0.9 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.95 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.8 t -57.78 -39.9 78.56 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 121.128 -0.229 . . . . 0.0 111.441 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 60.2 m -62.78 -37.95 88.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.936 0.398 . . . . 0.0 110.406 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.598 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.6 -41.3 98.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . 0.47 HD12 ' CG ' ' A' ' 692' ' ' HIS . 61.1 mt -58.82 -47.45 84.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.065 0.459 . . . . 0.0 110.719 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -61.4 -38.82 88.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.688 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -83.87 -34.1 24.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.72 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.1 tt -50.93 -39.25 54.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.659 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -56.06 -35.95 67.52 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 74.5 mt -75.81 -30.54 59.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.459 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 28.4 mt -71.79 -37.41 70.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.187 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.476 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 42.2 mm-40 45.36 60.78 13.04 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.647 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.476 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 95.6 Cg_endo -89.67 157.93 5.21 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 123.43 2.754 . . . . 0.0 112.552 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 24.0 pt -97.33 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.783 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 41.7 t -142.66 139.52 28.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.928 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 73.4 mt -124.73 126.05 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 5.1 mp -104.63 137.8 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.737 ' SD ' ' N ' ' A' ' 678' ' ' ALA . 0.2 OUTLIER -137.22 121.97 18.67 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.03 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . 0.737 ' N ' ' SD ' ' A' ' 677' ' ' MET . . . -66.63 153.91 41.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.79 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 56.9 t-105 -110.19 66.19 0.44 Allowed Pre-proline 0 C--N 1.328 -0.336 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.564 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -69.54 169.17 19.26 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.962 2.442 . . . . 0.0 111.454 178.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 682' ' ' PRO . 2.7 Cg_endo -50.02 172.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.243 1.962 . . . . 0.0 111.225 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.688 ' O ' ' N ' ' A' ' 684' ' ' GLN . 60.3 Cg_exo -25.73 -65.52 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.267 2.645 . . . . 0.0 112.989 -179.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.66 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 91.9 m-20 54.11 -70.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.482 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . 0.688 ' N ' ' O ' ' A' ' 682' ' ' PRO . 0.2 OUTLIER 103.37 -29.2 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.592 0.558 . . . . 0.0 111.113 179.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 86.5 p -66.04 -42.05 90.06 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 90.6 m -65.98 -36.65 83.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 110.578 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.4 mt -64.59 -32.79 74.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.869 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.596 ' CD1' ' C ' ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.95 -36.01 74.94 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.038 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.472 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 6.3 tp -59.51 -47.38 85.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.378 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.455 ' N ' HD21 ' A' ' 690' ' ' LEU . 4.6 mm? -61.76 -41.58 97.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.388 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.36 -42.78 96.5 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.623 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.479 ' HE2' ' NE2' ' A' ' 696' ' ' HIS . 5.7 t60 -58.07 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.569 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 88.2 mt -54.56 -42.75 71.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.115 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -65.11 -34.37 78.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.358 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.79 -36.54 78.4 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.479 ' NE2' ' HE2' ' A' ' 692' ' ' HIS . 2.0 m-70 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.423 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 N--CA 1.49 1.269 0 CA-C-O 120.865 0.277 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -49.26 155.67 2.97 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.716 2.277 . . . . 0.0 111.596 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 27.0 mt -77.03 138.62 39.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.691 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 24.8 t -121.69 132.59 70.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.19 137.51 48.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.634 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . 0.443 ' CE1' ' HB2' ' A' ' 721' ' ' ALA . 39.7 m-85 -113.77 121.83 45.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.259 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . 0.465 ' CD1' ' N ' ' A' ' 708' ' ' LEU . 4.1 mp -98.72 142.24 30.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.892 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 104.63 -134.3 11.93 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -92.14 157.29 41.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.946 0.403 . . . . 0.0 110.784 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -70.94 145.16 49.64 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.747 2.298 . . . . 0.0 111.719 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.72 145.81 70.67 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.636 2.224 . . . . 0.0 112.282 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.51 -40.09 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.7 144.53 86.03 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.373 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.38 -14.87 14.42 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 112.292 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.61 -32.21 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.652 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -76.67 -34.95 58.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.513 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 25.6 m -62.83 -41.88 99.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.782 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.82 92.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.032 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tp60 -75.95 -28.96 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.579 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . 0.443 ' HB2' ' CE1' ' A' ' 707' ' ' PHE . . . -73.5 126.53 30.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.949 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 84.8 p -86.61 -24.18 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.85 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.78 126.75 0.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.386 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.5 mt -90.19 131.06 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.624 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 18.6 mt -107.52 155.78 19.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.902 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 2.2 p -166.48 60.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.921 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . 0.462 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 15.1 tttt 57.65 61.77 5.78 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.308 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 62.7 Cg_endo -86.42 145.41 8.2 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.535 ' C ' ' CG ' ' A' ' 730' ' ' ASP . 1.6 mp -67.11 151.66 47.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.51 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.691 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.0 OUTLIER 50.88 93.43 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.13 8.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.847 2.364 . . . . 0.0 111.794 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.691 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -68.02 -25.66 65.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.671 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.03 -46.78 79.89 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.618 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.57 -44.78 89.87 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.73 -39.56 91.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.577 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 31.8 m -60.09 -36.85 78.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.101 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 44.6 m -60.56 -46.41 90.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.604 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.45 -39.52 92.13 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.364 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.691 ' C ' ' H ' ' A' ' 741' ' ' LEU . 6.2 tp-100 -63.86 -28.02 69.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.367 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.68 2.86 0.01 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.691 ' H ' ' C ' ' A' ' 739' ' ' GLN . 20.0 tp . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.652 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -88.37 135.35 33.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.944 0.402 . . . . 0.0 110.64 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 90.9 mt -112.67 138.51 41.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.286 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 17.3 tp -107.49 127.59 53.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.402 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 9.6 tt -131.63 123.41 27.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.664 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 47.9 mt -106.76 124.21 49.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.902 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.504 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.2 tt0 -159.47 163.53 35.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.672 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.504 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 78.5 tt0 -105.4 159.83 15.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.576 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.474 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 84.6 tt0 68.42 117.51 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.57 ' O ' ' OG1' ' A' ' 641' ' ' THR . 4.2 p30 -63.21 -34.58 77.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.669 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.93 -45.29 82.37 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.214 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.83 77.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.04 0.447 . . . . 0.0 110.127 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.458 ' HB3' ' CD1' ' A' ' 656' ' ' TRP . . . -66.44 -35.64 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.595 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.57 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.0 m -62.32 -46.63 87.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.694 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 55.2 t -56.91 -51.94 61.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.552 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.97 -48.1 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.667 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.522 ' O ' ' OG1' ' A' ' 648' ' ' THR . 71.7 m -67.04 -30.53 70.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 641' ' ' THR . 51.2 tp10 -61.34 -43.39 98.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.024 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 9.1 mmt -67.28 -43.88 80.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.182 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.69 -45.98 77.07 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.92 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.522 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 26.8 m -56.34 -42.83 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.465 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.66 65.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.449 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.23 -4.99 28.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.365 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.55 -4.98 73.59 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.56 139.48 32.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -94.07 126.94 39.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.43 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.2 p -130.54 142.96 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.571 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 18.7 mm -108.19 122.89 63.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.329 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.458 ' CD1' ' HB3' ' A' ' 640' ' ' ALA . 19.5 t90 -95.75 117.07 29.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.766 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 66.0 mt -118.57 147.49 43.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 3.6 p -110.12 20.64 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.265 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -149.44 123.67 9.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.677 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.35 -40.03 96.95 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.544 -0.623 . . . . 0.0 111.544 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 55.5 p -60.26 -38.72 84.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.081 0.467 . . . . 0.0 110.17 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.3 m -65.23 -35.46 81.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.902 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.542 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.78 -45.1 91.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.228 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . 0.446 ' CD1' ' HD1' ' A' ' 692' ' ' HIS . 44.6 mt -59.75 -41.06 90.14 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.558 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -63.0 -42.72 99.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -86.25 -42.6 13.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.973 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.542 ' N ' ' O ' ' A' ' 663' ' ' ALA . 1.1 tt -45.24 -44.67 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.889 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.97 -34.54 76.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.513 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 50.8 mt -78.4 -45.94 21.11 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.4 OUTLIER -83.49 -13.55 54.38 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.183 -0.607 . . . . 0.0 112.07 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.456 ' C ' ' O ' ' A' ' 670' ' ' LEU . 1.5 mt-30 38.24 74.82 0.61 Allowed Pre-proline 0 C--N 1.327 -0.393 0 C-N-CA 120.375 -0.53 . . . . 0.0 109.997 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -76.89 146.39 26.08 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.84 2.36 . . . . 0.0 112.289 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 21.8 pt -92.55 -13.13 8.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 14.5 p -145.02 139.06 22.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.215 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.16 125.09 70.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.934 0.397 . . . . 0.0 111.204 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.463 ' N ' HD13 ' A' ' 676' ' ' LEU . 5.4 mp -105.26 136.9 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 92.5 mtp -140.36 117.58 11.29 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.731 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -67.59 153.02 44.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.981 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.411 ' N ' ' O ' ' A' ' 708' ' ' LEU . 6.2 t-105 -120.98 57.97 6.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.209 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.444 ' O ' ' CB ' ' A' ' 683' ' ' ASP . 72.5 Cg_endo -77.0 152.78 31.97 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.891 2.394 . . . . 0.0 111.591 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.661 ' C ' ' H ' ' A' ' 683' ' ' ASP . 1.7 Cg_endo -51.11 -57.45 2.23 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.292 1.994 . . . . 0.0 112.523 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 10.0 Cg_endo -53.55 6.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.333 2.022 . . . . 0.0 111.987 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.661 ' H ' ' C ' ' A' ' 681' ' ' PRO . 56.8 t0 -76.45 148.93 36.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . 0.555 ' N ' ' OD1' ' A' ' 683' ' ' ASP . 10.3 pt20 -175.18 -43.85 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 34.1 t -64.09 -30.14 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.024 0.44 . . . . 0.0 110.382 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 87.6 m -58.84 -23.58 60.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.953 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.68 -37.97 89.36 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.508 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.483 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 0.8 OUTLIER -71.23 -39.55 71.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.941 -179.652 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.483 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 10.0 tt -60.84 -42.07 97.07 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.621 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 83.5 mt -60.48 -45.9 92.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.184 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -63.15 -40.99 99.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.199 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.446 ' HD1' ' CD1' ' A' ' 664' ' ' LEU . 7.7 t-160 -60.27 -60.94 3.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . 0.557 ' CD1' ' C ' ' A' ' 693' ' ' LEU . 0.4 OUTLIER -55.46 -39.87 70.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . 0.488 ' N ' ' HG ' ' A' ' 693' ' ' LEU . 79.3 ttt180 -65.02 -33.86 77.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.026 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . 0.478 ' HG2' ' CE1' ' A' ' 696' ' ' HIS . 78.2 tt0 -65.64 -36.66 84.33 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.276 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.478 ' CE1' ' HG2' ' A' ' 695' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.117 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 120.743 0.226 . . . . 0.0 112.403 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.2 173.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.579 2.186 . . . . 0.0 111.784 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.706 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.3 OUTLIER -77.15 137.36 38.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.416 HG11 ' CE1' ' A' ' 707' ' ' PHE . 44.1 t -122.05 131.18 73.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.067 0.46 . . . . 0.0 111.896 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 3.8 mp -112.35 134.63 53.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.731 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . 0.416 ' CE1' HG11 ' A' ' 705' ' ' VAL . 90.2 m-85 -115.64 129.92 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.465 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . 0.411 ' O ' ' N ' ' A' ' 679' ' ' TRP . 62.0 mt -106.11 140.49 39.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.884 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 117.32 -142.86 17.65 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -92.52 165.83 18.42 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.027 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.37 154.96 10.35 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.418 2.079 . . . . 0.0 112.022 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.06 169.22 5.04 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 123.076 2.518 . . . . 0.0 112.129 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.511 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 42.7 t -80.53 0.36 3.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.297 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -161.8 143.05 8.33 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.02 -10.98 25.11 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.694 2.263 . . . . 0.0 112.431 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . 0.558 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 3.5 mm? -69.52 -35.3 75.35 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.313 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.85 -31.43 59.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.8 m -60.98 -44.23 97.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.665 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.68 -37.12 85.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.871 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -77.37 -19.97 55.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.669 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.76 137.79 49.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.14 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.411 ' CB ' ' H ' ' A' ' 705' ' ' VAL . 67.3 m -86.26 -29.77 22.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.584 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.88 105.65 0.2 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 60.1 mt -93.13 129.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.658 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 6.4 mp -111.36 97.94 7.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 110.32 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 50.2 p -75.42 0.22 17.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.664 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -126.63 89.4 52.25 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.927 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.634 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 49.0 Cg_exo -51.99 154.65 9.86 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 123.016 2.477 . . . . 0.0 112.533 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.634 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 1.5 tp 98.15 -157.41 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.272 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 50.18 62.76 11.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.86 -19.43 62.02 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.445 2.097 . . . . 0.0 111.714 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.62 -36.31 65.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -70.13 -50.03 44.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.327 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 10.5 tp -58.02 -42.16 84.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.885 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 26.3 tp -62.84 -39.04 93.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.145 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.6 m -58.48 -47.62 83.47 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.412 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.9 m -65.15 -40.87 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.578 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.09 -45.72 87.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.657 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.672 ' O ' ' N ' ' A' ' 741' ' ' LEU . 98.1 mt-30 -66.08 -27.7 68.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.103 0.478 . . . . 0.0 109.955 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . 0.505 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -27.75 -33.01 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.432 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.672 ' N ' ' O ' ' A' ' 739' ' ' GLN . 6.3 mp . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.852 0.358 . . . . 0.0 110.163 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.639 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -95.72 134.02 39.14 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . 0.437 HD12 HG22 ' A' ' 630' ' ' ILE . 64.7 mt -116.92 136.71 53.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 120.966 0.413 . . . . 0.0 110.461 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 21.1 tp -104.66 129.96 52.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.659 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 8.0 tt -127.47 121.96 32.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.183 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.483 ' CD1' ' O ' ' A' ' 657' ' ' LEU . 12.2 tp -110.17 121.51 45.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.429 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.521 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 85.9 tt0 -159.47 165.97 31.93 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.195 -0.602 . . . . 0.0 111.345 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 94.4 mt-10 -107.62 160.65 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.97 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 71.31 108.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 27.1 p-10 -57.19 -37.74 72.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.073 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -63.76 -43.15 97.26 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.857 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.6 -36.92 70.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.483 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.04 -42.64 80.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.023 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 645' ' ' GLU . 31.6 m -63.26 -45.84 89.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.801 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 86.5 t -56.62 -53.55 39.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.825 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.05 -47.59 92.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.403 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.609 ' O ' ' OG1' ' A' ' 648' ' ' THR . 70.2 m -65.35 -29.91 70.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.111 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 641' ' ' THR . 73.8 tt0 -61.55 -45.81 92.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.671 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 92.0 mmm -70.27 -42.86 71.54 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.784 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.73 -43.01 85.36 Favored 'General case' 0 CA--C 1.522 -0.121 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.609 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 83.5 m -55.71 -40.15 72.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.28 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.81 -21.2 61.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.531 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -65.19 -5.1 6.03 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.809 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 102.45 -19.23 48.81 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -98.46 152.32 19.65 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.98 129.65 37.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.988 0.423 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 16.2 t -119.85 133.21 67.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . 0.419 HD11 HG22 ' A' ' 655' ' ' ILE . 27.1 mm -108.95 135.87 46.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.467 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 23.3 t90 -89.85 114.02 25.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.514 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.483 ' O ' ' CD1' ' A' ' 633' ' ' LEU . 4.6 mm? -112.27 136.24 51.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.047 0.451 . . . . 0.0 110.288 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . 0.61 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 4.4 p -117.42 19.95 6.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.994 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.61 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 89.4 m-20 -150.62 174.27 13.17 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.457 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -105.14 -63.47 0.65 Allowed Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.421 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 23.0 t -57.69 -36.99 72.69 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 51.1 m -62.86 -39.34 94.1 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.552 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.61 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.46 -39.67 95.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.585 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 61.9 mt -59.34 -39.42 83.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.003 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.78 -47.5 83.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.379 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -89.71 -42.68 11.19 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.683 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.61 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.6 tt -50.13 -36.78 31.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.041 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -56.22 -36.66 68.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.844 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 39.4 mt -77.47 -26.41 51.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.304 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 37.6 mt -73.05 -32.93 65.38 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.687 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.438 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 39.3 mm-40 46.3 58.87 16.15 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-O 121.207 0.527 . . . . 0.0 110.167 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.438 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 50.9 Cg_endo -74.06 150.07 42.48 Favored 'Trans proline' 0 C--N 1.302 -1.921 0 C-N-CA 123.459 2.773 . . . . 0.0 112.83 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 24.6 pt -100.54 -19.49 5.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.747 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 76.8 t -137.12 137.51 46.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.416 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . 0.417 HD12 HG22 ' A' ' 675' ' ' ILE . 65.9 mt -127.25 118.65 50.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 8.8 tt -105.1 130.81 53.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.838 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 61.4 mtt -138.53 133.1 32.18 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.481 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -71.0 150.84 45.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.695 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.733 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -116.88 -24.79 0.1 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 C-N-CA 120.274 -0.571 . . . . 0.0 112.302 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.733 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -48.61 -39.71 37.6 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 121.887 1.724 . . . . 0.0 113.14 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 15.0 Cg_exo -65.43 155.29 69.57 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.653 1.568 . . . . 0.0 111.799 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -53.55 -19.41 13.7 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.284 1.989 . . . . 0.0 112.093 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 61.55 161.2 0.07 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.507 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 179.77 -80.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.148 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 31.3 m -63.11 -32.87 74.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.573 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 5.9 p -60.94 -24.12 65.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.748 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.44 -35.3 80.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.544 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 1.0 OUTLIER -73.47 -37.77 65.65 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.308 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.544 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 8.4 tt -61.7 -46.94 87.54 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.79 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 82.6 mt -63.04 -42.42 99.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.515 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.12 -39.59 93.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.828 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -57.9 -53.55 56.92 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.801 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.0 mt -55.82 -37.68 69.0 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.531 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . 0.674 ' NE ' ' OE1' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.78 -40.28 94.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.52 -39.2 77.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.754 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 15.9 m170 . . . . . 0 C--N 1.326 -0.433 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.721 -179.578 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo . . . . . 0 N--CA 1.49 1.309 0 CA-C-O 120.682 0.201 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -74.81 151.14 40.13 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.164 1.91 . . . . 0.0 112.069 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 48.0 mt -74.95 139.97 43.38 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' A' ' 722' ' ' SER . 46.1 t -123.73 129.04 74.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.918 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 707' ' ' PHE . 9.2 tt -116.22 133.58 55.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.935 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . 0.473 ' CE2' HG13 ' A' ' 705' ' ' VAL . 97.2 m-85 -116.22 137.51 52.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.01 0.434 . . . . 0.0 111.614 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 80.6 mt -99.77 154.76 18.06 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.037 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 84.89 -132.9 11.38 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -87.21 151.83 51.96 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 0.0 111.076 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.21 165.38 19.73 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 123.059 2.506 . . . . 0.0 112.325 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -62.51 160.47 31.75 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.868 2.378 . . . . 0.0 112.138 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.538 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.1 t -91.06 23.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.472 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . 0.538 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 12.7 m-20 -161.3 141.71 8.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.038 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.27 -15.62 35.22 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.801 2.334 . . . . 0.0 112.972 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . 0.452 ' H ' HD11 ' A' ' 716' ' ' LEU . 5.9 mp -69.77 -35.28 74.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.024 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 89.1 mt -75.46 -31.53 60.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 45.4 m -64.22 -43.91 93.52 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.14 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.12 -40.11 95.49 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.088 0.47 . . . . 0.0 109.956 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.674 ' OE1' ' NE ' ' A' ' 694' ' ' ARG . 31.8 tt0 -73.62 -29.28 62.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.813 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -68.59 140.45 55.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.94 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 705' ' ' VAL . 34.5 t -87.28 -28.13 22.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.292 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.68 168.54 6.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.186 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 53.2 mt -151.17 113.01 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.505 ' N ' HD13 ' A' ' 725' ' ' LEU . 6.6 mp -105.89 136.53 45.37 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.132 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.0 t -69.17 -81.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -103.39 128.36 27.68 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.64 142.29 52.75 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 121.997 1.798 . . . . 0.0 112.006 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 20.2 tp -176.38 138.8 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.404 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.598 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.4 OUTLIER 57.72 74.13 0.68 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.763 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.92 -5.19 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.492 2.128 . . . . 0.0 111.691 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.598 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -69.84 -30.26 67.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.219 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.7 -45.31 79.21 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 25.5 tp -57.26 -41.66 80.09 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.3 -40.37 96.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.208 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 87.9 m -59.28 -40.64 86.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.292 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 26.1 m -61.08 -41.76 97.25 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.154 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.37 -44.29 95.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.012 0.434 . . . . 0.0 110.374 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.563 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.7 mm-40 -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.568 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -59.0 4.77 0.09 OUTLIER Glycine 0 CA--C 1.529 0.914 0 C-N-CA 121.211 -0.519 . . . . 0.0 111.92 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' ' 739' ' ' GLN . 27.0 tp . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 117.0 0.4 . . . . 0.0 110.284 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.697 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -94.84 139.04 31.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.863 0.363 . . . . 0.0 111.296 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 89.9 mt -114.3 145.56 19.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.289 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 10.1 tp -107.69 134.5 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.765 0.317 . . . . 0.0 110.69 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.52 ' C ' ' CD1' ' A' ' 632' ' ' LEU . 0.2 OUTLIER -129.13 116.9 19.93 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.494 ' N ' HD12 ' A' ' 632' ' ' LEU . 6.6 tt -109.41 120.38 42.32 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.438 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 85.6 tt0 -159.41 153.96 24.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.479 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.658 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 82.6 tt0 -112.68 138.81 48.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.174 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.658 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 81.8 tt0 106.02 115.62 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.69 0.619 . . . . 0.0 110.381 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.562 ' O ' ' OG1' ' A' ' 641' ' ' THR . 34.0 t0 -60.65 -37.08 80.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.044 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -67.46 -50.1 60.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.301 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.37 87.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.973 0.416 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.641 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.54 -38.78 81.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.808 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.562 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 53.1 m -62.67 -44.39 96.37 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.782 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.85 -54.05 34.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.458 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.81 -41.26 87.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.452 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.775 ' SG ' ' CZ3' ' A' ' 656' ' ' TRP . 91.3 m -55.78 -43.47 76.8 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.454 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.17 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 90.1 mtp -68.08 -50.73 53.22 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.594 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 74.8 mt -68.25 -43.54 77.65 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.143 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 90.5 m -56.43 -42.27 77.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.98 -28.7 69.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.372 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -63.51 -17.03 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 86.5 2.68 84.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -95.04 149.17 21.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.052 0.453 . . . . 0.0 111.002 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -92.22 123.47 35.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.848 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 5.4 m -126.34 150.05 31.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.815 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 26.9 mm -108.49 125.45 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.775 ' CZ3' ' SG ' ' A' ' 644' ' ' CYS . 0.5 OUTLIER -95.24 125.71 40.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 111.383 -179.073 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 86.7 mt -124.45 143.52 50.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.457 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 7.6 m -101.15 2.91 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.048 0.452 . . . . 0.0 109.989 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.406 ' OD1' ' C ' ' A' ' 659' ' ' ASP . 57.1 p30 -153.21 173.62 15.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.909 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . 0.401 ' O ' ' HG ' ' A' ' 664' ' ' LEU . . . -102.23 -35.25 3.96 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.144 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 13.3 m -55.8 -44.29 77.68 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.863 0.363 . . . . 0.0 110.959 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 70.2 m -62.69 -36.78 84.03 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.66 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.25 -38.7 92.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.597 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 660' ' ' GLY . 18.3 mt -57.75 -47.68 81.8 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.881 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -63.83 -40.86 97.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.532 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -89.78 -54.56 4.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.947 0.403 . . . . 0.0 111.757 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.66 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.1 tt -45.05 -39.17 5.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.73 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -55.33 -37.28 67.21 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.535 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.17 -30.94 49.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.627 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 13.9 mt -71.91 -38.45 69.91 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.636 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 48.01 66.34 5.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -78.36 160.64 29.04 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 123.133 2.556 . . . . 0.0 113.156 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 74.7 mt -96.25 -23.03 4.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.098 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . 0.4 HG11 ' N ' ' A' ' 675' ' ' ILE . 40.6 t -143.73 140.12 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 120.872 0.368 . . . . 0.0 111.114 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . 0.4 ' N ' HG11 ' A' ' 674' ' ' VAL . 76.0 mt -126.46 121.89 59.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.032 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.542 ' CD1' ' N ' ' A' ' 676' ' ' LEU . 2.8 mp -114.75 133.91 55.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.457 ' N ' ' SD ' ' A' ' 677' ' ' MET . 3.5 mpp? -138.87 139.17 38.02 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.54 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.24 146.16 53.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.603 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.776 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -132.1 14.25 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.776 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 6.6 Cg_exo -50.89 -44.17 43.13 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 121.423 1.415 . . . . 0.0 112.353 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 40.7 Cg_endo -86.88 164.31 8.91 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 123.098 2.532 . . . . 0.0 112.827 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -71.04 -65.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.969 2.446 . . . . 0.0 111.937 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.462 ' OD1' ' O ' ' A' ' 683' ' ' ASP . 50.2 p30 -82.5 156.91 23.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . 0.48 ' CD ' ' SG ' ' A' ' 686' ' ' CYS . 49.5 tt0 -177.48 135.96 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.381 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 685' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 687' ' ' LEU . 37.0 m -61.18 -27.99 68.81 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.856 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.718 ' SG ' ' CZ3' ' A' ' 679' ' ' TRP . 25.8 p -52.84 -14.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.01 0.434 . . . . 0.0 109.867 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . 0.472 HD13 ' H ' ' A' ' 684' ' ' GLN . 32.3 mt -64.22 -38.92 92.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.777 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 2.3 pp -70.46 -35.59 73.4 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.486 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 22.4 tp -57.84 -42.95 85.46 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.308 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 47.1 mt -62.18 -36.46 81.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.021 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -56.79 -41.75 78.27 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.434 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 29.3 t-80 -59.96 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.292 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 40.8 mt -54.81 -40.36 69.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.718 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 66.2 mtm180 -63.97 -35.45 80.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -69.38 -35.94 76.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.012 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.616 ' CG ' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.236 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.216 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 120.497 0.124 . . . . 0.0 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.62 135.86 63.28 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.312 2.008 . . . . 0.0 112.45 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.489 ' CD1' ' N ' ' A' ' 704' ' ' LEU . 6.5 mp -80.87 141.91 34.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.998 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.47 HG23 ' CZ ' ' A' ' 707' ' ' PHE . 14.6 p -130.57 136.3 58.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.336 0.588 . . . . 0.0 110.998 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.408 ' CD1' ' HB1' ' A' ' 723' ' ' ALA . 12.4 tp -118.45 133.1 56.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.948 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . 0.47 ' CZ ' HG23 ' A' ' 705' ' ' VAL . 97.0 m-85 -110.02 130.33 55.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.014 0.435 . . . . 0.0 111.487 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.67 147.0 25.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.414 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 99.05 -131.58 10.62 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.639 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.2 162.92 35.98 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.21 151.93 20.85 Favored 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.631 2.22 . . . . 0.0 112.616 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -45.06 171.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.891 2.394 . . . . 0.0 112.868 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.533 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 96.9 t -83.63 3.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . 0.533 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -161.68 152.77 15.3 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.029 0.443 . . . . 0.0 110.817 -179.588 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -69.63 -8.8 24.53 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.941 2.427 . . . . 0.0 112.41 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.45 -34.35 74.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.665 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 1.6 mm? -77.22 -36.04 55.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.7 m -62.56 -41.78 99.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.864 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.95 92.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.209 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -75.59 -28.9 59.1 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . 0.412 ' HA ' ' CG1' ' A' ' 705' ' ' VAL . . . -69.67 153.78 42.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.849 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 57.6 p -85.18 -31.61 23.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . 0.408 ' HB1' ' CD1' ' A' ' 706' ' ' LEU . . . -174.35 151.1 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.403 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 65.6 mt -133.15 127.91 55.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.93 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.406 ' N ' ' CD1' ' A' ' 725' ' ' LEU . 8.9 mp -105.09 158.8 16.32 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.86 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.43 9.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.518 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . 0.655 ' CB ' ' HZ1' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -132.85 92.58 25.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.498 179.633 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.52 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 53.2 Cg_exo -47.48 149.18 4.69 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.611 2.208 . . . . 0.0 112.415 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 59.3 mt 98.85 172.99 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.132 0.895 . . . . 0.0 110.148 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 61.77 62.81 2.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.054 179.82 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -64.36 -8.46 16.92 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.918 2.412 . . . . 0.0 112.272 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -69.4 -29.71 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.209 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 11.4 tp -66.63 -43.01 85.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 53.0 tp -57.97 -43.72 86.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.301 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.08 -38.6 86.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 75.5 m -57.66 -41.46 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.3 m -62.23 -46.46 88.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.497 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 63.1 mt -66.06 -40.12 90.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.7 ' C ' ' H ' ' A' ' 741' ' ' LEU . 41.9 tt0 -66.21 -21.04 66.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.593 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.1 -2.73 0.01 OUTLIER Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.7 ' H ' ' C ' ' A' ' 739' ' ' GLN . 69.7 mt . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.685 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -94.64 136.75 34.58 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . 0.418 HG12 ' CG1' ' A' ' 674' ' ' VAL . 75.6 mt -117.19 135.74 56.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.874 0.369 . . . . 0.0 111.054 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 8.4 tt -109.03 128.65 55.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.784 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.449 ' C ' ' CD2' ' A' ' 632' ' ' LEU . 8.6 tt -127.16 127.38 44.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.952 0.406 . . . . 0.0 111.913 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 44.6 tp -108.74 111.76 23.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.768 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.493 ' HG3' ' N ' ' A' ' 635' ' ' GLU . 45.9 tp10 -160.28 156.9 27.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.933 0.397 . . . . 0.0 111.229 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 634' ' ' GLU . 85.4 tt0 -96.53 156.25 16.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.942 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 77.6 tt0 71.72 119.57 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.262 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 40.9 p-10 -62.99 -31.91 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.534 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.3 mt-10 -65.0 -40.83 95.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.336 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.84 62.3 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.918 0.389 . . . . 0.0 110.644 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -62.06 -35.28 78.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.946 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.502 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 86.6 m -62.79 -44.82 95.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.935 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 43.5 t -55.19 -53.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.448 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 58.4 t -60.77 -43.26 94.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.207 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.0 OUTLIER -67.39 -30.67 70.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.921 -179.676 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 641' ' ' THR . 41.6 tp10 -61.4 -45.49 94.11 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.163 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 93.6 mmm -65.3 -44.29 88.39 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.912 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.71 -43.45 80.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.252 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.5 m -55.9 -42.04 75.42 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -62.83 -32.34 73.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.329 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.43 -6.34 45.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.827 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 92.46 -0.21 70.82 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.293 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -91.61 148.25 22.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 117.073 0.436 . . . . 0.0 110.829 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -91.05 130.73 36.92 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.68 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 24.6 t -116.86 137.06 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.257 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . 0.402 HG23 HD11 ' A' ' 655' ' ' ILE . 59.6 mt -109.42 127.13 66.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.703 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -95.49 114.51 26.28 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 111.355 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 53.1 mt -116.46 145.23 43.44 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 2.4 p -116.17 10.86 7.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.183 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -149.64 128.25 12.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.459 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.09 95.22 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 m -59.2 -38.59 80.24 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.843 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 86.4 m -63.91 -40.31 96.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.859 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.7 -41.88 98.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.848 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 54.3 mt -59.2 -43.5 92.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -63.94 -38.75 92.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.376 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -89.68 -49.86 6.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.083 0.468 . . . . 0.0 111.037 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.1 tt -46.08 -46.2 16.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.427 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.597 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 52.3 t0 -62.6 -41.08 98.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 72.7 mt -77.2 -36.88 54.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.361 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.554 ' C ' ' CD1' ' A' ' 670' ' ' LEU . 0.1 OUTLIER -82.25 -39.99 22.23 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.137 -179.327 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 3.4 mt-30 54.08 75.38 0.63 Allowed Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 121.262 0.553 . . . . 0.0 110.236 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.33 165.3 32.13 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 123.684 2.923 . . . . 0.0 112.463 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 75.3 mt -93.25 -26.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.163 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . 0.418 ' CG1' HG12 ' A' ' 630' ' ' ILE . 10.9 p -142.68 138.62 28.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.069 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 71.9 mt -116.6 129.42 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.179 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.429 HD11 ' N ' ' A' ' 677' ' ' MET . 0.0 OUTLIER -106.5 130.43 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.429 ' N ' HD11 ' A' ' 676' ' ' LEU . 38.9 ttm -141.08 137.59 32.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.317 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . 0.449 ' CB ' ' OE1' ' A' ' 634' ' ' GLU . . . -67.66 153.06 44.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.495 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.76 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 37.9 t-105 -103.53 -19.82 0.19 Allowed Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.788 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.76 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 85.9 Cg_endo -85.51 121.45 2.24 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.966 1.778 . . . . 0.0 110.937 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -74.94 111.97 3.45 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.422 2.081 . . . . 0.0 112.748 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.8 -18.49 2.96 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.833 2.355 . . . . 0.0 111.061 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.529 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 22.3 t70 -160.31 -11.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.43 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 683' ' ' ASP . 90.3 mt-30 100.89 2.03 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 O-C-N 124.092 0.87 . . . . 0.0 110.873 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 21.9 m -65.13 -37.67 88.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.77 0.319 . . . . 0.0 111.158 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 78.8 m -62.13 -34.22 75.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.95 -32.83 74.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.186 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.53 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 0.3 OUTLIER -69.2 -37.13 77.95 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.237 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.53 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 0.2 OUTLIER -62.16 -41.55 98.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.245 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.535 ' C ' ' CD1' ' A' ' 690' ' ' LEU . 3.0 tm? -59.82 -40.63 89.1 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.47 -42.63 96.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.781 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -57.73 -50.18 74.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.505 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 79.4 mt -54.95 -39.74 69.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.558 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -62.74 -33.55 75.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.646 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -67.5 -35.99 80.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.084 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.212 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.489 1.222 0 CA-C-O 120.737 0.224 . . . . 0.0 111.874 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.19 151.56 43.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.816 2.344 . . . . 0.0 112.021 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.44 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 6.8 mp -77.51 140.13 39.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.138 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 722' ' ' SER . 44.4 t -120.29 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.113 0.482 . . . . 0.0 111.097 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 706' ' ' LEU . 5.5 mp -118.84 134.63 55.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -110.05 130.93 55.46 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.947 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . 0.47 ' CD1' ' C ' ' A' ' 708' ' ' LEU . 0.9 OUTLIER -101.05 140.48 35.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 119.12 -131.77 9.25 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 158.24 48.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.768 0.318 . . . . 0.0 110.352 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -75.14 116.31 4.52 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.786 2.324 . . . . 0.0 112.127 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.88 142.59 25.8 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.048 . . . . 0.0 111.997 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 93.3 t -82.75 -20.09 9.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.811 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.4 128.22 89.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.673 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -73.14 -30.14 10.95 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.213 1.942 . . . . 0.0 111.635 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.86 -35.12 69.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.208 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.613 ' CD2' ' CZ3' ' A' ' 679' ' ' TRP . 66.1 tp -73.3 -37.7 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.55 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 33.2 m -63.48 -40.07 96.14 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.857 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.09 89.82 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.352 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -74.69 -29.62 61.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.441 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -69.13 139.59 54.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.522 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.616 ' N ' ' O ' ' A' ' 705' ' ' VAL . 80.5 p -85.25 -28.59 25.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.502 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.93 121.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.208 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.3 mt -91.65 124.14 44.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.893 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 59.9 mt -103.14 124.37 48.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.726 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 726' ' ' SER . . . . . 0.403 ' HB2' ' H ' ' A' ' 727' ' ' LYS . 5.1 m -72.93 -79.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.746 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . 0.403 ' H ' ' HB2' ' A' ' 726' ' ' SER . 3.2 mttm -142.84 167.4 16.21 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.176 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -60.99 119.65 6.92 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 121.81 1.673 . . . . 0.0 111.477 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 7.1 tt -178.65 -40.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.823 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 730' ' ' ASP . 0.0 OUTLIER -129.82 72.17 81.99 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.955 0.407 . . . . 0.0 110.909 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -71.55 7.49 1.52 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.866 2.378 . . . . 0.0 111.9 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 733' ' ' LEU . 21.5 pt20 -71.92 -36.22 69.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.455 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . 0.462 ' N ' ' HG3' ' A' ' 732' ' ' GLN . 14.4 tp -66.93 -42.91 84.54 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.078 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 14.2 tp -56.63 -50.14 72.91 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.42 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 85.6 mt -62.27 -37.12 84.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.147 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 66.1 m -59.0 -40.33 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.349 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 86.5 m -61.26 -47.5 85.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.622 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . 0.434 ' N ' HD13 ' A' ' 738' ' ' LEU . 7.0 mp -66.28 -45.08 81.69 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.511 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -66.35 -28.21 68.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.276 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.25 -36.9 16.94 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 179.548 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.683 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -89.81 136.1 33.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.773 0.321 . . . . 0.0 110.525 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.4 mm -112.11 134.78 53.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.661 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 56.1 tp -114.11 136.01 53.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.746 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.555 ' C ' ' CD2' ' A' ' 632' ' ' LEU . 6.8 tt -133.96 125.1 27.51 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.038 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.45 ' N ' HD22 ' A' ' 632' ' ' LEU . 9.3 tt -118.9 127.74 53.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.751 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.462 ' OE1' ' CD1' ' A' ' 656' ' ' TRP . 0.0 OUTLIER -159.06 171.57 19.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 0.0 111.028 -179.509 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -107.33 163.2 13.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.28 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 66.75 118.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.402 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -58.21 -37.33 74.61 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.185 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -64.91 -41.82 95.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.083 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -65.45 -39.11 91.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.906 0.384 . . . . 0.0 110.448 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.656 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -66.7 -39.51 88.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.727 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 59.6 m -62.06 -47.05 86.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.006 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.6 t -57.38 -53.67 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 61.1 t -60.53 -42.82 92.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.904 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.656 ' SG ' ' O ' ' A' ' 640' ' ' ALA . 74.9 m -56.89 -36.78 70.52 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -62.35 -40.07 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.293 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 16.3 mmt -65.38 -50.25 66.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.962 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 647' ' ' LEU . 10.0 mp -70.35 -45.55 65.88 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.434 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.544 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 48.5 m -55.87 -42.98 76.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.038 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.06 65.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.581 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.42 -11.3 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.18 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.12 -3.88 67.14 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.73 149.24 21.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.647 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -93.36 127.73 39.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.019 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . 0.437 HG21 ' N ' ' A' ' 655' ' ' ILE . 14.5 p -126.52 142.0 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.966 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . 0.437 ' N ' HG21 ' A' ' 654' ' ' VAL . 14.9 mm -103.5 133.67 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.462 ' CD1' ' OE1' ' A' ' 634' ' ' GLU . 16.4 t90 -91.42 112.82 24.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.979 0.418 . . . . 0.0 111.509 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.516 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 3.8 mm? -111.93 138.49 48.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.89 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 35.4 m -110.88 8.51 8.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -150.48 130.82 13.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.51 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . 0.403 ' HA3' ' CD1' ' A' ' 633' ' ' LEU . . . -63.63 -45.09 95.42 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.269 -0.491 . . . . 0.0 111.99 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 19.8 m -60.84 -44.71 96.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 111.117 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.9 m -64.55 -35.15 80.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.04 -43.19 99.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.465 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . 0.554 ' CD2' ' HD1' ' A' ' 692' ' ' HIS . 90.8 mt -59.73 -47.26 86.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.348 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . 0.554 ' OD1' ' C ' ' A' ' 665' ' ' ASP . 0.5 OUTLIER -64.48 -37.55 87.92 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.97 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . 0.544 ' N ' ' OD1' ' A' ' 665' ' ' ASP . 23.8 mt-30 -83.36 -43.77 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.548 ' N ' ' O ' ' A' ' 663' ' ' ALA . 9.8 tt -48.57 -36.46 15.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.48 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -54.62 -39.83 68.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.022 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 73.6 mt -78.3 -27.65 47.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.357 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 15.7 mt -73.06 -38.82 66.33 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.594 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.431 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.4 mm-40 46.35 63.74 9.3 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 74.4 Cg_endo -83.56 152.95 13.54 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 C-N-CA 123.227 2.618 . . . . 0.0 112.61 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 19.5 tt -93.46 -18.75 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.272 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 59.7 t -145.24 137.57 20.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.01 0.434 . . . . 0.0 110.938 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 59.3 mt -126.08 122.49 61.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.011 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 632' ' ' LEU . 4.5 mp -109.66 133.73 52.78 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 76.1 mtm -144.69 133.79 22.76 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.987 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -66.14 154.13 40.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.786 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -117.05 80.45 11.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.78 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -94.7 114.61 0.19 Allowed 'Trans proline' 0 C--N 1.31 -1.489 0 C-N-CA 123.426 2.751 . . . . 0.0 112.142 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.578 ' C ' ' H ' ' A' ' 683' ' ' ASP . 20.3 Cg_exo -53.79 -42.59 65.1 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.207 1.938 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.599 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 31.9 Cg_exo -52.73 -5.17 0.17 Allowed 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.02 1.813 . . . . 0.0 111.033 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.599 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 83.2 m-20 -150.44 73.67 1.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.874 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.16 8.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.629 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 685' ' ' SER . . . . . 0.579 ' H ' ' C ' ' A' ' 683' ' ' ASP . 43.8 m -59.75 -27.47 66.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.806 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 85.6 m -57.01 -23.19 44.49 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.539 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 82.0 mt -63.76 -32.92 74.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.363 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.495 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 0.7 OUTLIER -69.68 -36.28 75.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.468 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.495 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 0.2 OUTLIER -61.63 -43.24 99.23 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.462 ' N ' HD21 ' A' ' 690' ' ' LEU . 3.8 mm? -60.83 -36.87 80.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.01 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -60.05 -43.55 95.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.763 ' HE2' ' HE2' ' A' ' 696' ' ' HIS . 15.5 t-80 -59.15 -49.75 76.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.511 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.14 -40.38 70.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.29 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -61.99 -33.8 74.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.985 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -67.08 -33.78 76.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.416 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.763 ' HE2' ' HE2' ' A' ' 692' ' ' HIS . 96.1 m-70 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.626 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo . . . . . 0 N--CA 1.489 1.245 0 N-CA-C 111.576 -0.202 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.81 146.2 23.36 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.798 2.332 . . . . 0.0 113.201 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.464 ' CD1' ' N ' ' A' ' 704' ' ' LEU . 6.4 mp -81.5 143.89 31.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.659 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.42 HG23 ' CZ ' ' A' ' 707' ' ' PHE . 12.3 p -133.25 137.89 52.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.53 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.575 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 3.3 mp -119.37 135.56 54.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.25 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . 0.42 ' CZ ' HG23 ' A' ' 705' ' ' VAL . 95.3 m-85 -117.88 131.5 56.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.689 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 54.6 mt -99.89 142.52 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.805 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 110.71 -140.85 16.16 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -87.09 152.95 53.92 Favored Pre-proline 0 C--N 1.328 -0.326 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.523 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -74.19 153.1 45.85 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.547 2.165 . . . . 0.0 112.482 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . 0.454 ' HD2' ' HG1' ' A' ' 718' ' ' THR . 47.1 Cg_exo -48.38 162.4 0.33 Allowed 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.757 2.305 . . . . 0.0 112.863 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 2.2 t -84.46 16.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.056 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.63 148.21 11.27 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.983 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.83 -10.76 23.46 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.766 2.311 . . . . 0.0 112.958 -178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . 0.672 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 0.9 OUTLIER -70.58 -37.34 73.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.5 -179.63 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 48.1 mt -78.09 -38.8 43.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 718' ' ' THR . . . . . 0.454 ' HG1' ' HD2' ' A' ' 712' ' ' PRO . 86.7 m -63.8 -40.61 97.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.852 178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.91 89.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.24 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -76.57 -25.36 53.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.357 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.4 146.69 48.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 19.0 t -85.38 -27.36 25.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.669 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -169.84 154.77 5.45 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.165 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 39.0 mt -148.98 120.03 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.063 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 25.4 mt -104.23 115.12 29.84 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.784 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 8.8 m -70.08 -36.65 75.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.663 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -134.74 96.38 14.9 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -48.11 133.53 23.95 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.282 1.988 . . . . 0.0 111.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 16.6 tp -176.39 138.53 0.31 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.446 ' C ' ' H ' ' A' ' 732' ' ' GLN . 29.6 m-20 62.06 75.69 0.42 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.734 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.54 -9.3 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.715 2.277 . . . . 0.0 111.77 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 730' ' ' ASP . 93.1 mt-30 -69.89 -35.79 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 32.6 tp -67.3 -39.75 85.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 13.0 tp -57.32 -41.04 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.05 -38.95 93.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.752 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 71.9 m -59.2 -46.83 87.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.968 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.8 m -63.43 -41.68 98.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.583 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 9.8 tt -63.32 -37.92 89.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.106 0.479 . . . . 0.0 110.045 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 741' ' ' LEU . 6.7 tt0 -64.84 -30.43 71.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.797 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.42 -5.06 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.16 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.674 ' N ' ' O ' ' A' ' 739' ' ' GLN . 19.1 tp . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.194 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.637 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -88.13 163.59 16.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.754 0.311 . . . . 0.0 110.538 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 65.4 mt -111.58 141.74 26.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.959 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . 0.555 ' C ' ' CD1' ' A' ' 631' ' ' LEU . 2.8 tm? -110.96 123.75 50.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.309 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.481 ' N ' HD12 ' A' ' 631' ' ' LEU . 10.2 tt -123.1 126.66 47.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.993 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 41.8 tp -111.13 117.08 32.29 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.483 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 84.2 tt0 -159.7 159.91 33.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.729 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.599 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 84.7 tt0 -106.91 141.08 38.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.382 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.599 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 28.6 tp10 93.23 115.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.443 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.7 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 57.3 p30 -63.6 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.7 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 49.5 tp10 -63.81 -47.2 81.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.941 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.37 -43.51 66.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.977 0.418 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.466 ' HB3' ' CG ' ' A' ' 656' ' ' TRP . . . -65.14 -40.49 94.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.128 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.585 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 90.3 m -61.73 -45.35 94.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.924 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 52.1 t -55.89 -52.0 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.237 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.53 -46.7 95.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.726 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.456 ' O ' ' OG1' ' A' ' 648' ' ' THR . 72.6 m -69.36 -32.99 72.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.015 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 641' ' ' THR . 85.0 tt0 -60.23 -43.48 96.01 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.575 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 73.6 mtp -71.25 -40.73 70.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.367 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 83.1 mt -67.84 -45.45 74.6 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.958 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.456 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 30.0 m -56.16 -42.59 77.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.72 -31.07 69.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.492 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -75.7 -1.97 27.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.535 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 84.64 10.42 79.42 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -94.92 136.14 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.439 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -95.82 121.52 37.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.933 0.396 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 13.0 p -136.6 140.24 43.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.313 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.47 128.69 65.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.466 ' CG ' ' HB3' ' A' ' 640' ' ' ALA . 26.3 t90 -95.38 117.64 30.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.342 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 69.2 mt -118.69 150.79 39.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.542 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 14.5 p -103.91 7.36 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.267 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.8 t0 -148.09 119.98 8.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -55.78 -35.85 64.15 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 37.5 m -58.88 -40.42 84.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.881 0.372 . . . . 0.0 110.467 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 53.2 m -63.76 -38.66 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.872 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.581 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -62.31 -40.27 95.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.973 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 60.7 mt -59.94 -37.58 79.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.636 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -63.04 -44.59 95.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.319 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -90.38 -41.68 11.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.623 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.5 tt -47.0 -46.02 21.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.27 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -61.85 -35.19 77.54 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.488 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 45.1 mt -76.97 -44.21 32.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.237 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.41 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.9 OUTLIER -83.55 -12.83 55.67 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.629 -178.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.41 ' C ' ' O ' ' A' ' 670' ' ' LEU . 37.4 mm-40 40.09 74.36 0.72 Allowed Pre-proline 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.35 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.449 ' CD ' ' HG ' ' A' ' 667' ' ' LEU . 56.2 Cg_endo -73.14 150.79 48.54 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.909 2.406 . . . . 0.0 112.448 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 27.5 pt -95.3 -12.13 8.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.461 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 88.4 t -140.13 134.77 36.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.304 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.3 mt -128.7 124.91 62.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.982 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.3 mp -103.38 143.59 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.932 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.482 ' CE ' ' HG ' ' A' ' 686' ' ' CYS . 80.3 mtp -139.12 116.25 11.03 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.002 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.72 146.19 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.003 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.706 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 20.6 t-105 -118.22 -35.67 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.74 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.706 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 26.0 Cg_exo -54.0 -42.54 65.96 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.252 1.968 . . . . 0.0 113.053 -179.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.511 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 74.1 Cg_endo -84.47 157.26 12.48 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.312 2.008 . . . . 0.0 112.07 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -48.54 -81.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.702 2.268 . . . . 0.0 111.528 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' A' ' 686' ' ' CYS . 85.4 m-20 53.35 57.13 6.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.587 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -53.67 -32.0 49.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.891 0.377 . . . . 0.0 110.26 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 17.3 m -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.212 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.482 ' HG ' ' CE ' ' A' ' 677' ' ' MET . 4.5 t -57.19 -29.55 63.79 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.286 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.88 -38.16 88.06 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.751 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.539 ' CD1' ' C ' ' A' ' 688' ' ' LEU . 0.4 OUTLIER -70.45 -37.89 74.4 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.468 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.499 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 9.7 tp -60.07 -41.56 92.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.552 ' C ' ' CD1' ' A' ' 690' ' ' LEU . 3.1 tm? -59.72 -42.73 93.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.515 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -60.29 -43.33 96.37 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.821 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -59.29 -51.65 69.03 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.085 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 74.2 mt -54.24 -43.33 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.275 0.56 . . . . 0.0 109.822 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -65.31 -30.56 71.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.106 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 696' ' ' HIS . 40.6 tp10 -65.3 -50.96 63.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.441 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.511 ' CD2' ' O ' ' A' ' 696' ' ' HIS . 0.6 OUTLIER . . . . . 0 N--CA 1.463 0.214 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.72 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo . . . . . 0 N--CA 1.491 1.367 0 CA-C-O 120.751 0.229 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -47.17 155.01 1.13 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.938 2.426 . . . . 0.0 111.861 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.43 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 34.0 mt -76.69 146.53 38.01 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 13.7 p -123.74 135.72 62.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.22 0.533 . . . . 0.0 110.931 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.554 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 4.3 mp -122.16 138.14 54.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.654 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -107.3 130.08 54.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.908 0.385 . . . . 0.0 110.188 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . 0.637 ' CD1' ' N ' ' A' ' 709' ' ' GLY . 0.1 OUTLIER -94.9 136.88 34.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.392 -179.711 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . 0.637 ' N ' ' CD1' ' A' ' 708' ' ' LEU . . . 99.62 -132.74 11.04 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -90.01 149.39 41.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.886 0.374 . . . . 0.0 110.67 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.75 151.27 45.98 Favored 'Trans proline' 0 C--N 1.307 -1.626 0 C-N-CA 122.866 2.378 . . . . 0.0 112.158 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.53 157.39 41.81 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 122.675 2.25 . . . . 0.0 111.789 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 80.5 t -77.98 -38.54 24.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.795 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -72.73 136.27 80.5 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.562 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -74.76 -12.88 22.09 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 C-N-CA 122.596 2.197 . . . . 0.0 112.495 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.4 mt -70.86 -31.44 68.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 61.4 mt -76.48 -33.71 58.68 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 62.2 m -63.11 -42.48 99.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.885 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.77 91.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.354 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -78.55 -22.63 46.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.729 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.97 138.09 47.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.453 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.43 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 22.2 t -85.56 -26.79 25.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.147 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -169.19 152.43 5.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 69.3 mt -130.11 128.83 65.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.012 0.434 . . . . 0.0 110.642 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.529 ' O ' ' O ' ' A' ' 709' ' ' GLY . 58.1 mt -104.59 149.76 25.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.143 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 55.7 p -165.45 -2.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.81 0.338 . . . . 0.0 110.626 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.07 81.9 69.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.828 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.654 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.5 Cg_exo -49.67 147.99 12.65 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.061 2.507 . . . . 0.0 112.57 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.654 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 15.9 tp 105.5 154.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.945 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.523 ' C ' ' H ' ' A' ' 732' ' ' GLN . 17.3 t0 63.19 62.65 1.71 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . 0.467 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 28.6 Cg_exo -57.44 -0.06 0.3 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.869 2.379 . . . . 0.0 111.868 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.523 ' H ' ' C ' ' A' ' 730' ' ' ASP . 12.1 mm100 -69.91 -29.77 67.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.595 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.66 -45.84 81.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . 0.427 HD13 ' CD2' ' A' ' 706' ' ' LEU . 37.6 tp -58.37 -40.87 83.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.573 178.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.6 -38.72 88.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.265 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 28.3 m -57.76 -40.24 79.27 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 82.9 m -60.96 -40.91 95.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.011 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.63 -38.38 90.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -63.49 -35.19 79.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -62.2 -11.25 31.92 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 53.3 tp . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.992 -179.896 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.58 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -90.89 148.99 22.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.076 0.465 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.6 mm -112.18 134.92 53.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.202 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 632' ' ' LEU . 1.0 OUTLIER -107.44 124.61 50.12 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.237 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 631' ' ' LEU . 9.1 tt -131.33 127.05 36.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.648 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.44 ' CD2' ' SG ' ' A' ' 686' ' ' CYS . 6.7 tt -109.47 116.3 31.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.127 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.499 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 82.9 tt0 -159.97 158.15 30.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.599 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.519 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 22.2 pt-20 -100.5 162.46 12.92 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.519 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.8 tp10 83.56 112.65 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.458 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.686 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 93.2 m-20 -63.9 -36.0 82.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.625 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.414 ' CG ' ' N ' ' A' ' 639' ' ' ALA . 5.3 pt-20 -67.21 -37.33 83.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.138 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . 0.414 ' N ' ' CG ' ' A' ' 638' ' ' GLU . . . -71.29 -45.3 63.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.388 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.416 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -66.89 -35.68 80.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.749 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.527 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 89.5 m -62.29 -48.08 81.49 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.741 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.79 -47.43 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.147 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 57.4 t -61.07 -42.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.581 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.578 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.8 OUTLIER -62.43 -45.64 92.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -61.78 -38.38 87.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.905 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.96 -52.34 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.796 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . 0.458 HD11 ' N ' ' A' ' 647' ' ' LEU . 8.0 mp -68.46 -46.42 69.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.961 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.578 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.0 m -55.66 -39.86 71.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.773 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.24 -29.36 68.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.776 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -79.33 -3.18 44.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.02 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.71 -10.11 68.61 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . 0.402 ' CD2' HD11 ' A' ' 738' ' ' LEU . 81.9 m-85 -94.46 130.02 40.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -94.71 133.33 38.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.402 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . 0.522 ' CG1' ' SG ' ' A' ' 644' ' ' CYS . 9.0 p -131.0 140.88 47.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.194 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 11.5 mm -103.01 134.02 45.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.686 ' CH2' ' OD1' ' A' ' 637' ' ' ASP . 9.5 t90 -93.21 115.11 27.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.65 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 54.3 mt -114.84 141.57 47.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.685 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . 0.606 ' CG2' ' CZ2' ' A' ' 656' ' ' TRP . 40.2 t -98.39 -0.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.777 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.571 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 74.4 m-20 -150.76 146.91 26.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.789 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -69.32 -40.62 80.46 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.104 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 661' ' ' SER . . . . . 0.515 ' HG ' ' N ' ' A' ' 662' ' ' THR . 95.9 p -59.43 -37.93 79.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.718 0.294 . . . . 0.0 111.215 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 662' ' ' THR . . . . . 0.515 ' N ' ' HG ' ' A' ' 661' ' ' SER . 88.5 m -62.17 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 109.787 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.77 -43.21 97.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.005 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.58 -45.51 81.29 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.831 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 88.9 m-20 -64.08 -43.61 94.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.836 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -86.67 -52.6 5.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.091 0.472 . . . . 0.0 111.226 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.617 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.6 tt -45.08 -37.83 4.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.139 -178.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.559 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 21.4 p-10 -56.26 -40.02 73.53 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.047 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . 0.518 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 33.7 mt -79.3 -26.94 42.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 10.6 mt -72.23 -41.95 66.27 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.422 -178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 51.76 67.53 4.04 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.64 159.13 25.18 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.41 2.74 . . . . 0.0 113.369 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 61.1 mt -95.1 -23.37 5.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.988 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 17.3 t -143.54 139.39 26.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.556 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 63.5 mt -124.1 130.89 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.982 0.42 . . . . 0.0 111.539 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.487 ' CD1' ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -105.06 146.11 29.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.699 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.36 119.22 14.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.529 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.95 144.96 54.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.597 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.72 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.8 t-105 -118.16 -32.36 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.72 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.1 Cg_exo -49.33 -41.09 43.6 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.001 1.801 . . . . 0.0 112.769 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 11.0 Cg_exo -67.44 159.43 52.44 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.287 1.991 . . . . 0.0 111.513 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.39 -7.38 1.24 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.518 2.145 . . . . 0.0 111.349 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.642 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 13.6 t70 56.27 -129.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.458 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . 0.642 ' CB ' ' O ' ' A' ' 683' ' ' ASP . 3.3 tm0? 100.84 -78.31 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.372 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 60.5 p -66.88 -26.75 67.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.965 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.44 ' CB ' ' OD2' ' A' ' 683' ' ' ASP . 0.1 OUTLIER -61.25 -22.04 64.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.562 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.9 mt -62.72 -34.41 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.422 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 77.1 mt -67.76 -38.03 82.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.677 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.17 -47.64 84.57 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.03 0.443 . . . . 0.0 110.215 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.435 ' CD1' ' O ' ' A' ' 686' ' ' CYS . 6.5 mp -62.16 -32.88 73.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.62 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -60.29 -41.53 93.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.658 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.796 ' HE2' ' CE1' ' A' ' 696' ' ' HIS . 19.1 t-160 -56.93 -49.53 75.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.45 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 97.0 mt -56.32 -41.31 75.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.691 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -63.18 -39.82 95.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.948 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -69.78 -32.26 70.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.771 -0.371 . . . . 0.0 110.81 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.796 ' CE1' ' HE2' ' A' ' 692' ' ' HIS . 55.1 m170 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.315 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo . . . . . 0 N--CA 1.488 1.165 0 CA-C-O 120.549 0.145 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.85 149.08 32.89 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.579 2.186 . . . . 0.0 112.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.422 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 5.3 mp -78.69 145.98 34.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.963 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 58.6 t -121.61 126.39 74.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.017 0.437 . . . . 0.0 111.087 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 44.6 mt -117.66 140.1 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.396 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -111.92 132.16 54.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 23.9 mt -94.84 148.29 22.46 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.391 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . 0.445 ' O ' ' OG ' ' A' ' 726' ' ' SER . . . 69.63 -119.51 9.21 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.4 148.57 40.79 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.854 0.359 . . . . 0.0 110.851 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.0 161.05 36.3 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.182 2.588 . . . . 0.0 112.937 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.7 154.21 70.61 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 123.252 2.635 . . . . 0.0 111.91 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 92.7 t -79.44 -34.77 16.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.44 127.61 92.71 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.24 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -69.63 -25.12 29.53 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . 0.579 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 3.7 mm? -71.49 -33.89 69.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 85.5 mt -78.13 -36.0 48.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 91.9 m -64.33 -44.91 90.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.919 178.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.05 -36.77 82.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.366 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -77.78 -6.9 55.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.114 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.98 144.27 45.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.245 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.422 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 38.0 m -85.45 -33.47 21.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.443 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.5 131.83 0.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . 0.421 HG23 HD11 ' A' ' 724' ' ' ILE . 78.0 mt -92.8 123.94 45.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.68 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.498 ' C ' ' HG ' ' A' ' 726' ' ' SER . 56.6 mt -109.52 150.91 27.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.657 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 726' ' ' SER . . . . . 0.498 ' HG ' ' C ' ' A' ' 725' ' ' LEU . 0.7 OUTLIER -168.27 -57.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -103.58 145.31 30.38 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.295 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.3 149.39 88.46 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.722 2.281 . . . . 0.0 111.707 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 7.0 tt -177.87 85.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.696 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.634 ' C ' ' H ' ' A' ' 732' ' ' GLN . 39.0 m-20 53.49 86.71 0.16 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.307 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.17 -0.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.568 2.179 . . . . 0.0 111.753 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.634 ' H ' ' C ' ' A' ' 730' ' ' ASP . 97.1 mt-30 -68.12 -28.87 67.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.482 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.46 -44.16 91.97 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.676 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.37 -43.51 92.87 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.73 -39.58 92.05 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.688 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 736' ' ' THR . . . . . 0.459 ' O ' ' N ' ' A' ' 740' ' ' GLY . 58.4 m -60.16 -39.8 87.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.62 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 30.2 m -59.36 -46.15 89.44 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.949 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . 0.402 HD11 ' CD2' ' A' ' 652' ' ' PHE . 87.9 mt -68.03 -50.71 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.981 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -66.94 -27.25 67.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.344 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 736' ' ' THR . . . -49.83 -29.89 14.15 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 741' ' ' LEU . 5.5 mp . . . . . 0 C--N 1.329 -0.292 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.456 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -90.72 136.59 32.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.407 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 74.3 mt -114.93 135.79 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.343 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . 0.417 ' CD2' HD13 ' A' ' 633' ' ' LEU . 8.1 tt -122.46 125.51 45.96 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.519 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.436 ' N ' HD13 ' A' ' 632' ' ' LEU . 4.5 mp -117.28 135.2 54.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.127 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.449 ' HB3' ' SG ' ' A' ' 686' ' ' CYS . 5.0 mp -107.96 111.41 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.65 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.484 ' HA ' HE22 ' A' ' 684' ' ' GLN . 87.2 tt0 -160.05 157.08 28.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.646 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.644 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 94.1 mt-10 -111.07 150.63 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.105 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.644 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 72.8 tt0 103.76 102.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.666 0.604 . . . . 0.0 109.705 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.586 ' O ' ' OG1' ' A' ' 641' ' ' THR . 54.4 t0 -56.19 -36.08 67.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.637 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.706 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.65 -45.49 52.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.937 0.398 . . . . 0.0 110.449 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.444 ' HB3' ' CD1' ' A' ' 656' ' ' TRP . . . -65.2 -38.79 91.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.913 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.586 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.2 m -62.37 -46.48 88.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.844 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 42.1 t -56.24 -53.51 38.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.777 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 76.2 t -59.22 -42.78 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.724 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.579 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.3 m -58.17 -40.86 82.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.16 -38.39 88.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.192 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 12.2 mmm -68.03 -49.14 63.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.279 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.73 -43.08 76.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.973 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.579 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 65.6 m -56.05 -41.32 74.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.787 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.21 70.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.24 -5.39 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.781 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.73 5.98 83.45 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . 0.41 ' CE1' HD12 ' A' ' 735' ' ' LEU . 56.8 m-85 -95.47 135.41 37.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.879 0.371 . . . . 0.0 110.867 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 20.2 tttm -93.78 122.66 36.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.64 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . 0.407 ' HB ' ' CD1' ' A' ' 632' ' ' LEU . 6.2 m -128.31 150.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 111.276 -179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 27.4 mm -114.16 129.87 69.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.005 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.455 ' HE1' ' HB3' ' A' ' 634' ' ' GLU . 1.4 t-105 -96.77 133.86 40.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.88 0.371 . . . . 0.0 111.475 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.457 ' N ' HD21 ' A' ' 657' ' ' LEU . 4.3 mm? -120.12 140.94 50.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.589 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 19.3 m -107.53 6.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.957 0.408 . . . . 0.0 109.975 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.486 ' C ' ' OD1' ' A' ' 659' ' ' ASP . 48.6 p30 -153.36 -168.76 3.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.337 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -113.12 -37.24 1.38 Allowed Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 24.4 m -58.84 -45.77 89.29 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 53.7 m -65.01 -36.71 85.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.228 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.13 -45.9 91.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.797 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 94.4 mt -57.88 -45.08 86.9 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.323 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -63.1 -41.16 99.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.004 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . 0.489 ' CG ' ' N ' ' A' ' 667' ' ' LEU . 19.8 pt20 -94.46 -45.75 7.3 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.561 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.9 tt -48.15 -41.54 27.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.833 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -61.58 -35.27 77.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.701 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 90.1 mt -76.5 -44.2 36.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.194 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' A' ' 671' ' ' GLN . 1.4 pp -81.54 -15.69 54.07 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.866 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 670' ' ' LEU . 2.8 mm-40 37.97 77.99 0.38 Allowed Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.385 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.405 ' HD3' ' CD1' ' A' ' 670' ' ' LEU . 30.9 Cg_endo -69.35 156.98 62.87 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.555 2.17 . . . . 0.0 112.465 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 10.0 mm -93.16 -24.95 5.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.323 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 13.2 p -143.57 142.11 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.371 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.2 mt -127.82 127.27 68.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.101 0.477 . . . . 0.0 111.755 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.36 131.47 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.416 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 65.7 ttp -139.92 127.61 21.79 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.3 152.22 44.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.864 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.418 ' CH2' HD12 ' A' ' 717' ' ' LEU . 32.2 t-105 -124.93 72.09 62.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -87.51 144.37 6.65 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.118 2.545 . . . . 0.0 112.11 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.73 ' O ' ' N ' ' A' ' 683' ' ' ASP . 5.8 Cg_exo -51.25 -50.39 14.09 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.651 2.234 . . . . 0.0 113.26 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 52.8 Cg_exo -38.35 -11.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 122.538 2.159 . . . . 0.0 112.064 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.73 ' N ' ' O ' ' A' ' 681' ' ' PRO . 13.2 t0 73.72 78.15 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . 0.484 HE22 ' HA ' ' A' ' 634' ' ' GLU . 45.4 tt0 -60.35 138.8 57.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.465 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 685' ' ' SER . . . . . 0.442 ' C ' ' H ' ' A' ' 687' ' ' LEU . 38.1 m -62.27 -29.34 70.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.623 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.449 ' SG ' ' HB3' ' A' ' 633' ' ' LEU . 83.7 m -53.59 -14.05 0.77 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . 0.588 ' CD1' ' OD1' ' A' ' 683' ' ' ASP . 47.2 mt -62.65 -32.38 73.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.146 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 56.5 mt -64.26 -39.73 94.53 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.596 ' C ' ' CD1' ' A' ' 689' ' ' LEU . 2.4 tm? -60.22 -44.11 95.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.182 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 19.5 tp -59.22 -39.57 83.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.749 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -60.2 -39.21 85.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.91 0.386 . . . . 0.0 110.064 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.412 ' CD2' ' C ' ' A' ' 692' ' ' HIS . 5.3 t60 -57.51 -50.0 74.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.963 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.92 -35.41 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.576 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . 0.503 ' CZ ' ' CD ' ' A' ' 720' ' ' GLN . 24.4 mmt180 -62.04 -36.76 82.59 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.107 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -68.74 -33.86 74.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.467 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.166 -179.754 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo . . . . . 0 N--CA 1.49 1.274 0 CA-C-O 120.694 0.206 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -63.05 161.16 30.9 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.703 2.269 . . . . 0.0 111.722 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.3 tp -76.63 124.9 28.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.975 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.409 ' H ' ' HB3' ' A' ' 722' ' ' SER . 61.0 t -122.56 132.26 71.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 121.157 0.503 . . . . 0.0 111.874 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 5.2 mp -125.01 145.68 49.78 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.438 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -106.25 123.37 47.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.979 0.418 . . . . 0.0 110.585 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.2 mt -96.76 150.83 20.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.575 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -123.7 6.46 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.04 156.1 46.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -71.05 156.4 59.98 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 123.099 2.533 . . . . 0.0 112.286 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.29 -153.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.898 2.399 . . . . 0.0 111.771 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 1.5 t -145.12 -52.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.498 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.09 145.07 90.83 Favored Pre-proline 0 C--N 1.327 -0.374 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.191 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.53 -17.62 33.96 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.592 2.195 . . . . 0.0 112.437 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 60.7 tp -70.27 -34.98 73.45 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.613 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.494 ' HA ' HH22 ' A' ' 694' ' ' ARG . 71.0 mt -76.38 -37.91 56.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 39.7 m -65.66 -43.0 90.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.261 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.62 -41.12 93.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.465 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.503 ' CD ' ' CZ ' ' A' ' 694' ' ' ARG . 42.7 tt0 -78.37 -22.97 47.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.72 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -72.92 139.47 46.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.56 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.409 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -86.89 -30.27 21.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.63 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.49 124.25 0.69 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.767 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 62.6 mt -91.41 125.56 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.82 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 725' ' ' LEU . 6.9 mp -107.2 147.91 29.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.535 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.1 m -166.89 -3.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.431 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 9.4 tptm -133.24 79.63 61.05 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.328 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.07 141.0 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.794 2.33 . . . . 0.0 112.087 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.3 OUTLIER -179.09 116.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.492 ' O ' ' O ' ' A' ' 729' ' ' LEU . 57.3 t0 56.42 121.2 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.721 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.2 -11.85 30.99 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.327 2.018 . . . . 0.0 112.205 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -71.42 -27.45 63.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.443 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 46.8 tp -66.13 -49.75 66.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.364 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 4.7 mp -58.84 -42.9 90.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.955 0.407 . . . . 0.0 110.079 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . 0.41 HD12 ' CE1' ' A' ' 652' ' ' PHE . 37.0 tp -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.319 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 56.1 m -60.53 -39.66 88.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.637 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 48.9 m -61.5 -44.18 97.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.7 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 39.8 mt -65.59 -37.35 86.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.122 0.486 . . . . 0.0 109.944 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.669 ' O ' ' N ' ' A' ' 741' ' ' LEU . 47.2 tt0 -64.55 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.4 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.96 -6.52 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.478 -0.649 . . . . 0.0 111.478 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.669 ' N ' ' O ' ' A' ' 739' ' ' GLN . 66.1 mt . . . . . 0 C--N 1.329 -0.313 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.543 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.607 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -90.52 128.92 36.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 38.7 mt -118.35 142.9 30.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.753 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 23.6 tp -106.89 133.06 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.407 ' HA ' ' O ' ' A' ' 676' ' ' LEU . 9.3 tt -130.41 120.22 23.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 14.3 tp -107.28 119.25 38.87 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.64 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 87.7 tt0 -159.72 158.33 31.12 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.274 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.653 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.8 tt0 -109.02 133.43 53.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.776 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.653 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 75.3 tt0 105.47 113.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.653 0.596 . . . . 0.0 109.677 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.678 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.8 p30 -61.94 -33.49 74.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.38 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.678 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.6 mt-10 -65.77 -41.54 91.94 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.792 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -76.24 -46.04 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.168 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -62.39 -41.19 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.539 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 87.1 m -63.87 -43.27 96.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.306 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 41.4 t -54.5 -52.76 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.154 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 87.6 t -58.15 -41.82 81.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.523 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.555 ' O ' ' OG1' ' A' ' 648' ' ' THR . 73.0 m -59.91 -39.09 84.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.6 -36.92 84.29 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.098 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 67.9 mmm -68.69 -48.88 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . 0.474 HD11 ' N ' ' A' ' 647' ' ' LEU . 9.5 mp -69.08 -43.31 74.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.555 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 32.1 m -55.58 -41.42 73.32 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.34 -29.68 69.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.28 -5.23 30.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -8.23 70.39 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -97.41 138.34 35.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 15.9 ttmm -92.1 133.11 36.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.947 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 7.1 p -125.6 141.38 45.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.964 0.411 . . . . 0.0 111.195 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 59.6 mt -107.35 129.76 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.921 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.64 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 19.9 t90 -93.85 118.96 32.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.82 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.523 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 2.7 mm? -109.12 143.22 38.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.665 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . 0.591 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 88.5 t -103.95 4.45 10.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.591 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 97.3 m-20 -145.77 121.27 10.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.06 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -57.06 -43.17 93.31 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.271 -0.731 . . . . 0.0 111.271 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 88.5 p -61.34 -40.25 93.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.718 0.294 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 34.0 m -64.1 -38.28 90.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.122 0.487 . . . . 0.0 110.184 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.588 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.75 -44.6 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.458 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.08 -44.72 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.9 0.381 . . . . 0.0 111.161 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -59.24 -41.04 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.568 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . 0.571 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 97.9 mt-30 -86.73 -23.99 25.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.028 0.442 . . . . 0.0 109.99 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 663' ' ' ALA . 2.8 tp -50.44 -45.67 56.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.32 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -62.59 -30.33 71.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.866 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 29.1 mt -73.88 -47.2 39.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.925 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.571 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.82 -17.75 42.88 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.488 -179.467 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 670' ' ' LEU . 12.9 mm-40 41.35 64.16 5.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.931 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -72.38 155.52 55.51 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 123.106 2.537 . . . . 0.0 112.79 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 95.9 mt -93.88 -22.18 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.194 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . 0.417 ' CG1' ' CD1' ' A' ' 706' ' ' LEU . 22.0 t -138.41 136.44 44.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.475 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . 0.408 HG21 ' SD ' ' A' ' 677' ' ' MET . 75.6 mt -120.98 123.31 69.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.579 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.407 ' O ' ' HA ' ' A' ' 632' ' ' LEU . 5.5 mp -106.9 128.52 54.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.449 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.421 ' HE2' ' CD1' ' A' ' 693' ' ' LEU . 1.7 mpp? -141.02 141.17 34.36 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.259 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.2 153.91 39.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.749 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.755 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 57.9 t-105 -99.56 -25.59 0.23 Allowed Pre-proline 0 C--N 1.328 -0.341 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.872 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 2.8 Cg_exo -70.29 149.18 63.11 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 121.893 1.729 . . . . 0.0 110.316 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.77 110.66 2.95 Favored 'Trans proline' 0 C--N 1.301 -1.938 0 C-N-CA 122.447 2.098 . . . . 0.0 112.444 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.583 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 62.0 Cg_endo -91.76 -33.14 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.899 2.4 . . . . 0.0 111.487 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.583 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 81.7 m-20 -157.01 -81.05 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 179.72 -25.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.768 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 22.7 t -64.18 -33.74 76.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -59.99 -33.81 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.79 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . 0.465 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 80.9 mt -66.76 -39.22 87.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.897 0.379 . . . . 0.0 110.554 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.573 ' CD1' ' C ' ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.96 -34.64 73.67 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.474 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 9.7 tt -58.83 -41.66 87.4 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 49.9 tp -59.68 -43.06 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.092 179.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.02 -42.96 99.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.796 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -57.91 -48.05 81.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.384 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . 0.421 ' CD1' ' HE2' ' A' ' 677' ' ' MET . 91.8 mt -55.53 -37.77 68.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.969 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -63.19 -40.52 97.75 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.778 -0.369 . . . . 0.0 110.909 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.72 -33.61 74.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.68 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.713 179.898 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo . . . . . 0 N--CA 1.489 1.212 0 CA-C-O 120.537 0.141 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.07 150.39 42.93 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.457 2.105 . . . . 0.0 111.919 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 737' ' ' THR . 52.5 mt -78.15 138.72 38.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 29.4 t -115.99 129.33 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.095 0.474 . . . . 0.0 111.323 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.446 ' N ' HD13 ' A' ' 706' ' ' LEU . 4.5 mp -117.07 136.63 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.659 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -110.86 137.08 48.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.125 0.488 . . . . 0.0 111.77 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 56.6 mt -96.63 156.4 16.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.452 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -140.03 17.9 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.72 150.07 47.46 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.965 0.412 . . . . 0.0 110.983 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.76 146.08 33.26 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.966 2.444 . . . . 0.0 112.582 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . 0.403 ' HA ' ' CE2' ' A' ' 679' ' ' TRP . 36.7 Cg_exo -50.85 154.26 7.26 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.216 1.944 . . . . 0.0 111.178 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 54.2 t -77.7 -42.89 29.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.488 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -72.96 137.76 79.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.21 -13.48 18.94 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.391 2.061 . . . . 0.0 112.322 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.94 -36.53 75.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.802 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 80.1 mt -75.48 -34.23 60.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 91.6 m -63.79 -43.46 96.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.082 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.24 -37.35 86.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.603 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -73.26 -27.28 61.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.184 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.16 149.29 46.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.396 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.452 ' HG ' ' HB3' ' A' ' 704' ' ' LEU . 8.1 t -85.65 -31.15 22.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.235 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -172.28 160.52 5.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.476 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.3 mt -147.1 120.99 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.707 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.5 mt -112.94 129.52 56.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.804 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 14.8 m -68.12 -40.48 82.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.058 0.456 . . . . 0.0 109.947 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.81 145.23 27.08 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.011 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 129.57 30.16 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.243 1.962 . . . . 0.0 111.651 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.443 ' HG ' ' N ' ' A' ' 730' ' ' ASP . 34.8 tp -179.5 149.8 0.4 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.443 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 2.4 m-20 57.66 68.02 2.12 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.761 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.31 -15.7 8.73 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.923 2.415 . . . . 0.0 112.052 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -69.86 -33.35 72.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.257 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 25.4 tp -67.05 -42.36 84.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.965 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 43.1 tp -56.45 -43.97 80.03 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.037 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.46 -39.64 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.22 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.8 m -59.05 -40.41 85.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 737' ' ' THR . . . . . 0.494 ' O ' ' CD1' ' A' ' 704' ' ' LEU . 73.4 m -63.35 -39.92 95.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.126 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . 0.431 ' CD2' ' C ' ' A' ' 738' ' ' LEU . 7.3 tt -63.97 -47.78 79.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.357 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.633 ' C ' ' H ' ' A' ' 741' ' ' LEU . 2.8 pt20 -69.14 -22.34 63.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.91 0.15 0.06 OUTLIER Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.633 ' H ' ' C ' ' A' ' 739' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 120.844 0.354 . . . . 0.0 110.486 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -90.25 133.21 35.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.971 0.415 . . . . 0.0 111.029 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . 0.46 HG21 ' N ' ' A' ' 631' ' ' LEU . 63.8 mt -118.29 141.96 35.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.914 179.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . 0.46 ' N ' HG21 ' A' ' 630' ' ' ILE . 1.2 tp -106.06 129.09 54.23 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.44 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 9.6 tt -134.33 120.58 20.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.751 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 8.3 tt -108.43 120.09 41.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.913 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.524 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 81.7 tt0 -159.78 161.21 34.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.535 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.601 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 93.9 mt-10 -113.55 155.73 24.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.19 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.601 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.4 tp10 91.65 113.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.889 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -58.15 -38.23 76.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.145 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.486 ' O ' ' CG2' ' A' ' 642' ' ' VAL . 76.3 mm-40 -66.88 -41.44 87.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.118 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -76.23 -45.15 34.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.811 0.339 . . . . 0.0 110.948 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.9 -46.2 82.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.05 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 58.4 m -63.63 -44.46 93.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.486 ' CG2' ' O ' ' A' ' 638' ' ' GLU . 41.1 t -55.86 -52.88 44.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.802 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 70.7 t -60.29 -44.42 95.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.53 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.5 OUTLIER -62.55 -37.32 85.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.745 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . 0.486 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 84.2 tt0 -62.37 -39.46 93.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.688 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 43.0 tpp -67.92 -50.31 56.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.722 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . 0.487 ' CD1' ' N ' ' A' ' 647' ' ' LEU . 7.9 mp -68.57 -44.74 73.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.551 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.53 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 62.5 m -56.26 -43.46 78.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.021 0.438 . . . . 0.0 109.975 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.36 -23.74 63.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.54 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.25 -3.07 21.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.53 -9.81 69.04 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -95.31 138.55 32.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 110.604 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.27 129.74 38.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.134 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 9.5 p -129.12 138.7 53.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 3.1 mp -106.37 131.36 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.921 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.524 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 16.0 t90 -90.56 122.22 33.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.11 -178.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.507 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 3.5 mm? -111.06 140.31 45.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.712 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . 0.57 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 1.5 t -109.35 5.71 9.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.319 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.57 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 62.9 m-20 -147.34 137.72 23.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.357 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -65.17 -46.7 86.92 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 21.4 m -60.05 -38.37 82.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 110.956 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 46.4 m -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.502 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.524 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.017 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 39.1 mt -59.05 -40.33 84.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.901 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . 0.582 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 86.3 m-20 -62.37 -42.33 99.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.161 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . 0.569 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 88.4 mt-30 -87.84 -36.23 17.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.931 0.396 . . . . 0.0 110.92 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 663' ' ' ALA . 0.8 OUTLIER -48.54 -44.44 36.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.995 -179.614 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.582 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 50.7 p-10 -63.71 -32.02 73.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.383 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . 0.546 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 81.4 mt -72.39 -46.71 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.91 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.569 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.87 -15.76 50.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.798 -179.121 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.454 ' NE2' ' HA ' ' A' ' 671' ' ' GLN . 3.5 mm-40 40.72 61.1 7.21 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.1 0.476 . . . . 0.0 110.111 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.06 151.76 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.352 2.701 . . . . 0.0 112.447 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 7.0 pt -95.94 -11.54 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 63.6 t -138.68 135.2 43.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.458 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 67.0 mt -127.85 124.16 62.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.809 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.5 mp -102.74 138.03 40.18 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.454 ' HE3' ' SG ' ' A' ' 686' ' ' CYS . 74.1 mtp -139.27 134.38 32.56 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.086 -0.646 . . . . 0.0 111.623 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . 0.431 ' C ' ' OD2' ' A' ' 683' ' ' ASP . . . -67.71 150.84 48.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.594 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.75 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 25.2 t-105 -115.03 -21.03 0.11 Allowed Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 66.2 Cg_exo -47.74 158.67 0.7 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.859 1.706 . . . . 0.0 112.104 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.68 ' C ' ' H ' ' A' ' 683' ' ' ASP . 2.5 Cg_endo -50.2 -54.85 4.77 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.894 2.396 . . . . 0.0 113.402 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 2.1 Cg_endo -49.17 0.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.059 1.839 . . . . 0.0 111.945 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.68 ' H ' ' C ' ' A' ' 681' ' ' PRO . 84.8 m-20 -82.48 45.5 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.822 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -58.65 -38.45 78.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.103 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 59.8 p -67.35 -30.09 69.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.104 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.454 ' SG ' ' HE3' ' A' ' 677' ' ' MET . 25.2 t -62.06 -25.13 67.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.149 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 77.2 mt -66.19 -39.66 89.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.752 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.488 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 1.2 pp -72.75 -43.26 63.13 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.717 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.488 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 0.5 OUTLIER -61.49 -41.23 96.96 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.61 -42.16 92.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.601 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.51 -40.54 94.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.227 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.746 ' CE1' ' HE2' ' A' ' 696' ' ' HIS . 5.8 t60 -57.83 -47.51 82.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.263 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 44.8 mt -54.68 -39.81 68.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -63.34 -34.13 77.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.142 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.2 -31.46 71.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.746 ' HE2' ' CE1' ' A' ' 692' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.157 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo . . . . . 0 N--CA 1.491 1.328 0 CA-C-O 120.747 0.228 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.73 152.62 34.01 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.664 2.243 . . . . 0.0 112.197 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.42 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 29.2 mt -76.87 139.09 40.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.286 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 722' ' ' SER . 16.9 t -122.94 130.98 74.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.12 0.486 . . . . 0.0 111.554 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.479 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 4.6 mp -119.23 138.96 52.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.996 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -108.93 126.8 53.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.918 0.39 . . . . 0.0 110.89 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.9 mt -97.46 145.91 25.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.308 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 97.77 -127.64 9.29 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.825 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . 0.52 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.1 OUTLIER -87.15 153.99 54.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.993 0.425 . . . . 0.0 111.245 -178.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.02 161.99 24.18 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.916 2.411 . . . . 0.0 112.425 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -62.85 151.03 86.38 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 123.39 2.727 . . . . 0.0 112.683 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . 0.544 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.7 t -86.91 16.15 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.381 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.5 OUTLIER -161.81 143.24 8.41 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.0 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.41 -20.43 31.8 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.643 2.228 . . . . 0.0 111.881 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 84.8 mt -70.06 -34.08 72.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 59.6 tp -75.5 -35.18 60.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.692 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 57.3 m -62.6 -41.55 99.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 178.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.9 92.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.094 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -75.11 -28.54 60.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.14 144.58 51.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.598 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.612 ' N ' ' O ' ' A' ' 705' ' ' VAL . 32.7 t -86.16 -27.28 24.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.443 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 122.88 0.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.837 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 28.8 mm -89.55 122.83 41.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.53 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 5.0 mp -109.05 146.21 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.971 0.415 . . . . 0.0 110.796 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.6 p -167.93 -22.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.954 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.67 81.03 64.95 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.665 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -46.22 122.53 5.56 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.751 2.301 . . . . 0.0 112.453 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 24.2 tp 179.2 141.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.569 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 60.94 68.75 1.2 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.915 0.388 . . . . 0.0 110.718 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -51.91 -1.32 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.955 2.436 . . . . 0.0 112.027 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.569 ' H ' ' C ' ' A' ' 730' ' ' ASP . 1.4 pt20 -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.866 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . 0.411 ' N ' ' HG3' ' A' ' 732' ' ' GLN . 22.4 tp -64.91 -45.84 84.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.085 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.0 tp -57.98 -48.0 81.3 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.42 -41.86 93.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 736' ' ' THR . . . . . 0.516 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 64.6 m -59.83 -40.51 88.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.621 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 737' ' ' THR . . . . . 0.52 ' CG2' ' HG ' ' A' ' 722' ' ' SER . 41.7 m -61.08 -45.77 93.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.97 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.9 -41.73 86.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.091 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.466 ' C ' ' H ' ' A' ' 741' ' ' LEU . 72.4 tp60 -64.53 -35.92 82.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.317 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.76 -11.35 1.98 Allowed Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.466 ' H ' ' C ' ' A' ' 739' ' ' GLN . 24.3 tp . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 120.88 0.372 . . . . 0.0 110.32 179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.658 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -92.94 134.31 35.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.707 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 2.4 mp -115.42 139.8 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.297 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . 0.491 ' C ' ' CD1' ' A' ' 632' ' ' LEU . 8.4 tt -112.51 129.59 56.29 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.621 -0.431 . . . . 0.0 110.596 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.62 ' CD1' ' N ' ' A' ' 632' ' ' LEU . 0.0 OUTLIER -130.99 122.29 26.58 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.732 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.479 ' CD2' ' C ' ' A' ' 633' ' ' LEU . 7.0 tt -108.32 125.28 51.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.963 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.457 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 94.0 mt-10 -158.4 170.24 22.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.069 0.461 . . . . 0.0 110.909 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.561 ' OE2' ' O ' ' A' ' 682' ' ' PRO . 95.8 mt-10 -114.76 162.11 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.987 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 69.59 123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.34 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.58 ' O ' ' OG1' ' A' ' 641' ' ' THR . 90.9 m-20 -58.83 -34.4 71.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.185 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -63.64 -42.05 98.17 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.064 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.46 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.812 0.339 . . . . 0.0 110.888 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.444 ' HB1' ' NE1' ' A' ' 656' ' ' TRP . . . -65.87 -39.68 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.049 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.58 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 54.3 m -62.84 -45.07 94.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.064 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 52.8 t -56.7 -52.56 52.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.896 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 57.4 t -60.22 -46.28 94.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.581 ' O ' ' OG1' ' A' ' 648' ' ' THR . 96.1 m -66.99 -36.8 82.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -61.67 -38.28 87.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.477 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.3 mtt -68.36 -50.61 51.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.29 -43.63 77.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.625 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.581 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 41.1 m -56.17 -41.55 75.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.34 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.1 73.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.74 -1.81 17.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.542 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 82.4 10.63 83.26 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -91.43 140.39 29.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -93.52 120.32 33.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 5.7 m -129.0 150.42 34.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.941 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . 0.522 ' O ' ' CD2' ' A' ' 632' ' ' LEU . 24.1 mm -111.8 127.12 69.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.888 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.444 ' NE1' ' HB1' ' A' ' 640' ' ' ALA . 32.6 t90 -93.76 118.54 31.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.997 0.427 . . . . 0.0 111.285 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -115.59 144.51 43.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.456 179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 9.7 p -113.8 12.08 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -147.49 123.6 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.414 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -61.11 -43.89 98.85 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 17.6 t -59.69 -48.68 80.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 110.931 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.9 m -64.27 -38.02 89.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.03 -43.38 98.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.946 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 87.1 mt -58.57 -43.4 89.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.712 0.292 . . . . 0.0 111.09 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.8 -40.89 96.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.056 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -86.29 -41.99 14.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 663' ' ' ALA . 9.3 tt -47.68 -38.14 14.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.423 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 62.6 t0 -56.54 -37.09 70.02 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 60.8 mt -77.71 -30.31 51.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.605 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 16.2 mt -72.04 -36.16 69.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.558 -178.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.457 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 32.7 mm-40 46.68 62.4 11.66 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -178.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.457 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 66.3 Cg_endo -81.67 156.03 18.42 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 123.37 2.713 . . . . 0.0 112.957 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 81.0 mt -96.54 -23.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.681 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 48.7 t -138.65 139.11 41.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.903 0.383 . . . . 0.0 110.75 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 72.0 mt -128.6 123.44 59.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.588 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 676' ' ' LEU . 7.9 mp -105.67 131.98 52.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.2 mtm -138.06 138.68 39.02 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.527 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . 0.538 ' C ' ' OD2' ' A' ' 683' ' ' ASP . . . -65.91 151.1 47.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.64 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.736 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 74.5 t-105 -113.43 -21.99 0.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.265 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 92.1 Cg_exo -44.48 159.93 0.11 Allowed 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.698 1.599 . . . . 0.0 111.388 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.626 ' C ' ' H ' ' A' ' 683' ' ' ASP . 13.9 Cg_exo -52.24 -45.61 38.17 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.099 1.866 . . . . 0.0 112.677 -178.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.561 ' O ' ' OE2' ' A' ' 635' ' ' GLU . 31.3 Cg_exo -49.3 -8.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 121.734 1.622 . . . . 0.0 110.626 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.626 ' H ' ' C ' ' A' ' 681' ' ' PRO . 74.7 m-20 -83.42 24.67 0.81 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.831 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.35 -40.84 65.24 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.359 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 93.0 p -69.14 -35.41 76.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.458 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.433 ' SG ' HD21 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -62.35 -19.11 63.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.008 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.14 -32.99 74.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.772 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . 0.493 ' HG ' ' H ' ' A' ' 689' ' ' LEU . 1.6 pp -70.09 -44.1 69.73 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.725 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.493 ' H ' ' HG ' ' A' ' 688' ' ' LEU . 8.0 tt -60.68 -41.4 95.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 61.1 tp -60.39 -36.1 77.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.156 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -59.98 -45.03 94.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.834 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -57.66 -50.6 72.63 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.448 -0.501 . . . . 0.0 109.949 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.8 mt -56.17 -34.92 66.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.379 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -60.57 -40.79 92.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.5 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.28 -31.86 70.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.985 0.421 . . . . 0.0 110.172 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.519 179.782 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_exo . . . . . 0 N--CA 1.49 1.275 0 CA-C-O 121.023 0.343 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.92 158.77 36.72 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 123.069 2.512 . . . . 0.0 112.466 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 3.6 mp -77.12 149.67 35.66 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.493 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.51 ' N ' ' HG ' ' A' ' 722' ' ' SER . 35.7 t -114.86 129.22 71.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.352 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 5.7 mp -121.7 136.49 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.124 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . 0.44 ' CZ ' HG13 ' A' ' 705' ' ' VAL . 97.6 m-85 -111.61 127.88 55.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.398 . . . . 0.0 111.186 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 72.7 mt -97.16 148.38 23.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.496 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 106.88 -132.36 11.1 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -89.88 175.18 4.03 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.382 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -82.53 135.71 8.23 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.742 2.295 . . . . 0.0 112.414 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . 0.406 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 37.6 Cg_exo -51.31 150.81 14.17 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.114 1.876 . . . . 0.0 111.59 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.82 -39.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.687 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 132.14 81.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.497 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -72.19 -28.39 15.62 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.267 1.978 . . . . 0.0 111.818 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 72.1 mt -72.05 -28.84 63.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.573 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.549 ' CD2' ' CH2' ' A' ' 679' ' ' TRP . 40.4 tp -75.19 -42.82 54.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.858 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 57.3 m -64.6 -45.32 87.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.047 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.66 84.2 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.515 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -77.73 -17.46 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.455 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.97 147.71 48.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.425 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.51 ' HG ' ' N ' ' A' ' 705' ' ' VAL . 62.9 p -83.19 -25.08 32.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.135 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.8 157.98 4.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.563 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 70.1 mt -148.65 123.33 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.395 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 46.7 mt -102.59 147.85 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.44 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.4 p -167.59 -16.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.724 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -132.07 78.26 69.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.613 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -54.03 147.81 41.72 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.636 2.224 . . . . 0.0 111.74 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 6.2 tp -178.11 -38.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.159 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.665 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 -142.98 82.29 12.16 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.15 0.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.856 2.371 . . . . 0.0 111.669 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.665 ' H ' ' C ' ' A' ' 730' ' ' ASP . 90.5 mt-30 -69.56 -29.98 67.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.666 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.48 78.07 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 13.5 tp -57.85 -46.41 84.85 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 88.4 mt -63.98 -40.48 96.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.002 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 736' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 28.6 m -59.6 -39.2 83.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 27.4 m -62.31 -47.63 83.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.016 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.18 -41.01 90.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.859 0.362 . . . . 0.0 110.573 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -64.0 -28.08 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.101 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.59 -44.84 12.09 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 58.9 mt . . . . . 0 C--N 1.329 -0.296 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.222 179.233 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.648 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -93.57 134.39 35.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.875 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . 0.411 ' CG2' ' CD1' ' A' ' 676' ' ' LEU . 67.1 mt -118.38 138.82 47.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.12 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . 0.605 ' C ' ' CD1' ' A' ' 631' ' ' LEU . 3.2 tm? -110.06 124.05 50.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.64 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.446 ' N ' HD12 ' A' ' 631' ' ' LEU . 20.3 tp -113.26 122.1 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.726 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.458 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 17.6 tp -108.67 117.97 35.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.458 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 94.4 mt-10 -158.76 172.2 18.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.531 -178.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 636' ' ' GLU . 48.8 tp10 -106.82 152.44 23.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.127 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.449 ' N ' ' HG3' ' A' ' 635' ' ' GLU . 83.5 tt0 69.29 127.11 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.018 0.437 . . . . 0.0 110.543 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.689 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.4 p30 -66.25 -33.66 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.489 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.689 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.7 mt-10 -66.18 -42.24 89.17 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.82 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.63 -45.42 62.1 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.864 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.458 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -64.96 -40.91 95.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.917 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.582 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 32.3 m -62.58 -43.72 98.12 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.631 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 84.0 t -53.78 -49.23 59.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.872 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.8 t -58.82 -42.85 86.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.009 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.582 ' O ' ' OG1' ' A' ' 648' ' ' THR . 99.2 m -64.9 -36.61 84.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.369 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -62.06 -38.42 88.73 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.957 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 64.7 mtt -68.58 -47.89 65.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.32 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . 0.591 ' CD2' ' N ' ' A' ' 647' ' ' LEU . 1.6 mm? -69.48 -43.99 72.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.119 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.582 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.8 m -56.09 -40.51 73.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.867 179.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.8 72.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.555 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.95 -4.76 37.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.14 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.76 -0.36 60.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -93.57 141.7 28.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 0.0 110.648 179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -91.83 122.06 34.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.96 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . 0.434 HG13 ' HG ' ' A' ' 644' ' ' CYS . 23.1 t -120.11 135.48 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.183 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 63.4 mt -110.67 131.69 61.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.138 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.458 ' CD1' ' HB1' ' A' ' 640' ' ' ALA . 13.8 t90 -95.15 120.17 34.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.381 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.448 ' N ' HD21 ' A' ' 657' ' ' LEU . 3.3 mm? -116.16 135.13 54.2 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.483 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . 0.58 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 0.2 OUTLIER -100.41 2.54 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.295 179.629 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.58 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 80.1 m-20 -146.69 162.12 39.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.107 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -87.28 -48.75 4.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.768 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 t -57.57 -41.25 80.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.741 0.305 . . . . 0.0 111.054 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 50.6 m -62.84 -37.13 85.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.192 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.49 -40.09 96.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.818 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 39.0 mt -60.01 -43.14 95.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.016 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -63.08 -39.26 94.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -88.43 -49.92 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.391 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.4 tt -46.28 -42.67 14.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.332 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.55 -33.38 73.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.758 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 66.6 mt -74.23 -45.06 50.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.731 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.413 ' O ' ' C ' ' A' ' 671' ' ' GLN . 1.0 OUTLIER -83.19 -18.01 40.81 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 670' ' ' LEU . 76.9 mm-40 40.87 78.49 0.37 Allowed Pre-proline 0 C--N 1.33 -0.278 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.105 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.44 153.36 39.67 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 122.858 2.372 . . . . 0.0 112.774 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 78.4 mt -93.14 -19.11 6.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 121.049 0.452 . . . . 0.0 110.001 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 45.1 t -139.46 135.16 40.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.787 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 77.8 mt -123.85 121.26 61.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.968 0.413 . . . . 0.0 111.492 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.411 ' CD1' ' CG2' ' A' ' 630' ' ' ILE . 4.1 mp -105.39 127.52 53.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.0 mtm -140.42 133.95 30.09 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.904 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -67.99 152.62 45.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.286 178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.73 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 24.6 t-105 -110.59 -28.27 0.14 Allowed Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.282 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.73 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 34.4 Cg_endo -98.16 26.1 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 123.241 2.627 . . . . 0.0 115.42 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 71.3 Cg_endo -79.97 154.49 22.74 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.439 1.426 . . . . 0.0 112.116 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -64.26 -35.08 53.45 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.826 2.351 . . . . 0.0 112.243 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.601 ' C ' ' H ' ' A' ' 685' ' ' SER . 65.8 t0 -87.13 112.25 21.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.039 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -64.15 12.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.862 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 685' ' ' SER . . . . . 0.601 ' H ' ' C ' ' A' ' 683' ' ' ASP . 55.9 m -60.05 -29.82 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.801 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.465 ' SG ' ' HG3' ' A' ' 681' ' ' PRO . 19.4 m -59.5 -38.28 80.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.64 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 62.3 mt -67.47 -34.97 78.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.857 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.72 -42.12 82.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.886 0.374 . . . . 0.0 110.351 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . 0.445 ' C ' ' CD2' ' A' ' 689' ' ' LEU . 7.2 tt -60.57 -39.53 88.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.155 0.502 . . . . 0.0 109.875 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 9.0 tt -59.84 -41.54 91.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.648 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.58 -40.49 91.9 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.501 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -57.18 -46.03 83.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.311 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.55 -49.78 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . 0.816 HH11 HE22 ' A' ' 720' ' ' GLN . 54.0 ttt85 -69.05 -27.34 65.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.582 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . 0.661 ' O ' ' CD2' ' A' ' 696' ' ' HIS . 31.1 tp10 -62.93 -34.56 77.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.814 -178.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.661 ' CD2' ' O ' ' A' ' 695' ' ' GLU . 6.8 p80 . . . . . 0 N--CA 1.472 0.661 0 O-C-N 123.246 0.341 . . . . 0.0 111.876 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.491 1.369 0 CA-C-O 120.982 0.326 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -41.31 168.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 123.263 2.642 . . . . 0.0 112.633 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.481 ' CD1' ' N ' ' A' ' 704' ' ' LEU . 5.6 mp -76.93 142.76 39.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.064 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.587 ' N ' ' HG ' ' A' ' 722' ' ' SER . 44.3 t -126.61 135.25 64.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.207 0.527 . . . . 0.0 111.656 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 50.8 mt -110.33 132.94 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.304 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.12 126.68 55.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.924 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 49.2 mt -95.7 150.68 20.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.536 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 94.58 -134.88 12.19 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.71 156.77 44.69 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.951 0.405 . . . . 0.0 111.053 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.57 148.47 26.13 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 123.045 2.497 . . . . 0.0 112.326 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.35 151.12 86.15 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 122.604 2.203 . . . . 0.0 111.458 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 43.0 t -77.94 -42.88 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.942 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -72.99 140.65 80.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -75.96 -12.21 19.69 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.622 2.214 . . . . 0.0 112.61 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 38.6 tp -69.5 -35.87 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.926 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 66.8 mt -75.21 -34.49 61.49 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 27.1 m -63.66 -42.05 98.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.093 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.16 -39.22 93.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.094 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . 0.816 HE22 HH11 ' A' ' 694' ' ' ARG . 93.1 mt-30 -77.58 -19.96 54.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.175 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -74.46 132.94 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.868 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.587 ' HG ' ' N ' ' A' ' 705' ' ' VAL . 70.4 p -85.73 -27.04 25.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.834 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -172.72 112.62 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.917 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 64.6 mt -91.1 133.51 32.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.346 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.448 ' O ' ' OG ' ' A' ' 726' ' ' SER . 35.5 mt -106.93 147.04 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.974 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 726' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' A' ' 725' ' ' LEU . 2.9 m -168.78 5.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.379 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -134.56 78.87 55.25 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.474 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.28 137.7 76.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.917 1.744 . . . . 0.0 112.198 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' A' ' 730' ' ' ASP . 30.6 tp -179.23 112.87 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.541 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.57 ' C ' ' H ' ' A' ' 732' ' ' GLN . 5.5 m-20 51.32 100.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.2 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.51 -7.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.53 0 C-N-CA 122.692 2.261 . . . . 0.0 112.257 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 730' ' ' ASP . 92.1 mt-30 -71.75 -28.28 63.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.002 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 35.6 tp -66.7 -44.58 81.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . 0.505 ' C ' ' CD2' ' A' ' 734' ' ' LEU . 7.0 tt -57.78 -47.06 83.61 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.256 0.551 . . . . 0.0 109.591 178.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.94 -37.84 88.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.569 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.2 m -58.06 -39.34 78.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.487 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.0 m -59.97 -41.94 93.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.587 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.42 -35.22 80.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.232 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.48 ' C ' ' H ' ' A' ' 741' ' ' LEU . 47.8 tt0 -62.1 -34.43 76.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.52 -13.01 0.22 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.48 ' H ' ' C ' ' A' ' 739' ' ' GLN . 14.1 tp . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.58 0.229 . . . . 0.0 110.487 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.639 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -89.74 133.51 34.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . 0.409 ' CG2' ' CD1' ' A' ' 676' ' ' LEU . 67.5 mt -113.99 135.78 52.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.627 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' A' ' 631' ' ' LEU . 2.4 mm? -110.53 137.25 48.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.629 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 17.6 tp -126.58 125.81 42.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.582 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.447 HD21 ' SG ' ' A' ' 686' ' ' CYS . 24.8 tp -110.81 115.53 29.69 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.617 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 85.7 tt0 -159.59 161.2 35.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.804 -179.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.459 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 92.5 mt-10 -112.99 158.84 19.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 74.23 119.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.208 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.555 ' O ' ' OG1' ' A' ' 641' ' ' THR . 93.3 m-20 -57.5 -36.72 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.422 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.433 ' O ' ' CG2' ' A' ' 642' ' ' VAL . 84.0 tt0 -63.69 -43.62 96.08 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.677 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -77.46 -45.42 25.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.517 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.5 -43.18 90.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.959 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.555 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 61.3 m -63.85 -42.91 97.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.215 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.433 ' CG2' ' O ' ' A' ' 638' ' ' GLU . 51.2 t -55.59 -53.27 38.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.034 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.94 -42.57 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.431 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.584 ' O ' ' OG1' ' A' ' 648' ' ' THR . 3.3 t -60.93 -41.77 96.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.579 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.02 -38.44 88.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.621 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 646' ' ' MET . . . . . 0.448 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 61.2 ttp -70.09 -52.1 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 83.6 mt -64.73 -44.9 88.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.039 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.584 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.1 m -56.66 -40.99 76.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.075 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.06 -29.41 70.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.935 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -65.27 -5.22 6.59 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.892 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.61 -8.12 71.29 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -95.41 147.93 23.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.666 0.269 . . . . 0.0 110.424 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -91.71 129.63 37.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.991 0.424 . . . . 0.0 110.604 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . 0.444 ' CG1' ' SG ' ' A' ' 644' ' ' CYS . 11.3 p -127.91 140.19 49.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.404 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 66.5 mt -108.65 133.4 53.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.129 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.617 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 18.2 t90 -91.82 126.01 36.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.947 0.403 . . . . 0.0 110.835 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.487 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 3.1 mm? -112.24 145.62 39.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.463 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 19.2 m -106.74 -3.97 10.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.753 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -151.59 132.36 14.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.693 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.25 -40.74 97.76 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 661' ' ' SER . . . . . 0.719 ' H ' ' HG ' ' A' ' 685' ' ' SER . 81.5 p -62.08 -39.96 94.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 662' ' ' THR . . . . . 0.611 ' N ' ' HG ' ' A' ' 661' ' ' SER . 54.8 m -64.44 -37.65 88.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.089 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.605 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -61.96 -41.09 97.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.327 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 86.0 mt -59.43 -41.62 89.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -63.25 -43.04 99.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.324 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -89.89 -52.15 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.175 0.512 . . . . 0.0 111.197 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.605 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.9 tt -48.24 -33.83 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.056 -178.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.618 ' OD1' ' N ' ' A' ' 669' ' ' LEU . 46.4 p-10 -57.88 -38.77 76.37 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.34 -0.544 . . . . 0.0 110.46 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . 0.618 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 63.3 mt -79.75 -24.46 41.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.967 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 23.4 mt -71.9 -38.66 69.92 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.858 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.422 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 74.6 mm-40 48.9 62.67 11.78 Favored Pre-proline 0 C--N 1.329 -0.326 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.422 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 60.6 Cg_endo -79.52 159.62 25.52 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 123.36 2.707 . . . . 0.0 112.485 -179.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 73.5 mt -94.9 -23.27 5.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.52 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 51.7 t -138.8 133.52 41.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.162 0.506 . . . . 0.0 110.7 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 77.3 mt -128.2 121.22 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.958 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.441 HD11 ' N ' ' A' ' 676' ' ' LEU . 4.9 mp -105.29 128.92 53.7 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.401 ' HB3' ' SG ' ' A' ' 686' ' ' CYS . 70.5 mtm -142.02 142.8 32.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.552 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.78 152.57 44.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.883 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.752 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 72.5 t-105 -106.07 -23.79 0.19 Allowed Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.357 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.752 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.3 Cg_endo -100.32 29.29 0.12 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 123.219 2.613 . . . . 0.0 114.6 178.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.546 ' CD ' ' C ' ' A' ' 679' ' ' TRP . 63.4 Cg_endo -77.22 143.88 22.83 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.513 1.475 . . . . 0.0 111.903 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -66.97 -20.69 50.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.486 2.124 . . . . 0.0 112.12 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 685' ' ' SER . 84.9 m-20 -87.27 117.38 25.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.109 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -65.65 -1.42 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.299 179.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 685' ' ' SER . . . . . 0.719 ' HG ' ' H ' ' A' ' 661' ' ' SER . 23.7 t -59.85 -34.44 73.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.437 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.447 ' SG ' HD21 ' A' ' 633' ' ' LEU . 0.6 OUTLIER -59.96 -41.89 92.9 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.168 0.509 . . . . 0.0 109.782 179.511 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.37 -32.72 74.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.675 179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 84.0 mt -67.82 -37.39 81.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.015 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.92 -45.33 86.72 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.467 ' N ' HD21 ' A' ' 690' ' ' LEU . 2.9 mm? -62.04 -39.72 93.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.878 178.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -62.98 -46.07 89.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.252 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -55.84 -55.03 37.32 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.33 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 51.1 mt -55.8 -38.81 70.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.776 179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -62.62 -35.75 80.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.275 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -65.68 -35.76 81.71 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.123 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.037 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo . . . . . 0 N--CA 1.489 1.259 0 CA-C-O 120.697 0.207 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.47 162.63 17.03 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.953 2.436 . . . . 0.0 112.087 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 61.4 mt -77.41 133.9 38.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.324 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.484 ' C ' ' HG ' ' A' ' 722' ' ' SER . 52.8 t -125.47 132.51 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.956 0.408 . . . . 0.0 111.428 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.44 HD11 ' N ' ' A' ' 706' ' ' LEU . 5.2 mp -116.92 134.28 54.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.188 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -110.99 127.47 55.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.93 0.395 . . . . 0.0 110.984 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . 0.56 ' CD1' ' N ' ' A' ' 708' ' ' LEU . 4.5 mp -96.74 145.54 25.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.522 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 105.3 -129.37 9.78 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.62 164.09 27.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.831 0.348 . . . . 0.0 110.507 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -72.93 160.83 45.1 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.865 2.377 . . . . 0.0 112.444 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.7 156.11 55.09 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 123.019 2.48 . . . . 0.0 112.28 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 22.0 t -83.42 10.3 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -161.76 140.43 7.19 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.324 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.07 -9.53 23.74 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.766 2.311 . . . . 0.0 112.753 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.7 tp -68.5 -35.2 77.17 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.351 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.582 ' O ' ' N ' ' A' ' 721' ' ' ALA . 81.7 mt -76.06 -31.85 59.0 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 97.4 m -61.82 -43.21 99.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.853 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.99 -40.86 95.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -74.74 -31.66 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.604 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -72.62 142.45 48.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.484 ' HG ' ' C ' ' A' ' 705' ' ' VAL . 65.2 p -85.36 -23.73 27.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.278 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.05 163.3 4.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.436 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 72.4 mt -143.09 124.35 11.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.448 ' CD1' ' N ' ' A' ' 725' ' ' LEU . 5.7 mp -104.51 153.6 20.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.615 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.43 18.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.433 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -139.3 88.47 12.9 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.447 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.658 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.3 Cg_exo -48.49 144.73 13.26 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.52 2.146 . . . . 0.0 111.894 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.658 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 13.5 tp 103.46 156.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.685 0.616 . . . . 0.0 110.246 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.466 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 1.4 t70 61.74 63.48 2.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.952 0.406 . . . . 0.0 111.062 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . 0.448 ' HB3' ' SD ' ' A' ' 646' ' ' MET . 33.4 Cg_endo -67.11 -4.59 11.86 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.961 2.441 . . . . 0.0 111.817 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -69.24 -29.29 67.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.908 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.1 -44.68 88.04 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.681 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 42.1 tp -59.43 -42.16 91.21 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.94 178.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . 0.479 ' N ' HD21 ' A' ' 735' ' ' LEU . 2.7 mm? -62.34 -41.05 98.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.192 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 36.1 m -59.23 -38.84 80.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.084 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.1 m -61.8 -43.03 99.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.796 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.94 -40.96 97.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.983 0.421 . . . . 0.0 110.129 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -64.99 -24.93 67.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.171 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.8 -20.36 0.42 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.55 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.458 HD11 ' N ' ' A' ' 741' ' ' LEU . 5.8 mp . . . . . 0 C--N 1.329 -0.296 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.418 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.649 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . 0.499 ' CE1' ' HB3' ' A' ' 672' ' ' PRO . 13.9 p80 -84.53 164.43 18.76 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 64.1 mt -113.79 141.01 31.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.976 0.417 . . . . 0.0 111.522 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 9.9 tp -107.32 135.31 49.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.086 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 33.2 tp -133.93 118.98 18.52 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.227 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.438 HD23 ' SG ' ' A' ' 686' ' ' CYS . 8.2 tt -112.07 117.44 32.66 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.495 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.1 tt0 -159.78 162.97 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.045 -179.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.495 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 95.3 mt-10 -97.35 167.9 10.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.897 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 61.55 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 110.038 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.589 ' O ' ' OG1' ' A' ' 641' ' ' THR . 52.5 t0 -57.93 -36.95 73.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.919 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 54.7 mp0 -65.16 -43.78 90.64 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.737 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.65 -44.17 62.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.618 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.09 93.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.078 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.589 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 50.9 m -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.711 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 55.8 t -55.58 -51.91 53.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.142 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.6 t -60.68 -46.67 95.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.514 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.571 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.5 OUTLIER -66.42 -33.93 76.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.672 -179.905 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 641' ' ' THR . 85.2 tt0 -60.37 -39.53 87.58 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.319 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 7.3 tpp -65.0 -50.59 65.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.103 0.478 . . . . 0.0 109.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 85.0 mt -67.36 -45.25 76.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.204 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.571 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 28.5 m -56.13 -43.52 78.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.622 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . 0.499 ' C ' ' H ' ' A' ' 651' ' ' GLY . . . -69.66 -23.91 63.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -63.92 2.93 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.979 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 649' ' ' ALA . . . 97.12 -15.63 62.14 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -93.79 152.01 19.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -93.3 125.42 37.89 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.319 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 22.9 t -117.83 134.79 60.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.697 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 44.7 mt -109.06 131.4 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.065 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -95.53 121.66 37.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.176 -179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 7.1 mp -116.2 146.59 42.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.685 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 8.8 p -123.26 21.45 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.625 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -152.28 163.61 39.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.563 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -100.4 -54.51 1.01 Allowed Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.98 -0.628 . . . . 0.0 111.824 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 33.7 m -57.21 -41.87 80.24 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.602 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 26.5 m -64.4 -35.15 79.96 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.584 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.44 -42.48 99.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.622 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . 0.419 HD21 ' ND1' ' A' ' 692' ' ' HIS . 80.6 mt -59.49 -43.79 93.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.852 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -62.71 -41.94 99.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.484 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -89.28 -51.31 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 111.298 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.584 ' N ' ' O ' ' A' ' 663' ' ' ALA . 3.9 tt -45.81 -37.68 6.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.265 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.511 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 90.7 m-20 -56.14 -38.63 71.1 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.923 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.48 -31.46 53.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.101 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.493 ' HB3' ' CE1' ' A' ' 629' ' ' HIS . 11.1 mt -72.48 -38.48 68.19 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.247 -178.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 10.0 mm-40 46.82 65.55 6.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 110.192 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.499 ' HB3' ' CE1' ' A' ' 629' ' ' HIS . 30.5 Cg_endo -68.99 152.81 73.23 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 123.159 2.572 . . . . 0.0 112.952 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . 0.447 HG21 ' N ' ' A' ' 674' ' ' VAL . 19.3 tt -95.5 -22.21 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.696 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . 0.447 ' N ' HG21 ' A' ' 673' ' ' ILE . 76.1 t -140.1 133.69 35.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.468 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 78.4 mt -123.31 122.31 64.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.574 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 676' ' ' LEU . 5.0 mp -106.53 138.97 41.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.538 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.543 ' SD ' ' CD2' ' A' ' 690' ' ' LEU . 83.8 mtp -139.1 128.15 23.78 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.51 144.04 53.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.567 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.745 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 0.5 OUTLIER -113.68 -29.96 0.11 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.151 179.474 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.745 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 41.0 Cg_exo -50.87 -40.09 57.92 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.293 1.996 . . . . 0.0 113.288 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 23.4 Cg_exo -60.58 166.19 10.22 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.97 1.78 . . . . 0.0 111.961 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.512 ' O ' ' O ' ' A' ' 683' ' ' ASP . 32.1 Cg_exo -52.0 -17.97 6.35 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.532 2.154 . . . . 0.0 112.009 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 682' ' ' PRO . 1.0 OUTLIER 58.24 132.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.988 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -176.8 -78.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.736 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 77.3 p -64.08 -30.65 71.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.969 0.414 . . . . 0.0 109.941 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.438 ' SG ' HD23 ' A' ' 633' ' ' LEU . 2.4 m -62.42 -32.69 73.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.019 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.0 mt -64.58 -31.56 72.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.486 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.7 mt -63.27 -42.67 99.14 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.036 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 25.4 tp -60.36 -42.83 96.56 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.543 ' CD2' ' SD ' ' A' ' 677' ' ' MET . 82.1 mt -61.58 -40.64 95.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.778 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.88 -40.29 97.09 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.062 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.419 ' ND1' HD21 ' A' ' 664' ' ' LEU . 12.1 t-80 -57.5 -51.54 69.02 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.456 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 62.5 mt -55.13 -43.15 73.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.345 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -64.44 -35.66 81.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -65.91 -32.25 73.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.121 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 . . . . . 0 C--N 1.33 -0.25 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.454 -179.75 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo . . . . . 0 N--CA 1.489 1.228 0 CA-C-O 120.831 0.263 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -53.38 144.15 51.19 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.583 2.189 . . . . 0.0 111.789 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 5.6 mp -79.39 138.42 37.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.359 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.437 HG13 ' CE2' ' A' ' 707' ' ' PHE . 36.1 t -118.28 127.0 75.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.875 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.529 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 3.8 mp -115.63 129.85 56.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.942 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . 0.437 ' CE2' HG13 ' A' ' 705' ' ' VAL . 96.4 m-85 -109.15 128.23 54.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.014 0.435 . . . . 0.0 110.801 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 43.7 mt -95.44 149.97 20.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.561 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 101.34 -137.65 13.41 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -91.45 167.2 16.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.463 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.4 155.35 25.73 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.548 2.166 . . . . 0.0 112.483 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . 0.446 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 22.5 Cg_endo -63.34 161.12 32.14 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 123.26 2.64 . . . . 0.0 112.07 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.1 -71.62 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.5 OUTLIER -70.97 148.07 94.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.663 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.91 -14.19 32.27 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.732 2.288 . . . . 0.0 112.222 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 74.2 mt -70.88 -31.52 68.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 53.3 mt -77.03 -32.46 57.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 47.7 m -64.9 -43.54 92.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.039 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -66.18 -39.92 90.08 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.02 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -82.52 -11.55 58.38 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.454 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -75.13 129.36 37.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.46 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.6 m -85.88 -23.0 27.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.057 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -168.44 139.37 2.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.351 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 78.9 mt -123.73 126.11 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.656 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.55 ' CD1' ' N ' ' A' ' 725' ' ' LEU . 5.3 mp -106.82 151.9 24.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.679 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 726' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 727' ' ' LYS . 60.7 p -167.1 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.062 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . 0.407 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.0 OUTLIER -130.86 74.99 79.38 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.018 179.652 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -48.95 125.29 12.82 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.397 2.065 . . . . 0.0 111.858 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.647 ' O ' ' CD2' ' A' ' 729' ' ' LEU . 0.5 OUTLIER -179.78 134.27 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.488 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.585 ' C ' ' H ' ' A' ' 732' ' ' GLN . 4.1 m-20 56.03 75.1 0.62 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.723 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.59 -7.56 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.625 2.217 . . . . 0.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . 0.585 ' H ' ' C ' ' A' ' 730' ' ' ASP . 14.4 mm100 -70.7 -26.41 63.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.299 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.43 -47.56 75.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.927 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 47.0 tp -58.13 -47.26 83.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.17 0.51 . . . . 0.0 109.662 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.6 tp -63.28 -38.65 91.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.133 179.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 736' ' ' THR . . . . . 0.499 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 59.5 m -58.29 -41.56 84.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.51 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.2 m -61.32 -41.21 96.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.922 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 13.6 tp -63.64 -39.04 93.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.364 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' A' ' 741' ' ' LEU . 55.0 tp60 -65.29 -32.5 74.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.985 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -46.72 -11.15 0.05 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.983 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.499 ' H ' ' C ' ' A' ' 739' ' ' GLN . 84.1 mt . . . . . 0 C--N 1.328 -0.327 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.647 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.662 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -87.55 144.18 26.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.716 0.293 . . . . 0.0 110.738 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 67.8 mt -119.21 132.37 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.621 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 51.2 tp -115.3 134.51 55.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.982 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.592 ' C ' ' CD1' ' A' ' 632' ' ' LEU . 0.2 OUTLIER -136.41 134.39 37.71 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.628 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 25.9 tp -108.41 123.2 48.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.45 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 86.2 tt0 -159.45 155.32 26.35 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.509 -179.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.45 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 75.8 mm-40 -95.76 167.01 11.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.492 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 62.48 112.41 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.654 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.9 p30 -64.94 -25.87 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.32 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.654 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.7 mt-10 -63.74 -40.62 97.18 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.37 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.8 -41.65 68.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.292 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.477 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -67.44 -39.87 85.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.09 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 40.8 m -62.35 -44.09 97.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.796 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 81.1 t -57.71 -50.47 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.66 -39.86 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.574 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.8 OUTLIER -59.04 -39.56 82.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -63.48 -36.79 84.93 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.782 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 59.8 mtt -68.75 -54.37 16.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.124 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . 0.431 ' CD1' ' N ' ' A' ' 647' ' ' LEU . 10.5 mp -67.08 -42.74 84.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.284 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.574 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 43.8 m -55.42 -42.53 74.27 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.456 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.07 -25.88 62.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.691 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.68 -5.01 40.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.992 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -9.57 70.48 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -98.2 134.13 41.68 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -92.62 127.45 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.121 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . 0.411 HG12 ' SG ' ' A' ' 644' ' ' CYS . 14.4 p -122.84 139.78 48.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.041 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . 0.439 HD12 HG22 ' A' ' 655' ' ' ILE . 67.7 mt -107.33 131.0 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.72 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.545 ' CZ2' ' CG1' ' A' ' 658' ' ' VAL . 10.3 t90 -94.78 117.36 30.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.473 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.471 ' HG ' ' H ' ' A' ' 659' ' ' ASP . 27.8 tp -116.44 149.73 38.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.546 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . 0.545 ' CG1' ' CZ2' ' A' ' 656' ' ' TRP . 23.4 m -110.52 27.46 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.743 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.471 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 67.9 m-20 -148.82 164.68 33.74 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.976 0.417 . . . . 0.0 111.143 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -109.47 -63.53 0.53 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 46.8 t -58.6 -40.78 84.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.0 110.725 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.6 m -62.64 -35.59 80.09 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 109.561 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.636 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -60.13 -45.55 92.62 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.418 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . 0.571 ' CD1' ' C ' ' A' ' 664' ' ' LEU . 0.1 OUTLIER -57.97 -42.72 85.61 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.377 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . 0.498 ' N ' ' HG ' ' A' ' 664' ' ' LEU . 14.5 t70 -57.29 -39.6 76.05 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.158 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -94.56 -25.81 16.66 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.196 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.636 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.5 tt -53.24 -35.22 59.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.022 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.682 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 66.2 m-20 -54.92 -37.66 66.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.386 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 71.2 mt -76.76 -35.8 57.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.089 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.412 ' O ' ' C ' ' A' ' 671' ' ' GLN . 12.8 mt -70.44 -41.31 73.03 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.089 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.682 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 13.3 mt-30 41.35 64.64 5.15 Favored Pre-proline 0 C--N 1.331 -0.201 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -78.4 158.3 29.29 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 123.092 2.528 . . . . 0.0 113.47 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . 0.429 HG21 ' N ' ' A' ' 674' ' ' VAL . 5.9 tp -93.77 -21.28 6.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.554 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . 0.429 ' N ' HG21 ' A' ' 673' ' ' ILE . 62.1 t -142.19 137.75 29.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.539 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 64.7 mt -127.07 120.24 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.517 ' N ' ' CD2' ' A' ' 676' ' ' LEU . 0.0 OUTLIER -107.37 134.1 50.93 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.156 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.9 mtm -139.13 136.2 34.89 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.404 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -66.59 144.88 56.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.382 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.676 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 4.7 t-105 -113.13 -33.56 0.11 Allowed Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.715 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.676 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 20.1 Cg_exo -56.1 -43.0 60.65 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.013 1.809 . . . . 0.0 112.696 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 84.7 Cg_endo -83.59 165.37 14.05 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.739 2.293 . . . . 0.0 111.684 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.94 -82.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.381 2.054 . . . . 0.0 111.655 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 56.07 43.67 26.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.876 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -57.71 -30.35 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.428 -179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 94.2 p -64.61 -26.28 68.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.667 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -28.29 67.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.544 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 71.0 mt -62.7 -36.26 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.969 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 90.0 mt -68.42 -37.84 80.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.768 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 8.6 tt -56.58 -46.37 80.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.608 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.44 -39.0 91.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.734 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -61.66 -41.04 96.97 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.394 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 32.2 t-80 -59.91 -48.39 81.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.911 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.95 -42.03 68.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.612 -0.435 . . . . 0.0 109.939 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 57.0 ttm-85 -65.73 -28.02 68.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.5 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.32 -39.32 89.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.901 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 2.2 p80 . . . . . 0 N--CA 1.464 0.267 0 C-N-CA 119.844 -0.742 . . . . 0.0 112.342 -179.678 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.489 1.208 0 N-CA-C 112.426 0.125 . . . . 0.0 112.426 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -73.81 163.31 37.44 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 C-N-CA 122.653 2.235 . . . . 0.0 112.015 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.448 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 1.6 mm? -78.01 140.41 39.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.104 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 31.8 t -121.88 134.5 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.879 0.371 . . . . 0.0 111.127 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 47.4 mt -115.52 132.35 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.012 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -111.96 126.25 54.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.145 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.64 148.32 22.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.387 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 90.38 -128.89 9.48 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.27 163.13 37.94 Favored Pre-proline 0 CA--C 1.532 0.274 0 C-N-CA 121.264 -0.174 . . . . 0.0 110.763 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -68.45 138.9 43.59 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.157 1.904 . . . . 0.0 112.036 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . 0.412 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -47.64 151.96 3.05 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.388 2.059 . . . . 0.0 112.496 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 8.1 p -83.78 -46.61 18.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.115 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 147.56 90.58 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.423 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.22 -24.99 16.25 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.913 2.408 . . . . 0.0 113.175 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 77.0 mt -70.22 -29.61 66.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.923 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.487 ' CD1' ' N ' ' A' ' 717' ' ' LEU . 7.4 mp -77.76 -41.5 37.34 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.892 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 41.6 m -63.91 -42.81 97.31 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.03 90.4 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.969 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -83.82 -13.96 52.45 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.979 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -71.43 128.56 36.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.031 0.443 . . . . 0.0 110.809 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 31.9 t -85.5 -24.65 27.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.466 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.27 159.52 5.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.182 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 70.6 mt -136.39 125.93 38.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.779 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 50.7 mt -107.68 126.89 53.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.937 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 36.5 t -69.6 -87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.912 0.387 . . . . 0.0 110.358 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . 0.823 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 9.8 tttp -134.83 -34.49 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.833 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.823 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 36.9 Cg_exo -57.48 149.62 65.16 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.31 2.007 . . . . 0.0 112.659 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.48 -80.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.83 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 54.07 58.58 12.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.101 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -63.9 -15.77 50.99 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 C-N-CA 122.745 2.297 . . . . 0.0 112.165 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -70.78 -34.69 72.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.319 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.2 tp -68.85 -44.06 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.227 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 62.1 tp -53.19 -45.16 68.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.738 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.65 -40.22 96.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.218 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 58.3 m -58.6 -38.95 79.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.933 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 88.1 m -60.6 -39.69 89.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.994 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 23.5 mt -63.57 -42.38 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.659 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 741' ' ' LEU . 25.0 mt-30 -65.88 -28.71 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.244 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . 0.553 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -22.7 -45.76 0.01 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.56 ' N ' ' O ' ' A' ' 739' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.242 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.534 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . 0.465 ' HE2' HD13 ' A' ' 655' ' ' ILE . 21.7 t-80 -85.76 120.65 27.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.582 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 52.9 mt -117.68 135.48 57.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.755 0.312 . . . . 0.0 111.467 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 7.6 tt -108.17 127.62 53.99 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.047 0.451 . . . . 0.0 110.316 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . 0.403 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 50.9 tp -110.15 125.05 52.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 9.0 tt -112.2 110.49 20.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.418 ' OE2' ' CB ' ' A' ' 678' ' ' ALA . 75.9 mm-40 -155.72 166.46 33.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.944 -179.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -111.98 165.36 12.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.23 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.3 tp10 65.76 121.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 111.078 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.526 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 81.6 m-20 -58.51 -37.18 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.023 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.27 -45.26 81.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.061 -179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.7 -39.49 70.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.421 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . 0.443 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -68.35 -43.09 78.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.505 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 72.3 m -60.91 -43.55 98.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 49.4 t -56.13 -54.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.771 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.65 -45.27 94.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.074 0.464 . . . . 0.0 110.112 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.607 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.4 OUTLIER -67.35 -41.0 85.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.893 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 641' ' ' THR . 86.0 tt0 -57.94 -40.6 80.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 80.8 mtp -67.04 -52.05 47.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.926 0.393 . . . . 0.0 110.428 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 80.4 mt -68.9 -43.28 75.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.826 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.607 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 34.5 m -56.24 -40.78 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.245 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.26 -25.85 62.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.684 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.71 -3.51 22.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.56 2.41 65.39 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.096 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -96.45 141.87 29.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 117.386 0.593 . . . . 0.0 110.651 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -87.85 110.89 20.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.215 0.531 . . . . 0.0 109.691 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . 0.403 ' CG1' ' HB2' ' A' ' 632' ' ' LEU . 81.5 t -116.52 136.85 52.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.97 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . 0.485 HG22 HD11 ' A' ' 655' ' ' ILE . 63.3 mt -108.9 133.42 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.851 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . 0.526 ' CH2' ' OD1' ' A' ' 637' ' ' ASP . 23.8 t90 -92.96 111.59 23.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.756 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.419 ' HG ' ' H ' ' A' ' 659' ' ' ASP . 22.7 tp -123.81 135.56 53.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.766 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 21.1 m -105.72 -9.34 10.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.278 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.419 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 89.6 m-20 -100.95 152.04 21.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -102.78 -56.7 0.8 Allowed Glycine 0 CA--C 1.531 1.047 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.5 t -58.66 -40.78 84.47 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.888 0.375 . . . . 0.0 110.675 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 28.3 m -61.03 -38.85 87.61 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.619 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.55 -40.7 95.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.617 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . 0.439 ' O ' ' CG ' ' A' ' 668' ' ' ASP . 44.5 mt -57.8 -46.42 84.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.808 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.61 -43.49 93.59 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.817 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -84.67 -44.87 13.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.952 0.406 . . . . 0.0 111.391 -178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.619 ' N ' ' O ' ' A' ' 663' ' ' ALA . 9.6 tt -50.32 -35.06 25.97 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.5 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 664' ' ' LEU . 89.0 m-20 -55.36 -40.51 71.36 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.179 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 58.0 mt -74.5 -28.99 61.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 179.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 31.4 mt -72.39 -35.17 68.37 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.268 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.533 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 13.4 mm-40 43.4 62.23 9.19 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.533 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 3.6 Cg_exo -72.35 156.59 54.59 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.397 2.732 . . . . 0.0 113.335 -178.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . 0.472 HG22 HD11 ' A' ' 673' ' ' ILE . 70.9 mt -98.54 -27.52 3.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.263 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 38.8 t -137.04 132.97 47.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.511 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 63.7 mt -128.67 125.21 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.227 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . 0.583 ' CD1' ' N ' ' A' ' 676' ' ' LEU . 5.1 mp -103.82 129.69 51.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.898 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.461 ' SD ' HD23 ' A' ' 690' ' ' LEU . 10.6 ptp -143.52 140.1 30.12 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.253 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . 0.418 ' CB ' ' OE2' ' A' ' 634' ' ' GLU . . . -67.04 152.58 45.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.374 178.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.732 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 63.3 t-105 -106.4 -26.69 0.19 Allowed Pre-proline 0 C--O 1.233 0.217 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.362 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.8 Cg_endo -101.55 29.22 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 123.428 2.752 . . . . 0.0 114.6 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 66.1 Cg_endo -77.13 151.18 30.12 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.645 1.564 . . . . 0.0 111.966 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -71.82 -14.16 29.64 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.319 2.013 . . . . 0.0 112.376 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -87.63 112.47 22.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.777 0.323 . . . . 0.0 111.484 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -65.51 -8.98 22.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 87.9 p -64.53 -23.16 67.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -178.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.551 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -62.57 -38.61 90.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.052 0.453 . . . . 0.0 109.839 179.088 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . 0.551 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 76.0 mt -66.16 -35.83 81.51 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.992 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 63.3 mt -66.52 -36.39 82.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.685 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 14.9 tp -59.56 -40.75 88.34 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . 0.461 HD23 ' SD ' ' A' ' 677' ' ' MET . 46.7 mt -59.61 -39.01 82.82 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.901 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.14 -42.21 94.39 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.62 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . 0.688 ' HE2' ' CE1' ' A' ' 696' ' ' HIS . 4.1 t60 -62.63 -61.09 2.67 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . 0.423 ' CD2' ' HA ' ' A' ' 690' ' ' LEU . 1.6 pp -54.55 -33.13 59.61 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.868 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 694' ' ' ARG . 23.5 ttt85 -60.82 -42.46 97.73 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.027 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -69.2 -39.79 78.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . 0.688 ' CE1' ' HE2' ' A' ' 692' ' ' HIS . 64.5 m170 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.632 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo . . . . . 0 N--CA 1.49 1.317 0 CA-C-O 120.469 0.112 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.58 140.44 23.92 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 122.303 2.002 . . . . 0.0 112.183 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.708 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER -81.0 142.68 33.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.716 -179.771 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.4 ' O ' ' OG ' ' A' ' 722' ' ' SER . 40.5 t -126.05 125.98 68.89 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.041 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . 0.534 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 4.9 mp -122.4 135.6 54.72 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.067 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -111.23 130.3 55.69 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.132 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 72.4 mt -96.85 146.46 24.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.541 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 88.2 -136.38 13.72 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.31 151.04 50.54 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.082 0.468 . . . . 0.0 110.85 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.17 156.14 65.78 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 123.112 2.541 . . . . 0.0 112.945 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . 0.662 ' C ' ' H ' ' A' ' 714' ' ' ASP . 29.4 Cg_endo -67.53 3.68 1.68 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.871 2.38 . . . . 0.0 112.292 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 55.2 t 60.42 -38.84 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.684 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . 0.662 ' H ' ' C ' ' A' ' 712' ' ' PRO . 52.1 m-20 -70.08 133.15 87.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.38 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -73.91 -19.53 20.61 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 122.312 2.008 . . . . 0.0 113.088 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . 0.438 ' H ' HD11 ' A' ' 716' ' ' LEU . 5.3 mp -71.36 -40.82 70.38 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.295 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.56 -37.09 57.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.652 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 31.8 m -63.37 -39.68 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.64 91.96 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.784 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -78.97 -20.23 49.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.548 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.38 142.79 50.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.53 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.409 ' HG ' ' N ' ' A' ' 723' ' ' ALA . 91.9 p -85.95 -29.02 23.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.33 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . 0.409 ' N ' ' HG ' ' A' ' 722' ' ' SER . . . -167.2 129.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 18.2 mm -98.19 128.3 49.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.542 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 725' ' ' LEU . 6.1 mp -107.68 145.02 33.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.674 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 12.3 t -164.86 -16.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.062 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.96 74.81 80.25 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.136 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -50.36 142.93 28.23 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.845 2.364 . . . . 0.0 112.748 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . 0.422 ' O ' ' O ' ' A' ' 730' ' ' ASP . 39.6 tp -174.43 93.17 0.08 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.402 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 729' ' ' LEU . 25.2 m-20 57.76 147.06 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.47 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -68.98 3.22 2.52 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 123.142 2.561 . . . . 0.0 112.319 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -67.42 -31.61 71.92 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.731 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 24.9 tp -67.69 -53.72 25.35 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.094 -0.642 . . . . 0.0 110.667 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 9.1 tt -57.15 -41.37 79.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.038 0.447 . . . . 0.0 110.76 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 24.2 tp -60.03 -39.52 86.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 35.4 m -58.33 -39.42 79.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.388 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 52.2 m -60.8 -43.33 98.28 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.901 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 57.6 mt -63.22 -37.01 85.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.108 0.48 . . . . 0.0 110.388 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -64.67 -29.18 70.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.082 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.69 -20.3 3.92 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 67.4 mt . . . . . 0 C--N 1.326 -0.422 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.436 -179.656 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.651 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -89.09 131.27 35.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 110.376 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 630' ' ' ILE . . . . . 0.43 HG12 ' CG1' ' A' ' 674' ' ' VAL . 54.6 mt -114.67 141.54 30.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 631' ' ' LEU . . . . . 0.405 ' N ' HG21 ' A' ' 630' ' ' ILE . 83.2 mt -103.9 131.5 51.06 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.209 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 10.6 tp -124.18 117.36 24.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.011 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.469 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 9.4 tt -117.21 120.1 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.386 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 634' ' ' GLU . . . . . 0.469 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 92.4 mt-10 -158.56 170.29 22.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.194 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 635' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 636' ' ' GLU . 96.4 mt-10 -110.06 158.52 18.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.352 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 636' ' ' GLU . . . . . 0.453 ' HG2' ' H ' ' A' ' 638' ' ' GLU . 83.3 tt0 62.16 127.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.925 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 637' ' ' ASP . . . . . 0.706 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 51.6 p30 -61.94 -29.97 70.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 638' ' ' GLU . . . . . 0.706 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 50.8 tp10 -63.29 -41.11 98.95 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.058 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.62 59.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 110.278 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.97 76.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.064 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 641' ' ' THR . . . . . 0.59 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 67.1 m -62.47 -46.18 89.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.085 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 642' ' ' VAL . . . . . 0.452 ' CG2' ' O ' ' A' ' 638' ' ' GLU . 89.4 t -56.77 -52.66 51.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.285 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 98.4 t -60.31 -41.9 88.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.803 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 644' ' ' CYS . . . . . 0.505 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.7 OUTLIER -58.58 -42.39 87.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.779 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.1 -39.28 91.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.171 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.0 mtt -66.97 -50.14 63.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.061 0.457 . . . . 0.0 110.109 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 73.1 mt -69.08 -46.03 68.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.293 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 648' ' ' THR . . . . . 0.505 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 61.7 m -56.3 -41.98 76.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.105 0.479 . . . . 0.0 109.858 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.95 -24.97 64.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.649 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.72 -6.24 39.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.905 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.41 -12.76 66.29 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.758 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -96.03 142.35 28.35 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.742 179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -92.77 134.34 35.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.184 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 4.0 m -122.99 153.66 28.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.025 0.441 . . . . 0.0 111.099 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 69.6 mt -108.96 135.44 47.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.708 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 18.9 t90 -92.7 126.1 37.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 111.241 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 657' ' ' LEU . . . . . 0.465 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 3.9 mm? -115.12 143.2 45.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.677 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 658' ' ' VAL . . . . . 0.612 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 82.2 t -98.28 -18.95 6.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.17 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 659' ' ' ASP . . . . . 0.612 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 98.6 m-20 -147.85 150.13 33.58 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.473 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -65.49 -39.68 95.79 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 18.9 t -58.16 -40.34 81.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.759 0.314 . . . . 0.0 110.796 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.6 m -64.64 -38.94 92.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 663' ' ' ALA . . . . . 0.532 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.63 -46.41 85.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.495 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 67.5 mt -59.39 -42.19 91.12 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.811 -0.355 . . . . 0.0 111.134 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -62.74 -40.13 96.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.804 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -84.63 -42.93 14.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.097 0.475 . . . . 0.0 110.66 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 667' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.7 tt -45.29 -44.6 11.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.215 -179.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -58.56 -35.02 71.7 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.25 -38.52 56.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.928 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.492 ' CD2' ' N ' ' A' ' 670' ' ' LEU . 0.1 OUTLIER -77.41 -41.7 38.98 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.709 -178.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 671' ' ' GLN . . . . . 0.457 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 8.0 mm-40 58.88 62.71 4.18 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 0.0 109.899 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 672' ' ' PRO . . . . . 0.457 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 50.5 Cg_endo -80.35 165.76 20.76 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.365 2.71 . . . . 0.0 112.554 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 97.2 mt -94.92 -19.63 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.139 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 674' ' ' VAL . . . . . 0.43 ' CG1' HG12 ' A' ' 630' ' ' ILE . 14.9 p -141.05 141.92 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.309 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . 0.426 HD11 HG21 ' A' ' 675' ' ' ILE . 12.9 mm -119.93 124.51 72.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.134 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 51.1 mt -107.07 126.8 52.82 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 677' ' ' MET . . . . . 0.416 ' SD ' HG11 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -141.9 135.16 29.19 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.931 -0.707 . . . . 0.0 112.383 -178.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 678' ' ' ALA . . . . . 0.589 ' O ' ' SG ' ' A' ' 686' ' ' CYS . . . -68.09 152.55 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.67 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 679' ' ' TRP . . . . . 0.599 ' CG ' ' O ' ' A' ' 679' ' ' TRP . 74.6 t-105 -125.23 49.73 3.63 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.286 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . 0.5 ' HD3' ' N ' ' A' ' 679' ' ' TRP . 95.0 Cg_endo -84.2 135.07 6.18 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.547 2.165 . . . . 0.0 111.319 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 681' ' ' PRO . . . . . 0.638 ' C ' ' H ' ' A' ' 683' ' ' ASP . 16.3 Cg_exo -51.27 -47.42 25.99 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 121.93 1.754 . . . . 0.0 113.305 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 682' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 32.7 Cg_endo -65.91 29.58 0.1 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.69 1.594 . . . . 0.0 111.163 -179.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 683' ' ' ASP . . . . . 0.638 ' H ' ' C ' ' A' ' 681' ' ' PRO . 21.9 t70 -151.27 71.93 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.043 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.53 0.35 0.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.532 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 685' ' ' SER . . . . . 0.482 ' H ' ' C ' ' A' ' 683' ' ' ASP . 20.4 m -61.45 -33.41 73.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.299 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 686' ' ' CYS . . . . . 0.589 ' SG ' ' O ' ' A' ' 678' ' ' ALA . 91.0 m -59.05 -27.34 65.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.919 0.39 . . . . 0.0 110.342 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.68 -33.3 75.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.31 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.56 -39.1 84.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.301 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.53 -42.26 96.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.416 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.5 -44.1 96.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.868 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -61.99 -38.78 89.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.904 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -56.86 -50.12 73.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.0 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.07 -42.85 73.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.999 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -67.68 -33.1 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.172 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -65.81 -32.15 73.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.488 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 . . . . . 0 C--N 1.329 -0.324 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.613 -179.359 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo . . . . . 0 N--CA 1.49 1.287 0 N-CA-C 112.549 0.173 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.97 166.35 29.41 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.687 2.258 . . . . 0.0 111.791 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.402 ' HG ' ' CB ' ' A' ' 722' ' ' SER . 6.4 tt -77.26 125.58 29.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . 0.416 HG11 ' SD ' ' A' ' 677' ' ' MET . 61.2 t -122.81 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.121 0.486 . . . . 0.0 111.706 -179.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 19.7 mt -118.35 135.92 54.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.692 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -107.88 121.57 45.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.599 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 40.3 mt -98.94 134.55 41.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.164 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 134.1 -138.01 9.74 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.411 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 710' ' ' GLU . . . . . 0.603 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.9 OUTLIER -93.59 -176.93 0.62 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.674 0.273 . . . . 0.0 111.017 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' A' ' 710' ' ' GLU . 19.4 Cg_exo -61.74 157.49 42.36 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.719 2.28 . . . . 0.0 112.323 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.45 146.07 84.36 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.174 2.583 . . . . 0.0 112.778 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 54.4 t -84.22 -15.65 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.715 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -162.12 150.08 12.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.905 0.383 . . . . 0.0 110.398 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.4 -9.75 21.36 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.913 2.408 . . . . 0.0 112.939 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.4 mt -70.15 -39.88 75.1 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.767 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.523 ' C ' ' CD1' ' A' ' 717' ' ' LEU . 1.9 pp -80.56 -37.34 31.57 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 718' ' ' THR . . . . . 0.419 ' N ' ' HG ' ' A' ' 717' ' ' LEU . 30.9 m -63.83 -40.85 97.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.608 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.04 91.43 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-O 121.029 0.442 . . . . 0.0 109.998 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -74.25 -37.72 63.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.378 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.57 48.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.594 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 722' ' ' SER . . . . . 0.402 ' CB ' ' HG ' ' A' ' 704' ' ' LEU . 4.7 m -85.65 -23.15 27.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.47 163.99 8.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.371 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 31.6 mt -139.88 128.77 27.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.927 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 37.0 mt -106.9 125.41 50.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.131 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 59.0 m -72.1 -90.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.404 -179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 727' ' ' LYS . . . . . 0.804 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 26.9 tttt -130.71 -32.44 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 728' ' ' PRO . . . . . 0.804 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 48.0 Cg_exo -53.78 151.15 26.79 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.26 1.973 . . . . 0.0 112.08 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.54 -51.11 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.673 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 730' ' ' ASP . . . . . 0.469 ' N ' ' HD3' ' A' ' 731' ' ' PRO . 82.2 m-20 40.74 57.22 8.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.966 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 731' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 68.1 Cg_endo -82.55 -28.11 1.91 Allowed 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.567 2.178 . . . . 0.0 112.045 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -73.5 -37.39 65.7 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 49.5 tp -67.31 -40.51 86.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.862 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 27.5 tp -55.55 -47.22 76.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.932 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 9.4 tt -64.21 -44.42 91.99 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.271 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 91.3 m -61.2 -38.2 85.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.598 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 39.9 m -60.93 -42.54 98.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.202 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.6 -38.78 92.42 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.389 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 739' ' ' GLN . . . . . 0.532 ' C ' ' H ' ' A' ' 741' ' ' LEU . 97.0 mt-30 -64.49 -34.5 78.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.937 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -60.64 1.68 0.69 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 741' ' ' LEU . . . . . 0.532 ' H ' ' C ' ' A' ' 739' ' ' GLN . 63.1 tp . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 120.797 0.332 . . . . 0.0 110.602 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 179.54 135.26 2.37 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -96.09 135.18 38.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.789 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 57.5 mt -118.87 134.11 63.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.193 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 27.1 tp -107.21 131.67 53.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.097 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 4.6 tp -133.06 127.36 33.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.889 0.376 . . . . 0.0 111.877 -178.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.4 ' N ' HD11 ' A' ' 633' ' ' LEU . 7.9 mp -109.68 119.12 38.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.535 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 83.9 tt0 -159.06 156.97 30.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.012 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.65 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 85.3 tt0 -115.59 138.17 51.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.65 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 69.1 tt0 103.56 113.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.512 ' O ' ' OG1' ' A' ' 641' ' ' THR . 62.1 t0 -57.54 -36.04 71.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.333 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.4 -44.47 82.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.664 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -70.58 -43.2 69.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.832 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.35 87.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 86.9 m -62.22 -44.28 96.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.686 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 56.6 t -57.75 -53.73 40.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.46 -46.26 92.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.149 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.578 ' O ' ' OG1' ' A' ' 648' ' ' THR . 73.2 m -61.46 -35.74 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.031 -179.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -62.48 -40.32 96.3 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.913 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 89.5 mtp -67.36 -51.61 50.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.944 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . 0.43 ' N ' HD13 ' A' ' 647' ' ' LEU . 6.6 mp -67.89 -42.68 80.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.675 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.578 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 87.1 m -55.64 -42.08 74.5 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.759 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.06 -29.57 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.029 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.31 -6.65 47.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.735 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.25 2.4 73.98 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -96.88 145.15 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.122 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -93.43 128.92 39.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.689 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 71.8 t -124.61 138.01 55.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.552 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . 0.404 HD11 HG22 ' A' ' 655' ' ' ILE . 53.3 mt -105.66 130.74 56.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 0.0 110.495 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.535 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 24.4 t90 -96.66 111.51 23.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.424 ' CD1' ' HA ' ' A' ' 663' ' ' ALA . 64.6 mt -116.4 141.86 47.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.708 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 18.4 t -101.35 2.28 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.936 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.491 ' CG ' ' HG ' ' A' ' 661' ' ' SER . 56.8 t0 -148.42 136.33 20.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 0.0 110.879 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . 0.456 ' H ' ' HB2' ' A' ' 685' ' ' SER . . . -61.48 -37.9 94.9 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 661' ' ' SER . . . . . 0.491 ' HG ' ' CG ' ' A' ' 659' ' ' ASP . 90.0 p -60.02 -34.98 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.832 0.349 . . . . 0.0 110.229 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 19.2 m -64.75 -39.6 93.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.642 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.87 -43.61 95.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.043 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.72 -39.31 84.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.37 . . . . 0.0 110.834 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . 0.576 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 23.4 t70 -62.43 -41.52 98.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.949 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -90.08 -45.23 9.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.126 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.52 ' O ' ' N ' ' A' ' 671' ' ' GLN . 0.9 OUTLIER -44.56 -44.64 8.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.2 -179.132 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.576 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 30.1 p-10 -61.81 -35.74 79.08 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.45 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . 0.482 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 65.3 mt -78.23 -48.16 16.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.933 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.62 -29.32 30.2 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.527 -179.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.52 ' N ' ' O ' ' A' ' 667' ' ' LEU . 6.6 mt-30 45.56 81.17 0.26 Allowed Pre-proline 0 C--N 1.329 -0.321 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.115 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.69 157.19 18.69 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 123.028 2.485 . . . . 0.0 112.427 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . 0.405 HD11 HG22 ' A' ' 673' ' ' ILE . 26.3 pt -94.02 -10.7 9.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.69 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 83.4 t -139.7 134.05 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.54 179.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 62.2 mt -128.93 119.54 49.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.05 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 3.5 mp -107.68 137.68 45.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.071 179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.531 ' SD ' ' SG ' ' A' ' 686' ' ' CYS . 74.8 mtm -138.17 133.44 33.31 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.197 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . 0.587 ' O ' ' OD2' ' A' ' 683' ' ' ASP . . . -67.51 145.05 55.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.248 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.767 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 32.9 t-105 -113.21 -15.1 0.11 Allowed Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.767 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 75.4 Cg_exo -46.6 162.79 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.711 1.607 . . . . 0.0 112.296 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.519 ' N ' ' HD2' ' A' ' 682' ' ' PRO . 23.8 Cg_exo -50.47 -49.99 14.91 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.678 2.252 . . . . 0.0 114.112 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 10.7 Cg_endo -55.79 -6.12 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 121.51 1.474 . . . . 0.0 111.234 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.587 ' OD2' ' O ' ' A' ' 678' ' ' ALA . 27.3 t0 -83.53 155.23 23.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.96 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -179.09 -31.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.508 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 685' ' ' SER . . . . . 0.456 ' HB2' ' H ' ' A' ' 660' ' ' GLY . 83.7 p -66.3 -28.31 68.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.592 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.531 ' SG ' ' SD ' ' A' ' 677' ' ' MET . 1.6 t -61.25 -22.25 64.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 88.1 mt -64.79 -34.61 78.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.913 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.2 -39.86 86.4 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.968 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.402 HD12 ' SD ' ' A' ' 677' ' ' MET . 7.3 tt -61.85 -40.88 96.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.022 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.26 -38.56 83.89 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.335 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . 0.465 ' HA ' ' NH1' ' A' ' 694' ' ' ARG . 60.8 tt0 -61.01 -42.14 97.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.978 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -58.36 -49.35 77.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.105 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.62 ' O ' ' N ' ' A' ' 697' ' ' GLN . 64.0 mt -55.53 -38.77 69.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.523 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . 0.465 ' NH1' ' HA ' ' A' ' 691' ' ' GLN . 34.0 ttm105 -65.24 -37.57 87.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -68.41 -37.79 80.66 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.738 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -127.75 41.22 3.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.428 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.62 ' N ' ' O ' ' A' ' 693' ' ' LEU . 63.3 tp60 -57.26 -37.05 71.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.239 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -87.07 113.23 22.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.115 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -168.38 128.96 1.09 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.744 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -44.06 155.09 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 122.355 2.037 . . . . 0.0 111.734 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 56.98 60.36 7.29 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 703' ' ' PRO . 11.8 Cg_endo -57.49 113.5 1.53 Allowed 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.082 2.522 . . . . 0.0 112.4 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 702' ' ' PRO . 46.5 Cg_exo -51.35 -149.61 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 94.8 mt -154.25 123.25 6.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.328 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.573 ' O ' ' OG ' ' A' ' 722' ' ' SER . 21.1 t -107.36 127.17 63.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.17 0.509 . . . . 0.0 111.499 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 5.2 mp -121.35 139.37 53.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.363 179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -106.78 128.79 54.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.105 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.6 mt -93.71 146.79 23.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.598 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 86.66 -126.04 7.7 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -90.26 159.44 41.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 110.779 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.04 149.05 22.23 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.787 2.324 . . . . 0.0 112.338 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -64.92 145.61 86.09 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.71 2.274 . . . . 0.0 112.052 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 79.7 t -80.13 -37.68 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . 0.636 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.3 OUTLIER -71.98 139.57 82.7 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.494 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.28 -17.01 21.88 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.599 2.199 . . . . 0.0 112.925 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 21.3 tp -70.05 -38.93 75.95 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.829 -0.349 . . . . 0.0 111.015 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.513 ' CD1' ' CH2' ' A' ' 679' ' ' TRP . 48.5 mt -77.06 -34.86 57.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 61.0 m -64.98 -41.14 95.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.922 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.89 96.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.429 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -82.76 -8.22 59.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.56 131.66 41.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.573 ' OG ' ' O ' ' A' ' 705' ' ' VAL . 83.4 p -86.42 -29.18 23.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.667 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.08 131.77 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 60.9 mt -93.16 128.48 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.119 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 33.8 mt -107.79 148.48 29.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.387 . . . . 0.0 111.252 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.5 t -167.42 -66.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.517 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . 0.43 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 0.7 OUTLIER -135.06 59.74 35.72 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.207 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 63.5 Cg_endo -79.72 141.14 15.19 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.915 2.41 . . . . 0.0 112.295 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.517 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.2 OUTLIER -67.01 109.3 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.771 179.698 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.517 ' O ' ' O ' ' A' ' 729' ' ' LEU . 31.1 m-20 54.85 147.84 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.39 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -63.32 0.25 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 123.083 2.522 . . . . 0.0 111.898 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 730' ' ' ASP . 95.0 mt-30 -68.13 -29.95 68.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.581 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.8 tp -63.71 -42.86 97.89 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.55 -43.65 89.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.193 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.4 mt -61.53 -36.9 81.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.168 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.7 m -58.9 -42.26 89.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.331 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.8 m -62.0 -42.78 99.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.609 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.5 tt -64.78 -43.95 91.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.668 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 741' ' ' LEU . 96.9 mm-40 -66.53 -32.33 73.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.889 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.39 -5.93 0.37 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.145 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 739' ' ' GLN . 38.7 tp -77.54 -39.0 47.46 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.783 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 742' ' ' CYS . 39.5 t 52.93 63.18 8.93 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.484 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.88 116.75 2.86 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.537 2.158 . . . . 0.0 111.751 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -90.39 131.58 1.72 Allowed 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.77 2.313 . . . . 0.0 112.408 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . 0.539 ' OXT' ' CG ' ' A' ' 745' ' ' ASN . 35.8 p-10 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.745 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 153.99 157.01 7.91 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -93.98 135.64 35.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . 0.423 HG12 ' CG1' ' A' ' 674' ' ' VAL . 59.1 mt -115.82 135.93 54.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.366 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 16.3 tp -111.0 130.41 55.6 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.868 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.432 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 19.0 tp -116.09 125.65 52.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.771 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.419 HD22 ' SG ' ' A' ' 686' ' ' CYS . 14.7 tp -118.37 112.93 20.65 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.575 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 84.2 tt0 -160.35 164.96 32.06 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.719 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.505 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 77.5 mm-40 -106.07 168.2 9.29 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.3 tp10 67.7 110.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.42 . . . . 0.0 110.48 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.604 ' O ' ' OG1' ' A' ' 641' ' ' THR . 63.0 t0 -56.99 -36.02 69.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.292 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -62.67 -42.13 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.353 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.32 -45.99 57.53 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.563 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.1 -36.39 84.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.576 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.604 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 77.2 m -63.34 -46.55 86.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.646 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 41.7 t -54.69 -50.25 61.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.515 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 98.8 t -58.92 -43.52 88.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.87 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.54 ' O ' ' OG1' ' A' ' 648' ' ' THR . 71.1 m -67.34 -37.51 83.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.796 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -62.25 -39.48 93.01 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.352 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.6 mtm -65.8 -49.75 67.14 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.942 -0.703 . . . . 0.0 109.855 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 42.0 mt -70.52 -43.58 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.663 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.54 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 85.0 m -55.83 -42.36 75.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.938 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.91 -33.79 76.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -76.14 -5.46 46.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.43 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.74 14.8 66.91 Favored Glycine 0 CA--C 1.53 1.023 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -91.33 143.68 26.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . 0.432 ' HG2' ' HZ1' ' A' ' 653' ' ' LYS . 58.4 mttm -91.37 114.54 27.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . 0.432 ' CG1' ' HB2' ' A' ' 632' ' ' LEU . 61.1 t -128.82 134.25 64.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.095 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 53.0 mt -112.49 125.02 69.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.403 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.575 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 22.6 t90 -94.53 119.92 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 52.8 mt -119.58 149.31 42.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.992 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . 0.574 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 30.6 m -113.38 10.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.635 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 85.5 m-20 -149.86 121.06 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.271 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.92 -42.29 99.62 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 79.9 p -58.93 -37.67 77.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.074 0.464 . . . . 0.0 110.22 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 29.0 m -65.27 -39.69 92.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.103 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.593 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -64.62 -41.78 95.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.184 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . 0.443 HD11 ' HD1' ' A' ' 692' ' ' HIS . 89.8 mt -59.19 -46.12 89.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 111.446 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -61.78 -40.38 94.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.022 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -88.61 -54.79 4.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.476 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.593 ' N ' ' O ' ' A' ' 663' ' ' ALA . 10.3 tt -48.32 -35.19 11.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.484 -178.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -53.55 -40.61 65.68 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.193 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 57.0 mt -79.51 -24.98 41.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.724 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 32.3 mt -71.57 -35.61 70.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.801 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.499 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.2 mm-40 47.23 63.87 9.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 5.9 Cg_exo -73.11 160.02 46.38 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 123.178 2.586 . . . . 0.0 112.857 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 81.1 mt -94.53 -23.1 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.992 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . 0.423 ' CG1' HG12 ' A' ' 630' ' ' ILE . 10.5 p -145.82 141.07 21.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.067 0.461 . . . . 0.0 111.13 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 79.0 mt -124.32 119.35 56.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.192 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 70.2 mt -105.5 131.44 52.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.36 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 7.2 ptm -145.83 138.29 25.58 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.99 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.38 149.31 48.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.702 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 28.3 t-105 -110.63 -34.33 0.13 Allowed Pre-proline 0 C--N 1.328 -0.334 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.993 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.702 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 39.0 Cg_exo -52.56 -41.48 67.99 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.23 1.954 . . . . 0.0 112.762 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 24.0 Cg_exo -59.63 134.52 58.32 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.133 1.889 . . . . 0.0 112.094 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.35 33.33 0.52 Allowed 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.883 2.389 . . . . 0.0 112.437 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -81.45 111.76 18.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.153 0.502 . . . . 0.0 110.873 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -61.04 -24.94 66.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.68 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 38.6 m -59.95 -36.54 77.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.511 ' O ' ' CD1' ' A' ' 690' ' ' LEU . 73.6 m -59.97 -34.55 73.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.58 -34.91 79.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.416 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.57 ' CD1' ' C ' ' A' ' 688' ' ' LEU . 0.3 OUTLIER -70.48 -35.65 73.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.24 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.479 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 4.9 tp -60.47 -43.71 96.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.71 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.511 ' CD1' ' O ' ' A' ' 686' ' ' CYS . 7.0 mp -61.94 -38.89 90.18 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.857 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -60.13 -41.98 93.84 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.206 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.443 ' HD1' HD11 ' A' ' 664' ' ' LEU . 3.5 t-160 -61.6 -54.63 40.46 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.575 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.557 ' N ' ' CD2' ' A' ' 693' ' ' LEU . 1.7 mm? -55.17 -37.66 67.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.124 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -60.37 -37.16 79.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.263 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -68.44 -40.89 80.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.164 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.625 ' C ' ' ND1' ' A' ' 696' ' ' HIS . 0.1 OUTLIER -104.71 13.5 31.32 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.236 -179.697 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.464 ' N ' ' O ' ' A' ' 693' ' ' LEU . 54.8 tt0 -61.86 -29.49 70.22 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -78.1 1.46 21.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.77 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.45 146.39 88.89 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.89 148.24 58.02 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.577 2.185 . . . . 0.0 111.725 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.455 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 2.7 m-70 51.4 55.64 16.05 Favored Pre-proline 0 C--N 1.33 -0.278 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 17.8 Cg_endo -63.26 141.63 82.94 Favored 'Trans proline' 0 C--N 1.306 -1.661 0 C-N-CA 122.87 2.38 . . . . 0.0 112.342 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -69.59 149.16 67.65 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.721 2.281 . . . . 0.0 111.914 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 37.1 mt -78.71 141.35 37.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.498 ' O ' ' N ' ' A' ' 722' ' ' SER . 59.8 t -121.84 125.96 73.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.309 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.458 HD11 ' N ' ' A' ' 706' ' ' LEU . 5.4 mp -131.2 138.17 49.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.072 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . 0.465 ' CE2' ' HB3' ' A' ' 721' ' ' ALA . 13.0 m-85 -113.37 130.31 56.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.505 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . 0.459 ' CD1' ' N ' ' A' ' 708' ' ' LEU . 5.4 mp -94.88 148.72 22.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.408 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . 0.581 ' O ' ' O ' ' A' ' 725' ' ' LEU . . . 101.83 -134.93 11.94 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.36 154.09 48.73 Favored Pre-proline 0 CA--C 1.529 0.173 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -81.87 131.83 7.24 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 C-N-CA 122.655 2.236 . . . . 0.0 112.586 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -52.17 152.01 15.75 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.106 1.871 . . . . 0.0 111.636 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 76.9 t -80.99 -21.9 10.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.868 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -72.53 132.27 83.81 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.678 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -74.45 -30.22 8.41 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.281 1.987 . . . . 0.0 111.886 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . 0.497 ' HG ' ' N ' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -75.69 -32.18 60.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.957 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.497 ' N ' ' HG ' ' A' ' 716' ' ' LEU . 42.3 tp -76.78 -42.91 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 30.4 m -64.4 -39.41 93.79 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.72 -32.1 73.46 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -71.06 -31.43 67.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.853 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . 0.465 ' HB3' ' CE2' ' A' ' 707' ' ' PHE . . . -70.87 150.46 45.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.683 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.498 ' N ' ' O ' ' A' ' 705' ' ' VAL . 74.2 m -84.18 -26.95 28.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.148 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 159.45 5.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.359 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 73.9 mt -142.45 131.99 22.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.157 -179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.581 ' O ' ' O ' ' A' ' 709' ' ' GLY . 5.3 mp -102.93 148.43 25.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.242 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 20.6 p -165.71 6.63 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.128 0.49 . . . . 0.0 110.06 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -139.22 64.12 31.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.953 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -55.91 126.4 22.3 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.269 1.979 . . . . 0.0 112.477 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.469 ' CD1' ' O ' ' A' ' 729' ' ' LEU . 0.3 OUTLIER 178.49 -14.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.907 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -143.87 75.23 16.08 Favored Pre-proline 0 CA--C 1.528 0.12 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.378 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -56.52 -9.89 4.34 Favored 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.621 2.214 . . . . 0.0 111.408 179.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.671 ' O ' ' NE2' ' A' ' 732' ' ' GLN . 0.0 OUTLIER -72.64 -22.48 60.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.438 -179.462 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.71 -47.63 68.81 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 66.9 tp -59.97 -43.96 94.75 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.676 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 24.4 tp -59.06 -38.46 79.47 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 94.1 m -60.45 -37.1 79.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.505 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 57.7 m -59.85 -47.72 84.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.418 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.73 -38.77 87.34 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.504 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.632 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.4 mm-40 -64.61 -28.92 69.95 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.916 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -55.11 3.21 0.02 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.632 ' H ' ' C ' ' A' ' 739' ' ' GLN . 39.6 tp -79.14 -35.25 42.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.805 0.336 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 57.98 62.49 5.04 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.114 0.483 . . . . 0.0 110.524 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -82.47 116.92 2.68 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 122.334 2.023 . . . . 0.0 110.836 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -84.48 151.41 11.83 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.741 2.294 . . . . 0.0 112.343 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 65.3 t30 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.035 -0.984 . . . . 0.0 110.584 -179.789 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . 0.516 ' C ' ' H ' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -71.25 14.53 1.66 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . 0.516 ' H ' ' C ' ' A' ' 627' ' ' ALA . 3.0 m-70 -88.0 136.21 33.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.968 0.414 . . . . 0.0 110.925 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 78.6 mt -115.69 140.17 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.459 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 63.2 tp -108.76 132.08 54.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.964 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 8.4 tt -135.19 123.32 22.88 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.189 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 633' ' ' LEU . 9.6 mp -107.59 115.48 30.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.094 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.463 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.9 tt0 -159.92 157.59 29.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.886 0.374 . . . . 0.0 111.177 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.654 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.1 tt0 -115.37 144.52 43.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.394 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.654 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 42.6 tp10 110.96 109.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.724 0.64 . . . . 0.0 110.338 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.702 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.0 p30 -66.62 -34.42 77.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.745 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.702 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.8 mt-10 -67.43 -50.7 58.25 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.679 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -68.23 -36.14 79.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.171 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.483 ' HA ' ' CZ2' ' A' ' 656' ' ' TRP . . . -68.85 -40.15 79.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.23 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 62.4 m -60.89 -47.63 85.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.023 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 92.0 t -58.11 -53.37 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.467 . . . . 0.0 110.439 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.96 -46.43 94.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.252 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.578 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.7 t -56.09 -39.96 72.9 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.574 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -61.38 -37.32 82.97 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.95 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.1 mtt -66.12 -54.18 28.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.324 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.05 -43.68 78.13 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.539 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.578 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 29.3 m -55.86 -42.38 75.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.251 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.92 64.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.758 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -68.99 -4.93 18.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.611 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.35 -0.85 78.62 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -98.19 137.3 37.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.164 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -93.6 126.91 39.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.866 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 10.5 m -126.04 151.59 32.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 110.986 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 19.1 mm -108.91 127.48 65.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.62 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.483 ' CZ2' ' HA ' ' A' ' 640' ' ' ALA . 3.6 t-105 -96.16 119.3 34.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.05 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.507 ' HG ' ' H ' ' A' ' 659' ' ' ASP . 16.7 tp -132.62 139.08 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.969 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 17.6 m -99.13 -7.81 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.143 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.507 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 93.0 m-20 -98.39 155.15 17.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -97.24 -64.14 0.9 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.95 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.8 t -57.78 -39.9 78.56 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 121.128 -0.229 . . . . 0.0 111.441 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 60.2 m -62.78 -37.95 88.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.936 0.398 . . . . 0.0 110.406 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.598 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.6 -41.3 98.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . 0.47 HD12 ' CG ' ' A' ' 692' ' ' HIS . 61.1 mt -58.82 -47.45 84.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.065 0.459 . . . . 0.0 110.719 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -61.4 -38.82 88.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.688 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -83.87 -34.1 24.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.72 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.598 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.1 tt -50.93 -39.25 54.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.659 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -56.06 -35.95 67.52 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 74.5 mt -75.81 -30.54 59.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.459 179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 28.4 mt -71.79 -37.41 70.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.187 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.476 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 42.2 mm-40 45.36 60.78 13.04 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.647 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.476 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 95.6 Cg_endo -89.67 157.93 5.21 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 123.43 2.754 . . . . 0.0 112.552 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 24.0 pt -97.33 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.783 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 41.7 t -142.66 139.52 28.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.928 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 73.4 mt -124.73 126.05 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 5.1 mp -104.63 137.8 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.737 ' SD ' ' N ' ' A' ' 678' ' ' ALA . 0.2 OUTLIER -137.22 121.97 18.67 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.03 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . 0.737 ' N ' ' SD ' ' A' ' 677' ' ' MET . . . -66.63 153.91 41.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.79 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 56.9 t-105 -110.19 66.19 0.44 Allowed Pre-proline 0 C--N 1.328 -0.336 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.564 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -69.54 169.17 19.26 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.962 2.442 . . . . 0.0 111.454 178.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 682' ' ' PRO . 2.7 Cg_endo -50.02 172.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.243 1.962 . . . . 0.0 111.225 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.688 ' O ' ' N ' ' A' ' 684' ' ' GLN . 60.3 Cg_exo -25.73 -65.52 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.267 2.645 . . . . 0.0 112.989 -179.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.66 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 91.9 m-20 54.11 -70.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.482 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . 0.688 ' N ' ' O ' ' A' ' 682' ' ' PRO . 0.2 OUTLIER 103.37 -29.2 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.592 0.558 . . . . 0.0 111.113 179.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 86.5 p -66.04 -42.05 90.06 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 90.6 m -65.98 -36.65 83.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 110.578 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.4 mt -64.59 -32.79 74.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.869 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.596 ' CD1' ' C ' ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.95 -36.01 74.94 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.038 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.472 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 6.3 tp -59.51 -47.38 85.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.378 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.455 ' N ' HD21 ' A' ' 690' ' ' LEU . 4.6 mm? -61.76 -41.58 97.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.388 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.36 -42.78 96.5 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.623 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.479 ' HE2' ' NE2' ' A' ' 696' ' ' HIS . 5.7 t60 -58.07 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.569 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 88.2 mt -54.56 -42.75 71.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.115 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -65.11 -34.37 78.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.358 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.79 -36.54 78.4 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.479 ' NE2' ' HE2' ' A' ' 692' ' ' HIS . 2.0 m-70 -79.78 -51.25 9.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.423 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.623 ' O ' ' N ' ' A' ' 699' ' ' ASP . 88.3 mt-30 -63.06 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.128 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . 59.04 -46.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.349 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.623 ' N ' ' O ' ' A' ' 697' ' ' GLN . 0.7 OUTLIER -70.62 143.8 90.4 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.089 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.471 ' O ' ' CB ' ' A' ' 701' ' ' HIS . 28.8 Cg_endo -65.13 154.16 74.81 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.983 2.455 . . . . 0.0 112.374 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.75 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 7.5 t-80 79.09 31.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.109 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 19.5 Cg_endo -60.95 162.58 18.64 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.605 2.204 . . . . 0.0 111.849 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . 0.432 ' HG2' ' NE2' ' A' ' 697' ' ' GLN . 2.6 Cg_endo -49.26 155.67 2.97 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.716 2.277 . . . . 0.0 111.596 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 27.0 mt -77.03 138.62 39.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.691 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 24.8 t -121.69 132.59 70.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.19 137.51 48.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.634 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . 0.443 ' CE1' ' HB2' ' A' ' 721' ' ' ALA . 39.7 m-85 -113.77 121.83 45.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.259 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . 0.465 ' CD1' ' N ' ' A' ' 708' ' ' LEU . 4.1 mp -98.72 142.24 30.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.892 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 104.63 -134.3 11.93 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -92.14 157.29 41.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.946 0.403 . . . . 0.0 110.784 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -70.94 145.16 49.64 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.747 2.298 . . . . 0.0 111.719 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.72 145.81 70.67 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.636 2.224 . . . . 0.0 112.282 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.51 -40.09 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.7 144.53 86.03 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.373 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.38 -14.87 14.42 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 112.292 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.61 -32.21 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.652 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -76.67 -34.95 58.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.513 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 25.6 m -62.83 -41.88 99.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.782 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.82 92.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.032 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tp60 -75.95 -28.96 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.579 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . 0.443 ' HB2' ' CE1' ' A' ' 707' ' ' PHE . . . -73.5 126.53 30.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.949 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 84.8 p -86.61 -24.18 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.85 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.78 126.75 0.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.386 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.5 mt -90.19 131.06 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.624 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 18.6 mt -107.52 155.78 19.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.902 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 2.2 p -166.48 60.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.921 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . 0.462 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 15.1 tttt 57.65 61.77 5.78 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.308 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 62.7 Cg_endo -86.42 145.41 8.2 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.535 ' C ' ' CG ' ' A' ' 730' ' ' ASP . 1.6 mp -67.11 151.66 47.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.51 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.691 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.0 OUTLIER 50.88 93.43 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.13 8.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.847 2.364 . . . . 0.0 111.794 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.691 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -68.02 -25.66 65.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.671 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.03 -46.78 79.89 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.618 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.57 -44.78 89.87 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.73 -39.56 91.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.577 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 31.8 m -60.09 -36.85 78.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.101 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 44.6 m -60.56 -46.41 90.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.604 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.45 -39.52 92.13 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.364 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.691 ' C ' ' H ' ' A' ' 741' ' ' LEU . 6.2 tp-100 -63.86 -28.02 69.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.367 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.68 2.86 0.01 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.691 ' H ' ' C ' ' A' ' 739' ' ' GLN . 20.0 tp -75.09 -36.67 61.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.1 m 54.32 68.8 2.47 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.159 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.27 116.24 3.59 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 122.198 1.932 . . . . 0.0 111.121 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -88.47 153.64 6.5 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.733 2.289 . . . . 0.0 112.282 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 28.4 t30 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 117.915 -1.04 . . . . 0.0 110.572 179.92 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . 0.56 ' H3 ' ' CE1' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 79.03 40.28 17.21 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . 0.56 ' CE1' ' H3 ' ' A' ' 627' ' ' ALA . 58.4 m80 -88.37 135.35 33.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.944 0.402 . . . . 0.0 110.64 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 90.9 mt -112.67 138.51 41.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.286 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 17.3 tp -107.49 127.59 53.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.402 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 9.6 tt -131.63 123.41 27.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.664 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 47.9 mt -106.76 124.21 49.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.902 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.504 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.2 tt0 -159.47 163.53 35.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.672 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.504 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 78.5 tt0 -105.4 159.83 15.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.576 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.474 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 84.6 tt0 68.42 117.51 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.57 ' O ' ' OG1' ' A' ' 641' ' ' THR . 4.2 p30 -63.21 -34.58 77.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.669 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.93 -45.29 82.37 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.214 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.83 77.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.04 0.447 . . . . 0.0 110.127 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.458 ' HB3' ' CD1' ' A' ' 656' ' ' TRP . . . -66.44 -35.64 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.595 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.57 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.0 m -62.32 -46.63 87.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.694 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 55.2 t -56.91 -51.94 61.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.552 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.97 -48.1 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.667 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.522 ' O ' ' OG1' ' A' ' 648' ' ' THR . 71.7 m -67.04 -30.53 70.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 641' ' ' THR . 51.2 tp10 -61.34 -43.39 98.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.024 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 9.1 mmt -67.28 -43.88 80.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.182 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.69 -45.98 77.07 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.92 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.522 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 26.8 m -56.34 -42.83 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.465 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.66 65.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.449 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.23 -4.99 28.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.365 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.55 -4.98 73.59 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.56 139.48 32.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -94.07 126.94 39.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.43 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.2 p -130.54 142.96 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.571 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 18.7 mm -108.19 122.89 63.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.329 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.458 ' CD1' ' HB3' ' A' ' 640' ' ' ALA . 19.5 t90 -95.75 117.07 29.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.766 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 66.0 mt -118.57 147.49 43.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 3.6 p -110.12 20.64 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.265 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -149.44 123.67 9.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.677 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.35 -40.03 96.95 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.544 -0.623 . . . . 0.0 111.544 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 55.5 p -60.26 -38.72 84.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.081 0.467 . . . . 0.0 110.17 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.3 m -65.23 -35.46 81.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.902 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.542 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.78 -45.1 91.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.228 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . 0.446 ' CD1' ' HD1' ' A' ' 692' ' ' HIS . 44.6 mt -59.75 -41.06 90.14 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.558 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -63.0 -42.72 99.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -86.25 -42.6 13.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.973 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.542 ' N ' ' O ' ' A' ' 663' ' ' ALA . 1.1 tt -45.24 -44.67 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.889 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.97 -34.54 76.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.513 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 50.8 mt -78.4 -45.94 21.11 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.4 OUTLIER -83.49 -13.55 54.38 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.183 -0.607 . . . . 0.0 112.07 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.456 ' C ' ' O ' ' A' ' 670' ' ' LEU . 1.5 mt-30 38.24 74.82 0.61 Allowed Pre-proline 0 C--N 1.327 -0.393 0 C-N-CA 120.375 -0.53 . . . . 0.0 109.997 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -76.89 146.39 26.08 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.84 2.36 . . . . 0.0 112.289 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 21.8 pt -92.55 -13.13 8.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 14.5 p -145.02 139.06 22.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.215 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.16 125.09 70.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.934 0.397 . . . . 0.0 111.204 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.463 ' N ' HD13 ' A' ' 676' ' ' LEU . 5.4 mp -105.26 136.9 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 92.5 mtp -140.36 117.58 11.29 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.731 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -67.59 153.02 44.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.981 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.411 ' N ' ' O ' ' A' ' 708' ' ' LEU . 6.2 t-105 -120.98 57.97 6.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.209 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.444 ' O ' ' CB ' ' A' ' 683' ' ' ASP . 72.5 Cg_endo -77.0 152.78 31.97 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.891 2.394 . . . . 0.0 111.591 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.661 ' C ' ' H ' ' A' ' 683' ' ' ASP . 1.7 Cg_endo -51.11 -57.45 2.23 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.292 1.994 . . . . 0.0 112.523 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 10.0 Cg_endo -53.55 6.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.333 2.022 . . . . 0.0 111.987 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.661 ' H ' ' C ' ' A' ' 681' ' ' PRO . 56.8 t0 -76.45 148.93 36.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . 0.555 ' N ' ' OD1' ' A' ' 683' ' ' ASP . 10.3 pt20 -175.18 -43.85 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 34.1 t -64.09 -30.14 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.024 0.44 . . . . 0.0 110.382 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 87.6 m -58.84 -23.58 60.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.953 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.68 -37.97 89.36 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.508 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.483 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 0.8 OUTLIER -71.23 -39.55 71.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.941 -179.652 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.483 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 10.0 tt -60.84 -42.07 97.07 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.621 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 83.5 mt -60.48 -45.9 92.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.184 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -63.15 -40.99 99.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.199 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.446 ' HD1' ' CD1' ' A' ' 664' ' ' LEU . 7.7 t-160 -60.27 -60.94 3.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.557 ' CD1' ' C ' ' A' ' 693' ' ' LEU . 0.4 OUTLIER -55.46 -39.87 70.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . 0.488 ' N ' ' HG ' ' A' ' 693' ' ' LEU . 79.3 ttt180 -65.02 -33.86 77.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.026 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . 0.478 ' HG2' ' CE1' ' A' ' 696' ' ' HIS . 78.2 tt0 -65.64 -36.66 84.33 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.276 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.478 ' CE1' ' HG2' ' A' ' 695' ' ' GLU . 0.4 OUTLIER 165.81 72.95 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.117 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -61.56 -52.07 65.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.923 0.392 . . . . 0.0 110.634 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.536 ' C ' ' OD1' ' A' ' 699' ' ' ASP . . . -158.34 -13.84 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.985 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.536 ' OD1' ' C ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER -174.74 160.55 2.5 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -179.672 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.1 -10.07 5.43 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.863 2.376 . . . . 0.0 112.276 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.474 ' ND1' ' N ' ' A' ' 701' ' ' HIS . 3.0 m80 -123.96 75.57 57.96 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.087 0.47 . . . . 0.0 110.818 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -54.25 149.71 35.79 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 123.055 2.503 . . . . 0.0 112.403 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.2 173.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.579 2.186 . . . . 0.0 111.784 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.706 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.3 OUTLIER -77.15 137.36 38.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.416 HG11 ' CE1' ' A' ' 707' ' ' PHE . 44.1 t -122.05 131.18 73.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.067 0.46 . . . . 0.0 111.896 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 3.8 mp -112.35 134.63 53.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.731 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . 0.416 ' CE1' HG11 ' A' ' 705' ' ' VAL . 90.2 m-85 -115.64 129.92 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.465 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . 0.411 ' O ' ' N ' ' A' ' 679' ' ' TRP . 62.0 mt -106.11 140.49 39.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.884 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 117.32 -142.86 17.65 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -92.52 165.83 18.42 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.027 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.37 154.96 10.35 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.418 2.079 . . . . 0.0 112.022 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -60.06 169.22 5.04 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 123.076 2.518 . . . . 0.0 112.129 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.511 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 42.7 t -80.53 0.36 3.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.297 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -161.8 143.05 8.33 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.02 -10.98 25.11 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.694 2.263 . . . . 0.0 112.431 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . 0.558 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 3.5 mm? -69.52 -35.3 75.35 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.313 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.85 -31.43 59.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.8 m -60.98 -44.23 97.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.665 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.68 -37.12 85.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.871 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -77.37 -19.97 55.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.669 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.76 137.79 49.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.14 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.411 ' CB ' ' H ' ' A' ' 705' ' ' VAL . 67.3 m -86.26 -29.77 22.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.584 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.88 105.65 0.2 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 60.1 mt -93.13 129.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.658 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 6.4 mp -111.36 97.94 7.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 110.32 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 50.2 p -75.42 0.22 17.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.664 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -126.63 89.4 52.25 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.927 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.634 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 49.0 Cg_exo -51.99 154.65 9.86 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 123.016 2.477 . . . . 0.0 112.533 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.634 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 1.5 tp 98.15 -157.41 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.272 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 50.18 62.76 11.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.86 -19.43 62.02 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.445 2.097 . . . . 0.0 111.714 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.62 -36.31 65.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -70.13 -50.03 44.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.327 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 10.5 tp -58.02 -42.16 84.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.885 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 26.3 tp -62.84 -39.04 93.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.145 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.6 m -58.48 -47.62 83.47 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.412 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.9 m -65.15 -40.87 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.578 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.09 -45.72 87.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.657 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.672 ' O ' ' N ' ' A' ' 741' ' ' LEU . 98.1 mt-30 -66.08 -27.7 68.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.103 0.478 . . . . 0.0 109.955 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . 0.505 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -27.75 -33.01 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.432 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.672 ' N ' ' O ' ' A' ' 739' ' ' GLN . 6.3 mp -84.89 -73.05 0.45 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.852 0.358 . . . . 0.0 110.163 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.411 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 51.4 t 56.94 62.1 6.21 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.588 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.411 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 70.9 Cg_endo -82.92 117.01 2.54 Favored 'Trans proline' 0 C--N 1.303 -1.858 0 C-N-CA 122.569 2.179 . . . . 0.0 111.404 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -88.55 -8.79 5.15 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 122.639 2.226 . . . . 0.0 112.63 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 31.5 m120 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.527 179.984 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 72.13 124.84 0.07 OUTLIER Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -95.72 134.02 39.14 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . 0.437 HD12 HG22 ' A' ' 630' ' ' ILE . 64.7 mt -116.92 136.71 53.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 120.966 0.413 . . . . 0.0 110.461 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 21.1 tp -104.66 129.96 52.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.659 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 8.0 tt -127.47 121.96 32.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.183 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.483 ' CD1' ' O ' ' A' ' 657' ' ' LEU . 12.2 tp -110.17 121.51 45.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.429 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.521 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 85.9 tt0 -159.47 165.97 31.93 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.195 -0.602 . . . . 0.0 111.345 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 94.4 mt-10 -107.62 160.65 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.97 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 71.31 108.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 27.1 p-10 -57.19 -37.74 72.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.073 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -63.76 -43.15 97.26 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.857 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.6 -36.92 70.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.483 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.04 -42.64 80.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.023 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 645' ' ' GLU . 31.6 m -63.26 -45.84 89.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.801 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 86.5 t -56.62 -53.55 39.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.825 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.05 -47.59 92.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.403 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.609 ' O ' ' OG1' ' A' ' 648' ' ' THR . 70.2 m -65.35 -29.91 70.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.111 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 641' ' ' THR . 73.8 tt0 -61.55 -45.81 92.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.671 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 92.0 mmm -70.27 -42.86 71.54 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.784 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 73.5 mt -66.73 -43.01 85.36 Favored 'General case' 0 CA--C 1.522 -0.121 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.609 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 83.5 m -55.71 -40.15 72.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.28 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.81 -21.2 61.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.531 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -65.19 -5.1 6.03 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.809 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 102.45 -19.23 48.81 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -98.46 152.32 19.65 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.98 129.65 37.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.988 0.423 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 16.2 t -119.85 133.21 67.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . 0.419 HD11 HG22 ' A' ' 655' ' ' ILE . 27.1 mm -108.95 135.87 46.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.467 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 23.3 t90 -89.85 114.02 25.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.514 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.483 ' O ' ' CD1' ' A' ' 633' ' ' LEU . 4.6 mm? -112.27 136.24 51.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.047 0.451 . . . . 0.0 110.288 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . 0.61 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 4.4 p -117.42 19.95 6.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.994 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.61 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 89.4 m-20 -150.62 174.27 13.17 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.457 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -105.14 -63.47 0.65 Allowed Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.421 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 23.0 t -57.69 -36.99 72.69 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 51.1 m -62.86 -39.34 94.1 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.552 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.61 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.46 -39.67 95.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.585 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 61.9 mt -59.34 -39.42 83.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.003 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.78 -47.5 83.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.379 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -89.71 -42.68 11.19 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.683 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.61 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.6 tt -50.13 -36.78 31.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.041 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -56.22 -36.66 68.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.844 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 39.4 mt -77.47 -26.41 51.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.304 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 37.6 mt -73.05 -32.93 65.38 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.687 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.438 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 39.3 mm-40 46.3 58.87 16.15 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-O 121.207 0.527 . . . . 0.0 110.167 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.438 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 50.9 Cg_endo -74.06 150.07 42.48 Favored 'Trans proline' 0 C--N 1.302 -1.921 0 C-N-CA 123.459 2.773 . . . . 0.0 112.83 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 24.6 pt -100.54 -19.49 5.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.747 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 76.8 t -137.12 137.51 46.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.416 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . 0.417 HD12 HG22 ' A' ' 675' ' ' ILE . 65.9 mt -127.25 118.65 50.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 8.8 tt -105.1 130.81 53.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.838 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 61.4 mtt -138.53 133.1 32.18 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.481 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -71.0 150.84 45.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.695 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.733 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -116.88 -24.79 0.1 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 C-N-CA 120.274 -0.571 . . . . 0.0 112.302 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.733 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -48.61 -39.71 37.6 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 121.887 1.724 . . . . 0.0 113.14 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 15.0 Cg_exo -65.43 155.29 69.57 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.653 1.568 . . . . 0.0 111.799 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -53.55 -19.41 13.7 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.284 1.989 . . . . 0.0 112.093 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 61.55 161.2 0.07 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.507 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 179.77 -80.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.148 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 31.3 m -63.11 -32.87 74.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.573 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 5.9 p -60.94 -24.12 65.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.748 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.44 -35.3 80.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.544 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 1.0 OUTLIER -73.47 -37.77 65.65 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.308 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.544 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 8.4 tt -61.7 -46.94 87.54 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.79 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 82.6 mt -63.04 -42.42 99.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.515 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.12 -39.59 93.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.828 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -57.9 -53.55 56.92 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.801 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 697' ' ' GLN . 57.0 mt -55.82 -37.68 69.0 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.531 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . 0.674 ' NE ' ' OE1' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.78 -40.28 94.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.52 -39.2 77.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.754 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 15.9 m170 -100.16 8.07 44.11 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.721 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.428 ' OE1' ' CZ ' ' A' ' 694' ' ' ARG . 24.5 pt20 -52.69 -19.39 2.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.643 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -87.25 118.77 26.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.817 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.643 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 44.6 t0 107.17 -39.99 0.0 OUTLIER Pre-proline 0 N--CA 1.47 0.548 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.482 ' CD ' ' C ' ' A' ' 698' ' ' ALA . 72.4 Cg_endo -84.13 -158.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.936 1.757 . . . . 0.0 112.072 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -116.23 90.55 29.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.642 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -43.95 108.87 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.617 0 C-N-CA 122.966 2.444 . . . . 0.0 112.589 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -74.81 151.14 40.13 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.164 1.91 . . . . 0.0 112.069 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 48.0 mt -74.95 139.97 43.38 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' A' ' 722' ' ' SER . 46.1 t -123.73 129.04 74.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.918 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 707' ' ' PHE . 9.2 tt -116.22 133.58 55.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.935 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . 0.473 ' CE2' HG13 ' A' ' 705' ' ' VAL . 97.2 m-85 -116.22 137.51 52.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.01 0.434 . . . . 0.0 111.614 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 80.6 mt -99.77 154.76 18.06 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.037 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 84.89 -132.9 11.38 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -87.21 151.83 51.96 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 0.0 111.076 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.21 165.38 19.73 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 123.059 2.506 . . . . 0.0 112.325 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -62.51 160.47 31.75 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.868 2.378 . . . . 0.0 112.138 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.538 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.1 t -91.06 23.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.472 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . 0.538 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 12.7 m-20 -161.3 141.71 8.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.038 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.27 -15.62 35.22 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.801 2.334 . . . . 0.0 112.972 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . 0.452 ' H ' HD11 ' A' ' 716' ' ' LEU . 5.9 mp -69.77 -35.28 74.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.024 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 89.1 mt -75.46 -31.53 60.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 45.4 m -64.22 -43.91 93.52 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.14 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.12 -40.11 95.49 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.088 0.47 . . . . 0.0 109.956 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.674 ' OE1' ' NE ' ' A' ' 694' ' ' ARG . 31.8 tt0 -73.62 -29.28 62.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.813 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -68.59 140.45 55.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.94 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 705' ' ' VAL . 34.5 t -87.28 -28.13 22.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.292 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.68 168.54 6.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.186 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 53.2 mt -151.17 113.01 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.505 ' N ' HD13 ' A' ' 725' ' ' LEU . 6.6 mp -105.89 136.53 45.37 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.132 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.0 t -69.17 -81.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -103.39 128.36 27.68 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.64 142.29 52.75 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 121.997 1.798 . . . . 0.0 112.006 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 20.2 tp -176.38 138.8 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.404 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.598 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.4 OUTLIER 57.72 74.13 0.68 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.763 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.92 -5.19 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.492 2.128 . . . . 0.0 111.691 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.598 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -69.84 -30.26 67.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.219 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.7 -45.31 79.21 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 25.5 tp -57.26 -41.66 80.09 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.3 -40.37 96.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.208 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 87.9 m -59.28 -40.64 86.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.292 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 26.1 m -61.08 -41.76 97.25 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.154 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.37 -44.29 95.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.012 0.434 . . . . 0.0 110.374 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.563 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.7 mm-40 -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.568 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -59.0 4.77 0.09 OUTLIER Glycine 0 CA--C 1.529 0.914 0 C-N-CA 121.211 -0.519 . . . . 0.0 111.92 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.563 ' H ' ' C ' ' A' ' 739' ' ' GLN . 27.0 tp -81.76 -29.57 32.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.0 0.4 . . . . 0.0 110.284 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.473 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 23.5 t 63.55 61.71 1.72 Allowed Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.345 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 58.7 Cg_endo -86.65 117.52 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.714 2.276 . . . . 0.0 110.929 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -85.83 150.02 9.79 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.514 2.142 . . . . 0.0 112.677 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.92 -1.038 . . . . 0.0 110.416 179.338 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -76.59 148.24 35.1 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -94.84 139.04 31.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.863 0.363 . . . . 0.0 111.296 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 89.9 mt -114.3 145.56 19.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.289 179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 10.1 tp -107.69 134.5 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.765 0.317 . . . . 0.0 110.69 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.52 ' C ' ' CD1' ' A' ' 632' ' ' LEU . 0.2 OUTLIER -129.13 116.9 19.93 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.494 ' N ' HD12 ' A' ' 632' ' ' LEU . 6.6 tt -109.41 120.38 42.32 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.438 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 85.6 tt0 -159.41 153.96 24.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.479 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.658 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 82.6 tt0 -112.68 138.81 48.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.174 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.658 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 81.8 tt0 106.02 115.62 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.69 0.619 . . . . 0.0 110.381 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.562 ' O ' ' OG1' ' A' ' 641' ' ' THR . 34.0 t0 -60.65 -37.08 80.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.044 -179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -67.46 -50.1 60.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.301 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.37 87.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.973 0.416 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.641 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.54 -38.78 81.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.808 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.562 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 53.1 m -62.67 -44.39 96.37 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.782 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.85 -54.05 34.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.458 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.81 -41.26 87.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.452 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.775 ' SG ' ' CZ3' ' A' ' 656' ' ' TRP . 91.3 m -55.78 -43.47 76.8 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.454 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.17 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 90.1 mtp -68.08 -50.73 53.22 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.594 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 74.8 mt -68.25 -43.54 77.65 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.143 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 90.5 m -56.43 -42.27 77.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.98 -28.7 69.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.372 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -63.51 -17.03 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 86.5 2.68 84.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -95.04 149.17 21.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.052 0.453 . . . . 0.0 111.002 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -92.22 123.47 35.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.848 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 5.4 m -126.34 150.05 31.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.815 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 26.9 mm -108.49 125.45 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.775 ' CZ3' ' SG ' ' A' ' 644' ' ' CYS . 0.5 OUTLIER -95.24 125.71 40.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 111.383 -179.073 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 86.7 mt -124.45 143.52 50.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.457 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 7.6 m -101.15 2.91 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.048 0.452 . . . . 0.0 109.989 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.406 ' OD1' ' C ' ' A' ' 659' ' ' ASP . 57.1 p30 -153.21 173.62 15.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.909 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . 0.401 ' O ' ' HG ' ' A' ' 664' ' ' LEU . . . -102.23 -35.25 3.96 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.144 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 13.3 m -55.8 -44.29 77.68 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.863 0.363 . . . . 0.0 110.959 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 70.2 m -62.69 -36.78 84.03 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.66 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.25 -38.7 92.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.597 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 660' ' ' GLY . 18.3 mt -57.75 -47.68 81.8 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.881 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -63.83 -40.86 97.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.532 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -89.78 -54.56 4.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.947 0.403 . . . . 0.0 111.757 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.66 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.1 tt -45.05 -39.17 5.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.73 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -55.33 -37.28 67.21 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.535 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.17 -30.94 49.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.627 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 13.9 mt -71.91 -38.45 69.91 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.636 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 48.01 66.34 5.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -78.36 160.64 29.04 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 123.133 2.556 . . . . 0.0 113.156 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 74.7 mt -96.25 -23.03 4.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.098 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . 0.4 HG11 ' N ' ' A' ' 675' ' ' ILE . 40.6 t -143.73 140.12 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 120.872 0.368 . . . . 0.0 111.114 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . 0.4 ' N ' HG11 ' A' ' 674' ' ' VAL . 76.0 mt -126.46 121.89 59.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.032 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.542 ' CD1' ' N ' ' A' ' 676' ' ' LEU . 2.8 mp -114.75 133.91 55.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.457 ' N ' ' SD ' ' A' ' 677' ' ' MET . 3.5 mpp? -138.87 139.17 38.02 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.54 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.24 146.16 53.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.603 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.776 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -132.1 14.25 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.776 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 6.6 Cg_exo -50.89 -44.17 43.13 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 121.423 1.415 . . . . 0.0 112.353 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 40.7 Cg_endo -86.88 164.31 8.91 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 123.098 2.532 . . . . 0.0 112.827 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -71.04 -65.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.969 2.446 . . . . 0.0 111.937 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.462 ' OD1' ' O ' ' A' ' 683' ' ' ASP . 50.2 p30 -82.5 156.91 23.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . 0.48 ' CD ' ' SG ' ' A' ' 686' ' ' CYS . 49.5 tt0 -177.48 135.96 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.381 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 685' ' ' SER . . . . . 0.433 ' C ' ' H ' ' A' ' 687' ' ' LEU . 37.0 m -61.18 -27.99 68.81 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.856 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.718 ' SG ' ' CZ3' ' A' ' 679' ' ' TRP . 25.8 p -52.84 -14.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.01 0.434 . . . . 0.0 109.867 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . 0.472 HD13 ' H ' ' A' ' 684' ' ' GLN . 32.3 mt -64.22 -38.92 92.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.777 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 2.3 pp -70.46 -35.59 73.4 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.486 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 22.4 tp -57.84 -42.95 85.46 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.308 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 47.1 mt -62.18 -36.46 81.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.021 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -56.79 -41.75 78.27 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.434 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 29.3 t-80 -59.96 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.292 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 697' ' ' GLN . 40.8 mt -54.81 -40.36 69.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.718 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 66.2 mtm180 -63.97 -35.45 80.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -69.38 -35.94 76.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.012 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.616 ' CG ' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER -104.33 5.28 34.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.216 -179.122 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 693' ' ' LEU . 48.6 tt0 -58.45 -7.37 0.89 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.031 0.443 . . . . 0.0 110.144 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . -81.86 1.03 36.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.563 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.22 144.79 95.49 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.037 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.74 -8.29 17.23 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.621 2.214 . . . . 0.0 112.836 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -126.8 68.99 71.27 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.825 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -44.99 107.87 0.12 Allowed 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.598 2.199 . . . . 0.0 111.898 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.62 135.86 63.28 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.312 2.008 . . . . 0.0 112.45 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.489 ' CD1' ' N ' ' A' ' 704' ' ' LEU . 6.5 mp -80.87 141.91 34.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.998 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.47 HG23 ' CZ ' ' A' ' 707' ' ' PHE . 14.6 p -130.57 136.3 58.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.336 0.588 . . . . 0.0 110.998 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.408 ' CD1' ' HB1' ' A' ' 723' ' ' ALA . 12.4 tp -118.45 133.1 56.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.948 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . 0.47 ' CZ ' HG23 ' A' ' 705' ' ' VAL . 97.0 m-85 -110.02 130.33 55.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.014 0.435 . . . . 0.0 111.487 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.67 147.0 25.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.414 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 99.05 -131.58 10.62 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.639 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.2 162.92 35.98 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.21 151.93 20.85 Favored 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.631 2.22 . . . . 0.0 112.616 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -45.06 171.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.891 2.394 . . . . 0.0 112.868 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.533 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 96.9 t -83.63 3.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . 0.533 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -161.68 152.77 15.3 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.029 0.443 . . . . 0.0 110.817 -179.588 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -69.63 -8.8 24.53 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.941 2.427 . . . . 0.0 112.41 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.45 -34.35 74.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.665 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 1.6 mm? -77.22 -36.04 55.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.7 m -62.56 -41.78 99.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.864 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.95 92.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.209 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -75.59 -28.9 59.1 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . 0.412 ' HA ' ' CG1' ' A' ' 705' ' ' VAL . . . -69.67 153.78 42.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.849 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 57.6 p -85.18 -31.61 23.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . 0.408 ' HB1' ' CD1' ' A' ' 706' ' ' LEU . . . -174.35 151.1 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.403 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 65.6 mt -133.15 127.91 55.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.93 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.406 ' N ' ' CD1' ' A' ' 725' ' ' LEU . 8.9 mp -105.09 158.8 16.32 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.86 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.43 9.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.518 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . 0.655 ' CB ' ' HZ1' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -132.85 92.58 25.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.498 179.633 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.52 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 53.2 Cg_exo -47.48 149.18 4.69 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.611 2.208 . . . . 0.0 112.415 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 59.3 mt 98.85 172.99 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.132 0.895 . . . . 0.0 110.148 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 61.77 62.81 2.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.054 179.82 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -64.36 -8.46 16.92 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.918 2.412 . . . . 0.0 112.272 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -69.4 -29.71 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.209 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 11.4 tp -66.63 -43.01 85.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 53.0 tp -57.97 -43.72 86.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.301 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.08 -38.6 86.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 75.5 m -57.66 -41.46 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.3 m -62.23 -46.46 88.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.497 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 63.1 mt -66.06 -40.12 90.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.7 ' C ' ' H ' ' A' ' 741' ' ' LEU . 41.9 tt0 -66.21 -21.04 66.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.593 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.1 -2.73 0.01 OUTLIER Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.7 ' H ' ' C ' ' A' ' 739' ' ' GLN . 69.7 mt -84.11 -75.93 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 6.3 t 56.91 60.73 7.17 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.25 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -79.46 116.8 3.62 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.122 1.881 . . . . 0.0 110.934 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.66 144.44 11.21 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.59 2.193 . . . . 0.0 112.705 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 2.3 m120 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.491 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 141.35 153.43 5.95 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -94.64 136.75 34.58 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . 0.418 HG12 ' CG1' ' A' ' 674' ' ' VAL . 75.6 mt -117.19 135.74 56.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.874 0.369 . . . . 0.0 111.054 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 8.4 tt -109.03 128.65 55.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.784 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.449 ' C ' ' CD2' ' A' ' 632' ' ' LEU . 8.6 tt -127.16 127.38 44.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.952 0.406 . . . . 0.0 111.913 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 44.6 tp -108.74 111.76 23.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.768 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.493 ' HG3' ' N ' ' A' ' 635' ' ' GLU . 45.9 tp10 -160.28 156.9 27.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.933 0.397 . . . . 0.0 111.229 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 634' ' ' GLU . 85.4 tt0 -96.53 156.25 16.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.942 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 77.6 tt0 71.72 119.57 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.262 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 40.9 p-10 -62.99 -31.91 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.534 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.3 mt-10 -65.0 -40.83 95.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.336 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.84 62.3 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.918 0.389 . . . . 0.0 110.644 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -62.06 -35.28 78.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.946 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.502 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 86.6 m -62.79 -44.82 95.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.935 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 43.5 t -55.19 -53.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.448 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 58.4 t -60.77 -43.26 94.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.207 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.0 OUTLIER -67.39 -30.67 70.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.921 -179.676 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 641' ' ' THR . 41.6 tp10 -61.4 -45.49 94.11 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.163 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 93.6 mmm -65.3 -44.29 88.39 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.912 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.71 -43.45 80.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.252 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.5 m -55.9 -42.04 75.42 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -62.83 -32.34 73.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.329 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.43 -6.34 45.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.827 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 92.46 -0.21 70.82 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.293 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -91.61 148.25 22.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 117.073 0.436 . . . . 0.0 110.829 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -91.05 130.73 36.92 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.68 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 24.6 t -116.86 137.06 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.257 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . 0.402 HG23 HD11 ' A' ' 655' ' ' ILE . 59.6 mt -109.42 127.13 66.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.703 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -95.49 114.51 26.28 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 111.355 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 53.1 mt -116.46 145.23 43.44 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 2.4 p -116.17 10.86 7.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.183 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -149.64 128.25 12.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.459 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.09 95.22 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 m -59.2 -38.59 80.24 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.843 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 86.4 m -63.91 -40.31 96.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.859 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.7 -41.88 98.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.848 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 54.3 mt -59.2 -43.5 92.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -63.94 -38.75 92.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.376 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -89.68 -49.86 6.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.083 0.468 . . . . 0.0 111.037 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.1 tt -46.08 -46.2 16.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.427 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.597 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 52.3 t0 -62.6 -41.08 98.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 72.7 mt -77.2 -36.88 54.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.361 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.554 ' C ' ' CD1' ' A' ' 670' ' ' LEU . 0.1 OUTLIER -82.25 -39.99 22.23 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.137 -179.327 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 3.4 mt-30 54.08 75.38 0.63 Allowed Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 121.262 0.553 . . . . 0.0 110.236 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.33 165.3 32.13 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 123.684 2.923 . . . . 0.0 112.463 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 75.3 mt -93.25 -26.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.163 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . 0.418 ' CG1' HG12 ' A' ' 630' ' ' ILE . 10.9 p -142.68 138.62 28.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.069 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 71.9 mt -116.6 129.42 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.179 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.429 HD11 ' N ' ' A' ' 677' ' ' MET . 0.0 OUTLIER -106.5 130.43 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.429 ' N ' HD11 ' A' ' 676' ' ' LEU . 38.9 ttm -141.08 137.59 32.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.317 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . 0.449 ' CB ' ' OE1' ' A' ' 634' ' ' GLU . . . -67.66 153.06 44.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.495 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.76 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 37.9 t-105 -103.53 -19.82 0.19 Allowed Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.788 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.76 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 85.9 Cg_endo -85.51 121.45 2.24 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.966 1.778 . . . . 0.0 110.937 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -74.94 111.97 3.45 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.422 2.081 . . . . 0.0 112.748 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.8 -18.49 2.96 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.833 2.355 . . . . 0.0 111.061 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.529 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 22.3 t70 -160.31 -11.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.43 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 683' ' ' ASP . 90.3 mt-30 100.89 2.03 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 O-C-N 124.092 0.87 . . . . 0.0 110.873 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 21.9 m -65.13 -37.67 88.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.77 0.319 . . . . 0.0 111.158 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 78.8 m -62.13 -34.22 75.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.95 -32.83 74.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.186 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.53 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 0.3 OUTLIER -69.2 -37.13 77.95 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.237 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.53 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 0.2 OUTLIER -62.16 -41.55 98.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.245 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.535 ' C ' ' CD1' ' A' ' 690' ' ' LEU . 3.0 tm? -59.82 -40.63 89.1 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.47 -42.63 96.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.781 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -57.73 -50.18 74.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.505 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 79.4 mt -54.95 -39.74 69.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.558 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . 0.435 ' HG3' ' NE2' ' A' ' 697' ' ' GLN . 34.1 ttp180 -62.74 -33.55 75.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.646 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -67.5 -35.99 80.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.084 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -91.13 -3.36 57.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.212 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.435 ' NE2' ' HG3' ' A' ' 694' ' ' ARG . 1.0 OUTLIER -58.92 -11.89 3.87 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.925 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -84.75 0.73 49.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 110.681 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.36 166.36 35.54 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.324 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -56.62 -54.99 3.09 Favored 'Trans proline' 0 C--N 1.308 -1.576 0 C-N-CA 122.214 1.943 . . . . 0.0 111.959 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -135.87 72.9 61.17 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.827 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -48.4 158.23 1.1 Allowed 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.637 2.225 . . . . 0.0 111.874 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.19 151.56 43.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.816 2.344 . . . . 0.0 112.021 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.44 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 6.8 mp -77.51 140.13 39.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.138 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 722' ' ' SER . 44.4 t -120.29 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.113 0.482 . . . . 0.0 111.097 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 706' ' ' LEU . 5.5 mp -118.84 134.63 55.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -110.05 130.93 55.46 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.947 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . 0.47 ' CD1' ' C ' ' A' ' 708' ' ' LEU . 0.9 OUTLIER -101.05 140.48 35.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 119.12 -131.77 9.25 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 158.24 48.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.768 0.318 . . . . 0.0 110.352 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -75.14 116.31 4.52 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.786 2.324 . . . . 0.0 112.127 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.88 142.59 25.8 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.048 . . . . 0.0 111.997 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 93.3 t -82.75 -20.09 9.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.811 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.4 128.22 89.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.673 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -73.14 -30.14 10.95 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.213 1.942 . . . . 0.0 111.635 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.86 -35.12 69.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.208 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.613 ' CD2' ' CZ3' ' A' ' 679' ' ' TRP . 66.1 tp -73.3 -37.7 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.55 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 33.2 m -63.48 -40.07 96.14 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.857 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.09 89.82 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.352 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -74.69 -29.62 61.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.441 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -69.13 139.59 54.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.522 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.616 ' N ' ' O ' ' A' ' 705' ' ' VAL . 80.5 p -85.25 -28.59 25.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.502 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.93 121.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.208 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.3 mt -91.65 124.14 44.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.893 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 59.9 mt -103.14 124.37 48.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.726 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 726' ' ' SER . . . . . 0.403 ' HB2' ' H ' ' A' ' 727' ' ' LYS . 5.1 m -72.93 -79.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.746 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . 0.403 ' H ' ' HB2' ' A' ' 726' ' ' SER . 3.2 mttm -142.84 167.4 16.21 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.176 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -60.99 119.65 6.92 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 121.81 1.673 . . . . 0.0 111.477 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 7.1 tt -178.65 -40.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.823 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 730' ' ' ASP . 0.0 OUTLIER -129.82 72.17 81.99 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.955 0.407 . . . . 0.0 110.909 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -71.55 7.49 1.52 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.866 2.378 . . . . 0.0 111.9 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 733' ' ' LEU . 21.5 pt20 -71.92 -36.22 69.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.455 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . 0.462 ' N ' ' HG3' ' A' ' 732' ' ' GLN . 14.4 tp -66.93 -42.91 84.54 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.078 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 14.2 tp -56.63 -50.14 72.91 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.42 179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 85.6 mt -62.27 -37.12 84.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.147 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 66.1 m -59.0 -40.33 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.349 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 86.5 m -61.26 -47.5 85.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.622 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . 0.434 ' N ' HD13 ' A' ' 738' ' ' LEU . 7.0 mp -66.28 -45.08 81.69 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.511 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -66.35 -28.21 68.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.276 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.25 -36.9 16.94 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 78.8 mt -79.78 -37.93 34.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 49.05 63.99 9.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.573 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -81.24 116.49 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 C-N-CA 122.154 1.903 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -88.42 -3.41 6.74 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.51 2.14 . . . . 0.0 112.188 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.518 -179.824 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 103.28 68.77 0.79 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -89.81 136.1 33.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.773 0.321 . . . . 0.0 110.525 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.4 mm -112.11 134.78 53.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.661 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 56.1 tp -114.11 136.01 53.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.746 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.555 ' C ' ' CD2' ' A' ' 632' ' ' LEU . 6.8 tt -133.96 125.1 27.51 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.038 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.45 ' N ' HD22 ' A' ' 632' ' ' LEU . 9.3 tt -118.9 127.74 53.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.751 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.462 ' OE1' ' CD1' ' A' ' 656' ' ' TRP . 0.0 OUTLIER -159.06 171.57 19.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 0.0 111.028 -179.509 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -107.33 163.2 13.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.28 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 66.75 118.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.402 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -58.21 -37.33 74.61 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.185 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -64.91 -41.82 95.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.083 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -65.45 -39.11 91.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.906 0.384 . . . . 0.0 110.448 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.656 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -66.7 -39.51 88.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.727 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 59.6 m -62.06 -47.05 86.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.006 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.6 t -57.38 -53.67 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 61.1 t -60.53 -42.82 92.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.904 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.656 ' SG ' ' O ' ' A' ' 640' ' ' ALA . 74.9 m -56.89 -36.78 70.52 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -62.35 -40.07 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.293 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 16.3 mmt -65.38 -50.25 66.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.962 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 647' ' ' LEU . 10.0 mp -70.35 -45.55 65.88 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.434 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.544 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 48.5 m -55.87 -42.98 76.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.038 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.06 65.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.581 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.42 -11.3 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.18 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.12 -3.88 67.14 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.73 149.24 21.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.647 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -93.36 127.73 39.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.019 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . 0.437 HG21 ' N ' ' A' ' 655' ' ' ILE . 14.5 p -126.52 142.0 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.966 -179.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . 0.437 ' N ' HG21 ' A' ' 654' ' ' VAL . 14.9 mm -103.5 133.67 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.462 ' CD1' ' OE1' ' A' ' 634' ' ' GLU . 16.4 t90 -91.42 112.82 24.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.979 0.418 . . . . 0.0 111.509 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.516 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 3.8 mm? -111.93 138.49 48.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.89 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 35.4 m -110.88 8.51 8.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -150.48 130.82 13.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.51 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . 0.403 ' HA3' ' CD1' ' A' ' 633' ' ' LEU . . . -63.63 -45.09 95.42 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.269 -0.491 . . . . 0.0 111.99 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 19.8 m -60.84 -44.71 96.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 111.117 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.9 m -64.55 -35.15 80.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.04 -43.19 99.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.465 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . 0.554 ' CD2' ' HD1' ' A' ' 692' ' ' HIS . 90.8 mt -59.73 -47.26 86.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.348 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . 0.554 ' OD1' ' C ' ' A' ' 665' ' ' ASP . 0.5 OUTLIER -64.48 -37.55 87.92 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.97 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . 0.544 ' N ' ' OD1' ' A' ' 665' ' ' ASP . 23.8 mt-30 -83.36 -43.77 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.548 ' N ' ' O ' ' A' ' 663' ' ' ALA . 9.8 tt -48.57 -36.46 15.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.48 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -54.62 -39.83 68.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.022 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 73.6 mt -78.3 -27.65 47.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.357 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 15.7 mt -73.06 -38.82 66.33 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.594 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.431 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.4 mm-40 46.35 63.74 9.3 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 74.4 Cg_endo -83.56 152.95 13.54 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 C-N-CA 123.227 2.618 . . . . 0.0 112.61 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 19.5 tt -93.46 -18.75 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.272 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 59.7 t -145.24 137.57 20.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.01 0.434 . . . . 0.0 110.938 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 59.3 mt -126.08 122.49 61.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.011 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 632' ' ' LEU . 4.5 mp -109.66 133.73 52.78 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 76.1 mtm -144.69 133.79 22.76 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.987 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -66.14 154.13 40.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.786 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -117.05 80.45 11.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.78 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -94.7 114.61 0.19 Allowed 'Trans proline' 0 C--N 1.31 -1.489 0 C-N-CA 123.426 2.751 . . . . 0.0 112.142 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.578 ' C ' ' H ' ' A' ' 683' ' ' ASP . 20.3 Cg_exo -53.79 -42.59 65.1 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.207 1.938 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.599 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 31.9 Cg_exo -52.73 -5.17 0.17 Allowed 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.02 1.813 . . . . 0.0 111.033 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.599 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 83.2 m-20 -150.44 73.67 1.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.874 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.16 8.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.629 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 685' ' ' SER . . . . . 0.579 ' H ' ' C ' ' A' ' 683' ' ' ASP . 43.8 m -59.75 -27.47 66.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.806 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 85.6 m -57.01 -23.19 44.49 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.539 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 82.0 mt -63.76 -32.92 74.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.363 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.495 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 0.7 OUTLIER -69.68 -36.28 75.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.468 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.495 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 0.2 OUTLIER -61.63 -43.24 99.23 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.462 ' N ' HD21 ' A' ' 690' ' ' LEU . 3.8 mm? -60.83 -36.87 80.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.01 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -60.05 -43.55 95.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.763 ' HE2' ' HE2' ' A' ' 696' ' ' HIS . 15.5 t-80 -59.15 -49.75 76.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.511 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.14 -40.38 70.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.29 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -61.99 -33.8 74.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.985 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -67.08 -33.78 76.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.416 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.763 ' HE2' ' HE2' ' A' ' 692' ' ' HIS . 96.1 m-70 -100.66 5.98 43.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.626 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -57.1 -4.47 0.19 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.421 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.526 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . -84.52 4.65 30.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.164 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 696' ' ' HIS . 1.0 OUTLIER -70.4 145.66 93.31 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.264 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -67.52 -15.8 45.85 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.653 2.235 . . . . 0.0 113.028 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.55 ' ND1' ' H ' ' A' ' 701' ' ' HIS . 0.0 OUTLIER -127.06 69.01 73.03 Favored Pre-proline 0 C--N 1.329 -0.319 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.386 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -46.14 113.25 0.57 Allowed 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.687 2.258 . . . . 0.0 111.576 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.81 146.2 23.36 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.798 2.332 . . . . 0.0 113.201 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.464 ' CD1' ' N ' ' A' ' 704' ' ' LEU . 6.4 mp -81.5 143.89 31.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.659 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.42 HG23 ' CZ ' ' A' ' 707' ' ' PHE . 12.3 p -133.25 137.89 52.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.53 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.575 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 3.3 mp -119.37 135.56 54.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.25 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . 0.42 ' CZ ' HG23 ' A' ' 705' ' ' VAL . 95.3 m-85 -117.88 131.5 56.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.689 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 54.6 mt -99.89 142.52 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.805 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 110.71 -140.85 16.16 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -87.09 152.95 53.92 Favored Pre-proline 0 C--N 1.328 -0.326 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.523 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -74.19 153.1 45.85 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.547 2.165 . . . . 0.0 112.482 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . 0.454 ' HD2' ' HG1' ' A' ' 718' ' ' THR . 47.1 Cg_exo -48.38 162.4 0.33 Allowed 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.757 2.305 . . . . 0.0 112.863 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 2.2 t -84.46 16.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.056 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.63 148.21 11.27 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.983 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.83 -10.76 23.46 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.766 2.311 . . . . 0.0 112.958 -178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . 0.672 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 0.9 OUTLIER -70.58 -37.34 73.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.5 -179.63 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 48.1 mt -78.09 -38.8 43.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 718' ' ' THR . . . . . 0.454 ' HG1' ' HD2' ' A' ' 712' ' ' PRO . 86.7 m -63.8 -40.61 97.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.852 178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.91 89.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.24 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -76.57 -25.36 53.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.357 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.4 146.69 48.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 19.0 t -85.38 -27.36 25.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.669 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -169.84 154.77 5.45 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.165 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 39.0 mt -148.98 120.03 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.063 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 25.4 mt -104.23 115.12 29.84 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.784 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 8.8 m -70.08 -36.65 75.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.663 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -134.74 96.38 14.9 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -48.11 133.53 23.95 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.282 1.988 . . . . 0.0 111.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 16.6 tp -176.39 138.53 0.31 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.446 ' C ' ' H ' ' A' ' 732' ' ' GLN . 29.6 m-20 62.06 75.69 0.42 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.734 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.54 -9.3 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.715 2.277 . . . . 0.0 111.77 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 730' ' ' ASP . 93.1 mt-30 -69.89 -35.79 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 32.6 tp -67.3 -39.75 85.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 13.0 tp -57.32 -41.04 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.05 -38.95 93.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.752 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 71.9 m -59.2 -46.83 87.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.968 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.8 m -63.43 -41.68 98.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.583 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . 0.539 ' CD2' ' SG ' ' A' ' 742' ' ' CYS . 9.8 tt -63.32 -37.92 89.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.106 0.479 . . . . 0.0 110.045 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 741' ' ' LEU . 6.7 tt0 -64.84 -30.43 71.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.797 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.42 -5.06 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.16 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.674 ' N ' ' O ' ' A' ' 739' ' ' GLN . 19.1 tp -156.93 -41.5 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.194 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.572 ' CB ' ' CD ' ' A' ' 743' ' ' PRO . 1.4 m 28.82 -84.45 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.314 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.83 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.61 ' N ' ' O ' ' A' ' 741' ' ' LEU . 17.3 Cg_endo -58.14 121.32 9.8 Favored 'Trans proline' 0 N--CA 1.493 1.451 0 CA-C-N 120.276 1.134 . . . . 0.0 111.325 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -81.12 -4.19 12.49 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.577 2.185 . . . . 0.0 112.313 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . 0.507 ' OD1' ' O ' ' A' ' 745' ' ' ASN . 10.2 p30 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.366 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -161.37 -174.76 31.63 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -88.13 163.59 16.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.754 0.311 . . . . 0.0 110.538 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 65.4 mt -111.58 141.74 26.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.959 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . 0.555 ' C ' ' CD1' ' A' ' 631' ' ' LEU . 2.8 tm? -110.96 123.75 50.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.309 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.481 ' N ' HD12 ' A' ' 631' ' ' LEU . 10.2 tt -123.1 126.66 47.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.993 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 41.8 tp -111.13 117.08 32.29 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.483 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 84.2 tt0 -159.7 159.91 33.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.729 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.599 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 84.7 tt0 -106.91 141.08 38.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.382 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.599 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 28.6 tp10 93.23 115.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.443 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.7 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 57.3 p30 -63.6 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.7 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 49.5 tp10 -63.81 -47.2 81.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.941 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.37 -43.51 66.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.977 0.418 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.466 ' HB3' ' CG ' ' A' ' 656' ' ' TRP . . . -65.14 -40.49 94.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.128 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.585 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 90.3 m -61.73 -45.35 94.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.924 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 52.1 t -55.89 -52.0 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.237 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.53 -46.7 95.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.726 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.456 ' O ' ' OG1' ' A' ' 648' ' ' THR . 72.6 m -69.36 -32.99 72.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.015 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 641' ' ' THR . 85.0 tt0 -60.23 -43.48 96.01 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.575 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 73.6 mtp -71.25 -40.73 70.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.367 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 83.1 mt -67.84 -45.45 74.6 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.958 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.456 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 30.0 m -56.16 -42.59 77.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.72 -31.07 69.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.492 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -75.7 -1.97 27.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.535 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 84.64 10.42 79.42 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -94.92 136.14 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.439 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -95.82 121.52 37.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.933 0.396 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 13.0 p -136.6 140.24 43.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.313 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.47 128.69 65.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.466 ' CG ' ' HB3' ' A' ' 640' ' ' ALA . 26.3 t90 -95.38 117.64 30.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.342 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 69.2 mt -118.69 150.79 39.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.542 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 14.5 p -103.91 7.36 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.267 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.8 t0 -148.09 119.98 8.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -55.78 -35.85 64.15 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 37.5 m -58.88 -40.42 84.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.881 0.372 . . . . 0.0 110.467 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 53.2 m -63.76 -38.66 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.872 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.581 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -62.31 -40.27 95.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.973 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 60.7 mt -59.94 -37.58 79.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.636 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -63.04 -44.59 95.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.319 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -90.38 -41.68 11.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.623 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.5 tt -47.0 -46.02 21.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.27 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -61.85 -35.19 77.54 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.488 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 45.1 mt -76.97 -44.21 32.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.237 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.41 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.9 OUTLIER -83.55 -12.83 55.67 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.629 -178.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.41 ' C ' ' O ' ' A' ' 670' ' ' LEU . 37.4 mm-40 40.09 74.36 0.72 Allowed Pre-proline 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.35 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.449 ' CD ' ' HG ' ' A' ' 667' ' ' LEU . 56.2 Cg_endo -73.14 150.79 48.54 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.909 2.406 . . . . 0.0 112.448 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 27.5 pt -95.3 -12.13 8.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.461 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 88.4 t -140.13 134.77 36.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.304 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.3 mt -128.7 124.91 62.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.982 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.3 mp -103.38 143.59 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.932 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.482 ' CE ' ' HG ' ' A' ' 686' ' ' CYS . 80.3 mtp -139.12 116.25 11.03 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.002 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.72 146.19 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.003 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.706 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 20.6 t-105 -118.22 -35.67 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.74 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.706 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 26.0 Cg_exo -54.0 -42.54 65.96 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.252 1.968 . . . . 0.0 113.053 -179.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.511 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 74.1 Cg_endo -84.47 157.26 12.48 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.312 2.008 . . . . 0.0 112.07 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -48.54 -81.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.702 2.268 . . . . 0.0 111.528 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' A' ' 686' ' ' CYS . 85.4 m-20 53.35 57.13 6.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.587 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -53.67 -32.0 49.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.891 0.377 . . . . 0.0 110.26 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 17.3 m -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.212 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.482 ' HG ' ' CE ' ' A' ' 677' ' ' MET . 4.5 t -57.19 -29.55 63.79 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.286 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.88 -38.16 88.06 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.751 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.539 ' CD1' ' C ' ' A' ' 688' ' ' LEU . 0.4 OUTLIER -70.45 -37.89 74.4 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.468 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.499 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 9.7 tp -60.07 -41.56 92.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.552 ' C ' ' CD1' ' A' ' 690' ' ' LEU . 3.1 tm? -59.72 -42.73 93.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.515 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -60.29 -43.33 96.37 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.821 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -59.29 -51.65 69.03 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.085 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 74.2 mt -54.24 -43.33 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.275 0.56 . . . . 0.0 109.822 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -65.31 -30.56 71.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.106 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 696' ' ' HIS . 40.6 tp10 -65.3 -50.96 63.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.441 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.511 ' CD2' ' O ' ' A' ' 696' ' ' HIS . 0.6 OUTLIER 173.67 66.76 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.72 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.419 ' CD ' ' C ' ' A' ' 697' ' ' GLN . 3.4 tm0? -57.79 -46.73 84.21 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.174 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.607 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . -160.93 78.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.728 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.607 ' O ' ' O ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER 44.18 179.23 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 120.737 -0.385 . . . . 0.0 109.987 -179.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 699' ' ' ASP . 50.9 Cg_exo -50.03 148.17 13.81 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.168 1.912 . . . . 0.0 111.895 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.576 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 11.6 m170 62.7 46.84 0.85 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.637 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 12.2 Cg_endo -59.04 169.23 3.74 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 122.9 2.4 . . . . 0.0 111.92 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -47.17 155.01 1.13 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.938 2.426 . . . . 0.0 111.861 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.43 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 34.0 mt -76.69 146.53 38.01 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 13.7 p -123.74 135.72 62.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.22 0.533 . . . . 0.0 110.931 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.554 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 4.3 mp -122.16 138.14 54.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.654 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -107.3 130.08 54.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.908 0.385 . . . . 0.0 110.188 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . 0.637 ' CD1' ' N ' ' A' ' 709' ' ' GLY . 0.1 OUTLIER -94.9 136.88 34.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.392 -179.711 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . 0.637 ' N ' ' CD1' ' A' ' 708' ' ' LEU . . . 99.62 -132.74 11.04 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -90.01 149.39 41.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.886 0.374 . . . . 0.0 110.67 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.75 151.27 45.98 Favored 'Trans proline' 0 C--N 1.307 -1.626 0 C-N-CA 122.866 2.378 . . . . 0.0 112.158 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.53 157.39 41.81 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 122.675 2.25 . . . . 0.0 111.789 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 80.5 t -77.98 -38.54 24.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.795 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -72.73 136.27 80.5 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.562 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -74.76 -12.88 22.09 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 C-N-CA 122.596 2.197 . . . . 0.0 112.495 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.4 mt -70.86 -31.44 68.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 61.4 mt -76.48 -33.71 58.68 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 62.2 m -63.11 -42.48 99.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.885 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.77 91.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.354 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -78.55 -22.63 46.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.729 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.97 138.09 47.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.453 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.43 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 22.2 t -85.56 -26.79 25.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.147 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -169.19 152.43 5.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 69.3 mt -130.11 128.83 65.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.012 0.434 . . . . 0.0 110.642 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.529 ' O ' ' O ' ' A' ' 709' ' ' GLY . 58.1 mt -104.59 149.76 25.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.143 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 55.7 p -165.45 -2.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.81 0.338 . . . . 0.0 110.626 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -127.07 81.9 69.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.828 179.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.654 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.5 Cg_exo -49.67 147.99 12.65 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.061 2.507 . . . . 0.0 112.57 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.654 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 15.9 tp 105.5 154.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.945 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.523 ' C ' ' H ' ' A' ' 732' ' ' GLN . 17.3 t0 63.19 62.65 1.71 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . 0.467 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 28.6 Cg_exo -57.44 -0.06 0.3 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.869 2.379 . . . . 0.0 111.868 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.523 ' H ' ' C ' ' A' ' 730' ' ' ASP . 12.1 mm100 -69.91 -29.77 67.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.595 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.66 -45.84 81.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . 0.427 HD13 ' CD2' ' A' ' 706' ' ' LEU . 37.6 tp -58.37 -40.87 83.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.573 178.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.6 -38.72 88.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.265 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 28.3 m -57.76 -40.24 79.27 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 82.9 m -60.96 -40.91 95.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.011 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.63 -38.38 90.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -63.49 -35.19 79.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -62.2 -11.25 31.92 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 53.3 tp -81.67 -21.21 38.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.992 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.2 m 59.46 69.6 1.27 Allowed Pre-proline 0 CA--C 1.519 -0.224 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -54.39 116.3 2.97 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.72 1.613 . . . . 0.0 109.93 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -87.0 154.33 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.506 2.137 . . . . 0.0 112.794 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 38.8 t30 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.563 -179.793 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 106.99 118.41 4.36 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -90.89 148.99 22.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.076 0.465 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.6 mm -112.18 134.92 53.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.202 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 632' ' ' LEU . 1.0 OUTLIER -107.44 124.61 50.12 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.237 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.466 ' N ' HD12 ' A' ' 631' ' ' LEU . 9.1 tt -131.33 127.05 36.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.648 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.44 ' CD2' ' SG ' ' A' ' 686' ' ' CYS . 6.7 tt -109.47 116.3 31.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.127 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.499 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 82.9 tt0 -159.97 158.15 30.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.599 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.519 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 22.2 pt-20 -100.5 162.46 12.92 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.519 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.8 tp10 83.56 112.65 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.458 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.686 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 93.2 m-20 -63.9 -36.0 82.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.625 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.414 ' CG ' ' N ' ' A' ' 639' ' ' ALA . 5.3 pt-20 -67.21 -37.33 83.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.138 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . 0.414 ' N ' ' CG ' ' A' ' 638' ' ' GLU . . . -71.29 -45.3 63.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.388 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.416 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -66.89 -35.68 80.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.749 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.527 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 89.5 m -62.29 -48.08 81.49 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.741 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.79 -47.43 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.147 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 57.4 t -61.07 -42.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.581 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.578 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.8 OUTLIER -62.43 -45.64 92.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -61.78 -38.38 87.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.905 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.96 -52.34 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.796 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . 0.458 HD11 ' N ' ' A' ' 647' ' ' LEU . 8.0 mp -68.46 -46.42 69.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.961 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.578 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.0 m -55.66 -39.86 71.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.773 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.24 -29.36 68.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.776 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -79.33 -3.18 44.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.02 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.71 -10.11 68.61 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . 0.402 ' CD2' HD11 ' A' ' 738' ' ' LEU . 81.9 m-85 -94.46 130.02 40.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -94.71 133.33 38.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.402 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . 0.522 ' CG1' ' SG ' ' A' ' 644' ' ' CYS . 9.0 p -131.0 140.88 47.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.194 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 11.5 mm -103.01 134.02 45.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.686 ' CH2' ' OD1' ' A' ' 637' ' ' ASP . 9.5 t90 -93.21 115.11 27.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.65 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 54.3 mt -114.84 141.57 47.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.685 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . 0.606 ' CG2' ' CZ2' ' A' ' 656' ' ' TRP . 40.2 t -98.39 -0.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.777 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.571 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 74.4 m-20 -150.76 146.91 26.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.789 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -69.32 -40.62 80.46 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.104 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 661' ' ' SER . . . . . 0.515 ' HG ' ' N ' ' A' ' 662' ' ' THR . 95.9 p -59.43 -37.93 79.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.718 0.294 . . . . 0.0 111.215 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 662' ' ' THR . . . . . 0.515 ' N ' ' HG ' ' A' ' 661' ' ' SER . 88.5 m -62.17 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 109.787 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.77 -43.21 97.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.005 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.58 -45.51 81.29 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.831 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 88.9 m-20 -64.08 -43.61 94.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.836 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -86.67 -52.6 5.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.091 0.472 . . . . 0.0 111.226 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.617 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.6 tt -45.08 -37.83 4.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.139 -178.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.559 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 21.4 p-10 -56.26 -40.02 73.53 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.047 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . 0.518 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 33.7 mt -79.3 -26.94 42.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 10.6 mt -72.23 -41.95 66.27 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.422 -178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 51.76 67.53 4.04 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.64 159.13 25.18 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.41 2.74 . . . . 0.0 113.369 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 61.1 mt -95.1 -23.37 5.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.988 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 17.3 t -143.54 139.39 26.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.556 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 63.5 mt -124.1 130.89 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.982 0.42 . . . . 0.0 111.539 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.487 ' CD1' ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -105.06 146.11 29.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.699 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.36 119.22 14.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.529 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.95 144.96 54.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.597 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.72 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.8 t-105 -118.16 -32.36 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.72 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.1 Cg_exo -49.33 -41.09 43.6 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.001 1.801 . . . . 0.0 112.769 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 11.0 Cg_exo -67.44 159.43 52.44 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.287 1.991 . . . . 0.0 111.513 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.39 -7.38 1.24 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.518 2.145 . . . . 0.0 111.349 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.642 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 13.6 t70 56.27 -129.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.458 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . 0.642 ' CB ' ' O ' ' A' ' 683' ' ' ASP . 3.3 tm0? 100.84 -78.31 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.372 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 60.5 p -66.88 -26.75 67.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.965 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.44 ' CB ' ' OD2' ' A' ' 683' ' ' ASP . 0.1 OUTLIER -61.25 -22.04 64.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.562 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.9 mt -62.72 -34.41 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.422 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 77.1 mt -67.76 -38.03 82.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.677 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.17 -47.64 84.57 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.03 0.443 . . . . 0.0 110.215 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.435 ' CD1' ' O ' ' A' ' 686' ' ' CYS . 6.5 mp -62.16 -32.88 73.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.62 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -60.29 -41.53 93.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.658 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.796 ' HE2' ' CE1' ' A' ' 696' ' ' HIS . 19.1 t-160 -56.93 -49.53 75.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.45 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.419 ' O ' ' N ' ' A' ' 697' ' ' GLN . 97.0 mt -56.32 -41.31 75.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.691 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -63.18 -39.82 95.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.948 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -69.78 -32.26 70.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.771 -0.371 . . . . 0.0 110.81 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.796 ' CE1' ' HE2' ' A' ' 692' ' ' HIS . 55.1 m170 -107.38 15.49 24.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.315 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.419 ' N ' ' O ' ' A' ' 693' ' ' LEU . 21.9 pt20 -59.62 -22.84 62.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.363 . . . . 0.0 110.422 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -84.55 2.31 41.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.379 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -69.72 140.2 89.11 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.702 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.01 144.64 94.17 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.22 1.947 . . . . 0.0 112.214 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.621 ' O ' ' CG ' ' A' ' 701' ' ' HIS . 9.5 t-160 51.31 60.44 14.35 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.023 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 701' ' ' HIS . 53.0 Cg_exo -46.74 142.39 10.35 Favored 'Trans proline' 0 C--N 1.303 -1.846 0 C-N-CA 122.998 2.465 . . . . 0.0 112.093 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.85 149.08 32.89 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.579 2.186 . . . . 0.0 112.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.422 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 5.3 mp -78.69 145.98 34.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.963 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 58.6 t -121.61 126.39 74.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.017 0.437 . . . . 0.0 111.087 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 44.6 mt -117.66 140.1 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.396 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -111.92 132.16 54.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 23.9 mt -94.84 148.29 22.46 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.391 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . 0.445 ' O ' ' OG ' ' A' ' 726' ' ' SER . . . 69.63 -119.51 9.21 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.4 148.57 40.79 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.854 0.359 . . . . 0.0 110.851 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.0 161.05 36.3 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.182 2.588 . . . . 0.0 112.937 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.7 154.21 70.61 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 123.252 2.635 . . . . 0.0 111.91 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 92.7 t -79.44 -34.77 16.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.44 127.61 92.71 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.24 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -69.63 -25.12 29.53 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . 0.579 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 3.7 mm? -71.49 -33.89 69.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 85.5 mt -78.13 -36.0 48.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 91.9 m -64.33 -44.91 90.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.919 178.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.05 -36.77 82.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.366 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -77.78 -6.9 55.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.114 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.98 144.27 45.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.245 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.422 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 38.0 m -85.45 -33.47 21.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.443 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.5 131.83 0.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . 0.421 HG23 HD11 ' A' ' 724' ' ' ILE . 78.0 mt -92.8 123.94 45.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.68 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.498 ' C ' ' HG ' ' A' ' 726' ' ' SER . 56.6 mt -109.52 150.91 27.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.657 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 726' ' ' SER . . . . . 0.498 ' HG ' ' C ' ' A' ' 725' ' ' LEU . 0.7 OUTLIER -168.27 -57.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -103.58 145.31 30.38 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.295 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.3 149.39 88.46 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.722 2.281 . . . . 0.0 111.707 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 7.0 tt -177.87 85.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.696 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.634 ' C ' ' H ' ' A' ' 732' ' ' GLN . 39.0 m-20 53.49 86.71 0.16 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.307 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.17 -0.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.568 2.179 . . . . 0.0 111.753 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.634 ' H ' ' C ' ' A' ' 730' ' ' ASP . 97.1 mt-30 -68.12 -28.87 67.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.482 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.46 -44.16 91.97 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.676 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.37 -43.51 92.87 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.73 -39.58 92.05 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.688 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 736' ' ' THR . . . . . 0.459 ' O ' ' N ' ' A' ' 740' ' ' GLY . 58.4 m -60.16 -39.8 87.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.62 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 30.2 m -59.36 -46.15 89.44 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.949 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . 0.402 HD11 ' CD2' ' A' ' 652' ' ' PHE . 87.9 mt -68.03 -50.71 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.981 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 742' ' ' CYS . 25.4 mt-30 -66.94 -27.25 67.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.344 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 736' ' ' THR . . . -49.83 -29.89 14.15 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 741' ' ' LEU . 5.5 mp -83.97 -16.8 42.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.456 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.405 ' N ' ' O ' ' A' ' 739' ' ' GLN . 57.1 m 53.43 60.92 11.43 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -82.93 116.22 2.46 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.321 2.014 . . . . 0.0 111.075 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -86.06 145.91 8.77 Favored 'Trans proline' 0 C--N 1.308 -1.554 0 C-N-CA 122.867 2.378 . . . . 0.0 112.945 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . 0.618 ' C ' HD21 ' A' ' 745' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.518 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 157.06 -133.15 3.47 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -90.72 136.59 32.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.407 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 74.3 mt -114.93 135.79 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.343 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . 0.417 ' CD2' HD13 ' A' ' 633' ' ' LEU . 8.1 tt -122.46 125.51 45.96 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.519 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.436 ' N ' HD13 ' A' ' 632' ' ' LEU . 4.5 mp -117.28 135.2 54.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.127 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.449 ' HB3' ' SG ' ' A' ' 686' ' ' CYS . 5.0 mp -107.96 111.41 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.65 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.484 ' HA ' HE22 ' A' ' 684' ' ' GLN . 87.2 tt0 -160.05 157.08 28.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.646 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.644 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 94.1 mt-10 -111.07 150.63 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.105 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.644 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 72.8 tt0 103.76 102.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.666 0.604 . . . . 0.0 109.705 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.586 ' O ' ' OG1' ' A' ' 641' ' ' THR . 54.4 t0 -56.19 -36.08 67.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.637 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.706 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.65 -45.49 52.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.937 0.398 . . . . 0.0 110.449 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.444 ' HB3' ' CD1' ' A' ' 656' ' ' TRP . . . -65.2 -38.79 91.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.913 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.586 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.2 m -62.37 -46.48 88.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.844 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 42.1 t -56.24 -53.51 38.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.777 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 76.2 t -59.22 -42.78 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.724 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.579 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.3 m -58.17 -40.86 82.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.16 -38.39 88.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.192 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 12.2 mmm -68.03 -49.14 63.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.279 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 39.4 mt -68.73 -43.08 76.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.973 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.579 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 65.6 m -56.05 -41.32 74.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.787 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.21 70.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.24 -5.39 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.781 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.73 5.98 83.45 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . 0.41 ' CE1' HD12 ' A' ' 735' ' ' LEU . 56.8 m-85 -95.47 135.41 37.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.879 0.371 . . . . 0.0 110.867 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 20.2 tttm -93.78 122.66 36.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.64 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . 0.407 ' HB ' ' CD1' ' A' ' 632' ' ' LEU . 6.2 m -128.31 150.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 111.276 -179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 27.4 mm -114.16 129.87 69.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.005 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.455 ' HE1' ' HB3' ' A' ' 634' ' ' GLU . 1.4 t-105 -96.77 133.86 40.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.88 0.371 . . . . 0.0 111.475 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.457 ' N ' HD21 ' A' ' 657' ' ' LEU . 4.3 mm? -120.12 140.94 50.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.589 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 19.3 m -107.53 6.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.957 0.408 . . . . 0.0 109.975 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.486 ' C ' ' OD1' ' A' ' 659' ' ' ASP . 48.6 p30 -153.36 -168.76 3.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.337 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -113.12 -37.24 1.38 Allowed Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 24.4 m -58.84 -45.77 89.29 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 53.7 m -65.01 -36.71 85.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.228 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.13 -45.9 91.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.797 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 94.4 mt -57.88 -45.08 86.9 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.323 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -63.1 -41.16 99.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.004 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . 0.489 ' CG ' ' N ' ' A' ' 667' ' ' LEU . 19.8 pt20 -94.46 -45.75 7.3 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.561 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.9 tt -48.15 -41.54 27.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.833 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -61.58 -35.27 77.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.701 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 90.1 mt -76.5 -44.2 36.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.194 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' A' ' 671' ' ' GLN . 1.4 pp -81.54 -15.69 54.07 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.866 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 670' ' ' LEU . 2.8 mm-40 37.97 77.99 0.38 Allowed Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.385 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.405 ' HD3' ' CD1' ' A' ' 670' ' ' LEU . 30.9 Cg_endo -69.35 156.98 62.87 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.555 2.17 . . . . 0.0 112.465 -179.259 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 10.0 mm -93.16 -24.95 5.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.323 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 13.2 p -143.57 142.11 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.371 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.2 mt -127.82 127.27 68.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.101 0.477 . . . . 0.0 111.755 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.36 131.47 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.416 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 65.7 ttp -139.92 127.61 21.79 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.3 152.22 44.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.864 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.418 ' CH2' HD12 ' A' ' 717' ' ' LEU . 32.2 t-105 -124.93 72.09 62.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -87.51 144.37 6.65 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.118 2.545 . . . . 0.0 112.11 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.73 ' O ' ' N ' ' A' ' 683' ' ' ASP . 5.8 Cg_exo -51.25 -50.39 14.09 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.651 2.234 . . . . 0.0 113.26 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 52.8 Cg_exo -38.35 -11.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 122.538 2.159 . . . . 0.0 112.064 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.73 ' N ' ' O ' ' A' ' 681' ' ' PRO . 13.2 t0 73.72 78.15 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . 0.484 HE22 ' HA ' ' A' ' 634' ' ' GLU . 45.4 tt0 -60.35 138.8 57.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.465 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 685' ' ' SER . . . . . 0.442 ' C ' ' H ' ' A' ' 687' ' ' LEU . 38.1 m -62.27 -29.34 70.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.623 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.449 ' SG ' ' HB3' ' A' ' 633' ' ' LEU . 83.7 m -53.59 -14.05 0.77 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . 0.588 ' CD1' ' OD1' ' A' ' 683' ' ' ASP . 47.2 mt -62.65 -32.38 73.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.146 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 56.5 mt -64.26 -39.73 94.53 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.596 ' C ' ' CD1' ' A' ' 689' ' ' LEU . 2.4 tm? -60.22 -44.11 95.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.182 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 19.5 tp -59.22 -39.57 83.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.749 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -60.2 -39.21 85.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.91 0.386 . . . . 0.0 110.064 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.412 ' CD2' ' C ' ' A' ' 692' ' ' HIS . 5.3 t60 -57.51 -50.0 74.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.963 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.493 ' O ' ' N ' ' A' ' 697' ' ' GLN . 80.7 mt -55.92 -35.41 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.576 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . 0.503 ' CZ ' ' CD ' ' A' ' 720' ' ' GLN . 24.4 mmt180 -62.04 -36.76 82.59 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.107 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -68.74 -33.86 74.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.467 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -112.93 23.5 13.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.166 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.546 ' O ' ' N ' ' A' ' 699' ' ' ASP . 21.8 pt20 -56.0 -17.47 6.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.81 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.644 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . 62.29 -71.65 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.208 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.644 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 12.5 t0 107.36 -40.13 0.0 OUTLIER Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' A' ' 699' ' ' ASP . 23.3 Cg_exo -56.87 -55.9 2.34 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.486 1.458 . . . . 0.0 111.922 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -137.31 68.2 54.52 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.677 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.05 144.1 74.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.553 2.169 . . . . 0.0 112.346 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -63.05 161.16 30.9 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.703 2.269 . . . . 0.0 111.722 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.3 tp -76.63 124.9 28.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.975 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.409 ' H ' ' HB3' ' A' ' 722' ' ' SER . 61.0 t -122.56 132.26 71.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 121.157 0.503 . . . . 0.0 111.874 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 5.2 mp -125.01 145.68 49.78 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.438 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -106.25 123.37 47.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.979 0.418 . . . . 0.0 110.585 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.2 mt -96.76 150.83 20.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.575 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -123.7 6.46 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.04 156.1 46.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -71.05 156.4 59.98 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 123.099 2.533 . . . . 0.0 112.286 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.29 -153.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.898 2.399 . . . . 0.0 111.771 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 1.5 t -145.12 -52.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.498 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.09 145.07 90.83 Favored Pre-proline 0 C--N 1.327 -0.374 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.191 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.53 -17.62 33.96 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.592 2.195 . . . . 0.0 112.437 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 60.7 tp -70.27 -34.98 73.45 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.613 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.494 ' HA ' HH22 ' A' ' 694' ' ' ARG . 71.0 mt -76.38 -37.91 56.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 39.7 m -65.66 -43.0 90.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.261 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.62 -41.12 93.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.465 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.503 ' CD ' ' CZ ' ' A' ' 694' ' ' ARG . 42.7 tt0 -78.37 -22.97 47.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.72 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -72.92 139.47 46.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.56 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.409 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -86.89 -30.27 21.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.63 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.49 124.25 0.69 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.767 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 62.6 mt -91.41 125.56 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.82 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 725' ' ' LEU . 6.9 mp -107.2 147.91 29.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.535 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.1 m -166.89 -3.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.431 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 9.4 tptm -133.24 79.63 61.05 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.328 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.07 141.0 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.794 2.33 . . . . 0.0 112.087 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.3 OUTLIER -179.09 116.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.492 ' O ' ' O ' ' A' ' 729' ' ' LEU . 57.3 t0 56.42 121.2 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.721 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.2 -11.85 30.99 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.327 2.018 . . . . 0.0 112.205 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -71.42 -27.45 63.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.443 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 46.8 tp -66.13 -49.75 66.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.364 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 4.7 mp -58.84 -42.9 90.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.955 0.407 . . . . 0.0 110.079 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . 0.41 HD12 ' CE1' ' A' ' 652' ' ' PHE . 37.0 tp -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.319 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 56.1 m -60.53 -39.66 88.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.637 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 48.9 m -61.5 -44.18 97.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.7 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 39.8 mt -65.59 -37.35 86.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.122 0.486 . . . . 0.0 109.944 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.669 ' O ' ' N ' ' A' ' 741' ' ' LEU . 47.2 tt0 -64.55 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.4 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.96 -6.52 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.478 -0.649 . . . . 0.0 111.478 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.669 ' N ' ' O ' ' A' ' 739' ' ' GLN . 66.1 mt -77.61 -42.21 35.81 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.543 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.485 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 45.3 t 47.64 57.61 17.71 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.182 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.485 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 57.6 Cg_endo -82.29 116.75 2.72 Favored 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.139 1.892 . . . . 0.0 111.279 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.06 135.75 5.6 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 122.62 2.213 . . . . 0.0 112.304 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 10.0 m120 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.569 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . 0.778 ' H1 ' ' CD2' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 81.18 25.53 54.88 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . 0.778 ' CD2' ' H1 ' ' A' ' 627' ' ' ALA . 93.2 m-70 -90.52 128.92 36.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 38.7 mt -118.35 142.9 30.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.753 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 23.6 tp -106.89 133.06 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.407 ' HA ' ' O ' ' A' ' 676' ' ' LEU . 9.3 tt -130.41 120.22 23.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 14.3 tp -107.28 119.25 38.87 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.64 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 87.7 tt0 -159.72 158.33 31.12 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.274 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.653 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.8 tt0 -109.02 133.43 53.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.776 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.653 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 75.3 tt0 105.47 113.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.653 0.596 . . . . 0.0 109.677 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.678 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.8 p30 -61.94 -33.49 74.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.38 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.678 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.6 mt-10 -65.77 -41.54 91.94 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.792 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -76.24 -46.04 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.168 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -62.39 -41.19 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.539 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 87.1 m -63.87 -43.27 96.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.306 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 41.4 t -54.5 -52.76 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.154 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 87.6 t -58.15 -41.82 81.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.523 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.555 ' O ' ' OG1' ' A' ' 648' ' ' THR . 73.0 m -59.91 -39.09 84.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.6 -36.92 84.29 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.098 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 67.9 mmm -68.69 -48.88 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . 0.474 HD11 ' N ' ' A' ' 647' ' ' LEU . 9.5 mp -69.08 -43.31 74.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.555 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 32.1 m -55.58 -41.42 73.32 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.34 -29.68 69.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.28 -5.23 30.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -8.23 70.39 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -97.41 138.34 35.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 15.9 ttmm -92.1 133.11 36.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.947 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 7.1 p -125.6 141.38 45.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.964 0.411 . . . . 0.0 111.195 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 59.6 mt -107.35 129.76 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.921 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.64 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 19.9 t90 -93.85 118.96 32.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.82 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.523 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 2.7 mm? -109.12 143.22 38.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.665 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . 0.591 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 88.5 t -103.95 4.45 10.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.591 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 97.3 m-20 -145.77 121.27 10.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.06 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -57.06 -43.17 93.31 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.271 -0.731 . . . . 0.0 111.271 -179.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 88.5 p -61.34 -40.25 93.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.718 0.294 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 34.0 m -64.1 -38.28 90.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.122 0.487 . . . . 0.0 110.184 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.588 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.75 -44.6 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.458 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.08 -44.72 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.9 0.381 . . . . 0.0 111.161 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -59.24 -41.04 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.568 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . 0.571 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 97.9 mt-30 -86.73 -23.99 25.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.028 0.442 . . . . 0.0 109.99 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.588 ' N ' ' O ' ' A' ' 663' ' ' ALA . 2.8 tp -50.44 -45.67 56.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.32 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -62.59 -30.33 71.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.866 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 29.1 mt -73.88 -47.2 39.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.925 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.571 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.82 -17.75 42.88 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.488 -179.467 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 670' ' ' LEU . 12.9 mm-40 41.35 64.16 5.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.931 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -72.38 155.52 55.51 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 123.106 2.537 . . . . 0.0 112.79 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 95.9 mt -93.88 -22.18 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.194 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . 0.417 ' CG1' ' CD1' ' A' ' 706' ' ' LEU . 22.0 t -138.41 136.44 44.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.475 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . 0.408 HG21 ' SD ' ' A' ' 677' ' ' MET . 75.6 mt -120.98 123.31 69.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.579 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.407 ' O ' ' HA ' ' A' ' 632' ' ' LEU . 5.5 mp -106.9 128.52 54.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.449 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.421 ' HE2' ' CD1' ' A' ' 693' ' ' LEU . 1.7 mpp? -141.02 141.17 34.36 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.259 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.2 153.91 39.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.749 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.755 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 57.9 t-105 -99.56 -25.59 0.23 Allowed Pre-proline 0 C--N 1.328 -0.341 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.872 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 2.8 Cg_exo -70.29 149.18 63.11 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 121.893 1.729 . . . . 0.0 110.316 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.77 110.66 2.95 Favored 'Trans proline' 0 C--N 1.301 -1.938 0 C-N-CA 122.447 2.098 . . . . 0.0 112.444 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.583 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 62.0 Cg_endo -91.76 -33.14 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.899 2.4 . . . . 0.0 111.487 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.583 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 81.7 m-20 -157.01 -81.05 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 179.72 -25.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.768 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 22.7 t -64.18 -33.74 76.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -59.99 -33.81 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.79 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . 0.465 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 80.9 mt -66.76 -39.22 87.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.897 0.379 . . . . 0.0 110.554 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.573 ' CD1' ' C ' ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.96 -34.64 73.67 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.474 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 9.7 tt -58.83 -41.66 87.4 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 49.9 tp -59.68 -43.06 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.092 179.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.02 -42.96 99.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.796 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -57.91 -48.05 81.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.384 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.421 ' CD1' ' HE2' ' A' ' 677' ' ' MET . 91.8 mt -55.53 -37.77 68.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.969 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -63.19 -40.52 97.75 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.778 -0.369 . . . . 0.0 110.909 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.72 -33.61 74.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.68 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.467 ' O ' ' OD2' ' A' ' 699' ' ' ASP . 20.5 m-70 -96.79 0.92 50.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.713 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 693' ' ' LEU . 61.7 tt0 -60.07 -34.79 73.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.919 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -82.34 -0.13 44.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.851 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.467 ' OD2' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER -69.64 146.25 95.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.462 ' O ' ' OD1' ' A' ' 699' ' ' ASP . 10.7 Cg_endo -56.2 144.85 79.61 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.634 2.223 . . . . 0.0 112.54 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.402 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 27.1 m-70 51.63 56.86 16.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.581 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 28.7 Cg_endo -65.07 134.26 38.94 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.633 2.222 . . . . 0.0 111.832 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.07 150.39 42.93 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.457 2.105 . . . . 0.0 111.919 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 737' ' ' THR . 52.5 mt -78.15 138.72 38.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 29.4 t -115.99 129.33 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.095 0.474 . . . . 0.0 111.323 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.446 ' N ' HD13 ' A' ' 706' ' ' LEU . 4.5 mp -117.07 136.63 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.659 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -110.86 137.08 48.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.125 0.488 . . . . 0.0 111.77 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 56.6 mt -96.63 156.4 16.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.452 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -140.03 17.9 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.72 150.07 47.46 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.965 0.412 . . . . 0.0 110.983 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.76 146.08 33.26 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.966 2.444 . . . . 0.0 112.582 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . 0.403 ' HA ' ' CE2' ' A' ' 679' ' ' TRP . 36.7 Cg_exo -50.85 154.26 7.26 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.216 1.944 . . . . 0.0 111.178 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 54.2 t -77.7 -42.89 29.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.488 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -72.96 137.76 79.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.21 -13.48 18.94 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.391 2.061 . . . . 0.0 112.322 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.94 -36.53 75.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.802 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 80.1 mt -75.48 -34.23 60.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 91.6 m -63.79 -43.46 96.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.082 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.24 -37.35 86.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.603 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.4 ' HG2' HE22 ' A' ' 697' ' ' GLN . 96.6 mt-30 -73.26 -27.28 61.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.184 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.16 149.29 46.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.396 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.452 ' HG ' ' HB3' ' A' ' 704' ' ' LEU . 8.1 t -85.65 -31.15 22.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.235 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -172.28 160.52 5.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.476 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.3 mt -147.1 120.99 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.707 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.5 mt -112.94 129.52 56.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.804 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 14.8 m -68.12 -40.48 82.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.058 0.456 . . . . 0.0 109.947 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.81 145.23 27.08 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.011 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 129.57 30.16 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.243 1.962 . . . . 0.0 111.651 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.443 ' HG ' ' N ' ' A' ' 730' ' ' ASP . 34.8 tp -179.5 149.8 0.4 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.443 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 2.4 m-20 57.66 68.02 2.12 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.761 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.31 -15.7 8.73 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.923 2.415 . . . . 0.0 112.052 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -69.86 -33.35 72.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.257 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 25.4 tp -67.05 -42.36 84.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.965 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 43.1 tp -56.45 -43.97 80.03 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.037 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.46 -39.64 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.22 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.8 m -59.05 -40.41 85.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 737' ' ' THR . . . . . 0.494 ' O ' ' CD1' ' A' ' 704' ' ' LEU . 73.4 m -63.35 -39.92 95.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.126 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . 0.431 ' CD2' ' C ' ' A' ' 738' ' ' LEU . 7.3 tt -63.97 -47.78 79.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.357 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.633 ' C ' ' H ' ' A' ' 741' ' ' LEU . 2.8 pt20 -69.14 -22.34 63.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.91 0.15 0.06 OUTLIER Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.633 ' H ' ' C ' ' A' ' 739' ' ' GLN . 0.3 OUTLIER -85.37 -4.37 59.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.844 0.354 . . . . 0.0 110.486 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 46.8 t 64.11 65.19 1.17 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.702 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -74.8 117.01 4.78 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.36 2.04 . . . . 0.0 110.718 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -86.17 1.0 8.02 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.531 2.154 . . . . 0.0 112.355 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.475 179.813 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 93.1 7.14 62.63 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -90.25 133.21 35.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.971 0.415 . . . . 0.0 111.029 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . 0.46 HG21 ' N ' ' A' ' 631' ' ' LEU . 63.8 mt -118.29 141.96 35.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.914 179.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . 0.46 ' N ' HG21 ' A' ' 630' ' ' ILE . 1.2 tp -106.06 129.09 54.23 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.44 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 9.6 tt -134.33 120.58 20.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.751 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 8.3 tt -108.43 120.09 41.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.913 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.524 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 81.7 tt0 -159.78 161.21 34.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.535 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.601 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 93.9 mt-10 -113.55 155.73 24.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.19 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.601 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.4 tp10 91.65 113.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.889 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -58.15 -38.23 76.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.145 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.486 ' O ' ' CG2' ' A' ' 642' ' ' VAL . 76.3 mm-40 -66.88 -41.44 87.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.118 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -76.23 -45.15 34.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.811 0.339 . . . . 0.0 110.948 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.9 -46.2 82.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.05 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 58.4 m -63.63 -44.46 93.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.486 ' CG2' ' O ' ' A' ' 638' ' ' GLU . 41.1 t -55.86 -52.88 44.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.802 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 70.7 t -60.29 -44.42 95.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.53 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.5 OUTLIER -62.55 -37.32 85.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.745 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . 0.486 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 84.2 tt0 -62.37 -39.46 93.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.688 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 43.0 tpp -67.92 -50.31 56.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.722 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . 0.487 ' CD1' ' N ' ' A' ' 647' ' ' LEU . 7.9 mp -68.57 -44.74 73.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.551 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.53 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 62.5 m -56.26 -43.46 78.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.021 0.438 . . . . 0.0 109.975 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.36 -23.74 63.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.54 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.25 -3.07 21.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.53 -9.81 69.04 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -95.31 138.55 32.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 110.604 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.27 129.74 38.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.134 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 9.5 p -129.12 138.7 53.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 3.1 mp -106.37 131.36 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.921 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.524 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 16.0 t90 -90.56 122.22 33.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.11 -178.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.507 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 3.5 mm? -111.06 140.31 45.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.712 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . 0.57 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 1.5 t -109.35 5.71 9.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.319 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.57 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 62.9 m-20 -147.34 137.72 23.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.357 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -65.17 -46.7 86.92 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 21.4 m -60.05 -38.37 82.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 110.956 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 46.4 m -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.502 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.524 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.017 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 39.1 mt -59.05 -40.33 84.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.901 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . 0.582 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 86.3 m-20 -62.37 -42.33 99.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.161 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . 0.569 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 88.4 mt-30 -87.84 -36.23 17.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.931 0.396 . . . . 0.0 110.92 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' A' ' 663' ' ' ALA . 0.8 OUTLIER -48.54 -44.44 36.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.995 -179.614 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.582 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 50.7 p-10 -63.71 -32.02 73.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.383 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . 0.546 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 81.4 mt -72.39 -46.71 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.91 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.569 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.87 -15.76 50.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.798 -179.121 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.454 ' NE2' ' HA ' ' A' ' 671' ' ' GLN . 3.5 mm-40 40.72 61.1 7.21 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.1 0.476 . . . . 0.0 110.111 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.06 151.76 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.352 2.701 . . . . 0.0 112.447 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 7.0 pt -95.94 -11.54 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 63.6 t -138.68 135.2 43.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.458 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 67.0 mt -127.85 124.16 62.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.809 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.5 mp -102.74 138.03 40.18 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.454 ' HE3' ' SG ' ' A' ' 686' ' ' CYS . 74.1 mtp -139.27 134.38 32.56 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.086 -0.646 . . . . 0.0 111.623 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . 0.431 ' C ' ' OD2' ' A' ' 683' ' ' ASP . . . -67.71 150.84 48.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.594 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.75 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 25.2 t-105 -115.03 -21.03 0.11 Allowed Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 66.2 Cg_exo -47.74 158.67 0.7 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.859 1.706 . . . . 0.0 112.104 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.68 ' C ' ' H ' ' A' ' 683' ' ' ASP . 2.5 Cg_endo -50.2 -54.85 4.77 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.894 2.396 . . . . 0.0 113.402 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 2.1 Cg_endo -49.17 0.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.059 1.839 . . . . 0.0 111.945 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.68 ' H ' ' C ' ' A' ' 681' ' ' PRO . 84.8 m-20 -82.48 45.5 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.822 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -58.65 -38.45 78.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.103 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 59.8 p -67.35 -30.09 69.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.104 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.454 ' SG ' ' HE3' ' A' ' 677' ' ' MET . 25.2 t -62.06 -25.13 67.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.149 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 77.2 mt -66.19 -39.66 89.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.752 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.488 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 1.2 pp -72.75 -43.26 63.13 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.717 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.488 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 0.5 OUTLIER -61.49 -41.23 96.96 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 8.9 tt -59.61 -42.16 92.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.601 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.51 -40.54 94.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.227 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.746 ' CE1' ' HE2' ' A' ' 696' ' ' HIS . 5.8 t60 -57.83 -47.51 82.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.263 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.56 ' O ' ' N ' ' A' ' 697' ' ' GLN . 44.8 mt -54.68 -39.81 68.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -63.34 -34.13 77.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.142 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.2 -31.46 71.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.746 ' HE2' ' CE1' ' A' ' 692' ' ' HIS . 0.1 OUTLIER -169.9 63.6 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.157 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 693' ' ' LEU . 13.0 pt20 -62.21 5.68 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.15 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.608 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . 66.64 115.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.492 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.555 ' N ' ' CD ' ' A' ' 700' ' ' PRO . 0.3 OUTLIER -68.24 -47.31 38.9 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.603 -179.835 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.614 ' O ' ' C ' ' A' ' 701' ' ' HIS . 23.6 Cg_exo -60.63 136.38 66.58 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 122.592 2.195 . . . . 0.0 111.873 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.614 ' C ' ' O ' ' A' ' 700' ' ' PRO . 38.8 m170 -0.56 69.95 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.665 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.592 ' N ' ' O ' ' A' ' 700' ' ' PRO . 11.4 Cg_endo -58.16 147.72 82.1 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.192 1.928 . . . . 0.0 111.869 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.73 152.62 34.01 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.664 2.243 . . . . 0.0 112.197 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.42 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 29.2 mt -76.87 139.09 40.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.286 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 722' ' ' SER . 16.9 t -122.94 130.98 74.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.12 0.486 . . . . 0.0 111.554 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.479 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 4.6 mp -119.23 138.96 52.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.996 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -108.93 126.8 53.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.918 0.39 . . . . 0.0 110.89 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.9 mt -97.46 145.91 25.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.308 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 97.77 -127.64 9.29 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.825 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . 0.52 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.1 OUTLIER -87.15 153.99 54.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.993 0.425 . . . . 0.0 111.245 -178.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.02 161.99 24.18 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.916 2.411 . . . . 0.0 112.425 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -62.85 151.03 86.38 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 123.39 2.727 . . . . 0.0 112.683 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . 0.544 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.7 t -86.91 16.15 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.381 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.5 OUTLIER -161.81 143.24 8.41 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.0 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.41 -20.43 31.8 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.643 2.228 . . . . 0.0 111.881 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 84.8 mt -70.06 -34.08 72.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 59.6 tp -75.5 -35.18 60.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.692 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 57.3 m -62.6 -41.55 99.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 178.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.9 92.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.094 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -75.11 -28.54 60.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.14 144.58 51.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.598 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.612 ' N ' ' O ' ' A' ' 705' ' ' VAL . 32.7 t -86.16 -27.28 24.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.443 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 122.88 0.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.837 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 28.8 mm -89.55 122.83 41.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.53 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 5.0 mp -109.05 146.21 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.971 0.415 . . . . 0.0 110.796 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.6 p -167.93 -22.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.954 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.67 81.03 64.95 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.665 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -46.22 122.53 5.56 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.751 2.301 . . . . 0.0 112.453 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 24.2 tp 179.2 141.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.569 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 60.94 68.75 1.2 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.915 0.388 . . . . 0.0 110.718 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -51.91 -1.32 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.955 2.436 . . . . 0.0 112.027 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.569 ' H ' ' C ' ' A' ' 730' ' ' ASP . 1.4 pt20 -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.866 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . 0.411 ' N ' ' HG3' ' A' ' 732' ' ' GLN . 22.4 tp -64.91 -45.84 84.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.085 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.0 tp -57.98 -48.0 81.3 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.42 -41.86 93.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 736' ' ' THR . . . . . 0.516 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 64.6 m -59.83 -40.51 88.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.621 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 737' ' ' THR . . . . . 0.52 ' CG2' ' HG ' ' A' ' 722' ' ' SER . 41.7 m -61.08 -45.77 93.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.97 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.9 -41.73 86.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.091 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.6 ' NE2' ' SG ' ' A' ' 742' ' ' CYS . 72.4 tp60 -64.53 -35.92 82.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.317 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.76 -11.35 1.98 Allowed Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.466 ' H ' ' C ' ' A' ' 739' ' ' GLN . 24.3 tp -152.84 91.6 1.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.88 0.372 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.6 ' SG ' ' NE2' ' A' ' 739' ' ' GLN . 6.3 p -138.6 51.18 3.42 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.666 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 742' ' ' CYS . 67.6 Cg_endo -77.79 117.44 4.23 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.343 2.029 . . . . 0.0 111.029 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -84.39 127.02 3.76 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 122.406 2.07 . . . . 0.0 112.092 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.642 -179.793 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 87.49 178.9 48.16 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -92.94 134.31 35.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.707 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 2.4 mp -115.42 139.8 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.297 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . 0.491 ' C ' ' CD1' ' A' ' 632' ' ' LEU . 8.4 tt -112.51 129.59 56.29 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.621 -0.431 . . . . 0.0 110.596 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.62 ' CD1' ' N ' ' A' ' 632' ' ' LEU . 0.0 OUTLIER -130.99 122.29 26.58 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.732 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.479 ' CD2' ' C ' ' A' ' 633' ' ' LEU . 7.0 tt -108.32 125.28 51.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.963 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.457 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 94.0 mt-10 -158.4 170.24 22.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.069 0.461 . . . . 0.0 110.909 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.561 ' OE2' ' O ' ' A' ' 682' ' ' PRO . 95.8 mt-10 -114.76 162.11 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.987 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 69.59 123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.34 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.58 ' O ' ' OG1' ' A' ' 641' ' ' THR . 90.9 m-20 -58.83 -34.4 71.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.185 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -63.64 -42.05 98.17 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.064 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.46 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.812 0.339 . . . . 0.0 110.888 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.444 ' HB1' ' NE1' ' A' ' 656' ' ' TRP . . . -65.87 -39.68 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.049 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.58 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 54.3 m -62.84 -45.07 94.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.064 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 52.8 t -56.7 -52.56 52.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.896 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 57.4 t -60.22 -46.28 94.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.581 ' O ' ' OG1' ' A' ' 648' ' ' THR . 96.1 m -66.99 -36.8 82.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -61.67 -38.28 87.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.477 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.3 mtt -68.36 -50.61 51.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.29 -43.63 77.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.625 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.581 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 41.1 m -56.17 -41.55 75.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.34 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.1 73.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.74 -1.81 17.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.542 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 82.4 10.63 83.26 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -91.43 140.39 29.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -93.52 120.32 33.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 5.7 m -129.0 150.42 34.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.941 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . 0.522 ' O ' ' CD2' ' A' ' 632' ' ' LEU . 24.1 mm -111.8 127.12 69.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.888 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.444 ' NE1' ' HB1' ' A' ' 640' ' ' ALA . 32.6 t90 -93.76 118.54 31.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.997 0.427 . . . . 0.0 111.285 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -115.59 144.51 43.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.456 179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 9.7 p -113.8 12.08 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -147.49 123.6 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.414 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -61.11 -43.89 98.85 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 17.6 t -59.69 -48.68 80.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 110.931 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.9 m -64.27 -38.02 89.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.514 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.03 -43.38 98.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.946 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 87.1 mt -58.57 -43.4 89.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.712 0.292 . . . . 0.0 111.09 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.8 -40.89 96.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.056 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -86.29 -41.99 14.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 663' ' ' ALA . 9.3 tt -47.68 -38.14 14.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.423 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 62.6 t0 -56.54 -37.09 70.02 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 60.8 mt -77.71 -30.31 51.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.605 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 16.2 mt -72.04 -36.16 69.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.558 -178.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.457 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 32.7 mm-40 46.68 62.4 11.66 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -178.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.457 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 66.3 Cg_endo -81.67 156.03 18.42 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 123.37 2.713 . . . . 0.0 112.957 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 81.0 mt -96.54 -23.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.681 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 48.7 t -138.65 139.11 41.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.903 0.383 . . . . 0.0 110.75 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 72.0 mt -128.6 123.44 59.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.588 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 676' ' ' LEU . 7.9 mp -105.67 131.98 52.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.2 mtm -138.06 138.68 39.02 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.527 -179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . 0.538 ' C ' ' OD2' ' A' ' 683' ' ' ASP . . . -65.91 151.1 47.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.64 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.736 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 74.5 t-105 -113.43 -21.99 0.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.265 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 92.1 Cg_exo -44.48 159.93 0.11 Allowed 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.698 1.599 . . . . 0.0 111.388 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.626 ' C ' ' H ' ' A' ' 683' ' ' ASP . 13.9 Cg_exo -52.24 -45.61 38.17 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.099 1.866 . . . . 0.0 112.677 -178.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.561 ' O ' ' OE2' ' A' ' 635' ' ' GLU . 31.3 Cg_exo -49.3 -8.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 121.734 1.622 . . . . 0.0 110.626 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.626 ' H ' ' C ' ' A' ' 681' ' ' PRO . 74.7 m-20 -83.42 24.67 0.81 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.831 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.35 -40.84 65.24 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.359 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 93.0 p -69.14 -35.41 76.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.458 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.433 ' SG ' HD21 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -62.35 -19.11 63.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.008 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.14 -32.99 74.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.772 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . 0.493 ' HG ' ' H ' ' A' ' 689' ' ' LEU . 1.6 pp -70.09 -44.1 69.73 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.725 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.493 ' H ' ' HG ' ' A' ' 688' ' ' LEU . 8.0 tt -60.68 -41.4 95.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 61.1 tp -60.39 -36.1 77.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.156 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -59.98 -45.03 94.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.834 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -57.66 -50.6 72.63 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.448 -0.501 . . . . 0.0 109.949 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.8 mt -56.17 -34.92 66.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.379 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -60.57 -40.79 92.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.5 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.28 -31.86 70.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.985 0.421 . . . . 0.0 110.172 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -98.08 10.4 40.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.519 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.568 ' OE1' ' NE2' ' A' ' 720' ' ' GLN . 11.2 tp-100 -54.9 -15.52 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.734 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.583 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -80.97 131.56 35.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.583 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 4.4 t0 87.8 128.88 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.072 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -81.0 -11.96 12.12 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.593 2.195 . . . . 0.0 112.873 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.456 ' N ' ' HD2' ' A' ' 702' ' ' PRO . 0.1 OUTLIER -43.0 -53.31 10.53 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.781 0.324 . . . . 0.0 110.916 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 701' ' ' HIS . 65.6 Cg_exo -45.11 156.57 0.27 Allowed 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.874 2.382 . . . . 0.0 112.391 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.92 158.77 36.72 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 123.069 2.512 . . . . 0.0 112.466 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 3.6 mp -77.12 149.67 35.66 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.493 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.51 ' N ' ' HG ' ' A' ' 722' ' ' SER . 35.7 t -114.86 129.22 71.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.352 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 5.7 mp -121.7 136.49 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.124 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . 0.44 ' CZ ' HG13 ' A' ' 705' ' ' VAL . 97.6 m-85 -111.61 127.88 55.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.398 . . . . 0.0 111.186 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 72.7 mt -97.16 148.38 23.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.496 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 106.88 -132.36 11.1 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -89.88 175.18 4.03 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.382 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -82.53 135.71 8.23 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.742 2.295 . . . . 0.0 112.414 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . 0.406 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 37.6 Cg_exo -51.31 150.81 14.17 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.114 1.876 . . . . 0.0 111.59 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.82 -39.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.687 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 132.14 81.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.497 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -72.19 -28.39 15.62 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.267 1.978 . . . . 0.0 111.818 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 72.1 mt -72.05 -28.84 63.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.573 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.549 ' CD2' ' CH2' ' A' ' 679' ' ' TRP . 40.4 tp -75.19 -42.82 54.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.858 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 57.3 m -64.6 -45.32 87.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.047 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.66 84.2 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.515 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.568 ' NE2' ' OE1' ' A' ' 697' ' ' GLN . 67.4 tp60 -77.73 -17.46 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.455 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.97 147.71 48.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.425 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.51 ' HG ' ' N ' ' A' ' 705' ' ' VAL . 62.9 p -83.19 -25.08 32.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.135 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.8 157.98 4.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.563 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 70.1 mt -148.65 123.33 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.395 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 46.7 mt -102.59 147.85 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.44 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.4 p -167.59 -16.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.724 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -132.07 78.26 69.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.613 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -54.03 147.81 41.72 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.636 2.224 . . . . 0.0 111.74 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 6.2 tp -178.11 -38.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.159 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.665 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 -142.98 82.29 12.16 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.15 0.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.856 2.371 . . . . 0.0 111.669 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.665 ' H ' ' C ' ' A' ' 730' ' ' ASP . 90.5 mt-30 -69.56 -29.98 67.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.666 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.48 78.07 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 13.5 tp -57.85 -46.41 84.85 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 88.4 mt -63.98 -40.48 96.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.002 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 736' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 28.6 m -59.6 -39.2 83.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 27.4 m -62.31 -47.63 83.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.016 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.18 -41.01 90.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.859 0.362 . . . . 0.0 110.573 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -64.0 -28.08 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.101 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.59 -44.84 12.09 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 58.9 mt -88.0 -94.64 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.222 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.8 t 53.86 62.9 8.47 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -80.82 116.37 3.16 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.078 1.852 . . . . 0.0 110.988 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -86.56 154.02 9.03 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.775 2.317 . . . . 0.0 112.464 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.895 -1.05 . . . . 0.0 110.464 179.856 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -173.27 -179.13 43.75 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -93.57 134.39 35.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.875 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . 0.411 ' CG2' ' CD1' ' A' ' 676' ' ' LEU . 67.1 mt -118.38 138.82 47.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.12 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . 0.605 ' C ' ' CD1' ' A' ' 631' ' ' LEU . 3.2 tm? -110.06 124.05 50.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.64 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.446 ' N ' HD12 ' A' ' 631' ' ' LEU . 20.3 tp -113.26 122.1 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.726 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.458 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 17.6 tp -108.67 117.97 35.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.458 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 94.4 mt-10 -158.76 172.2 18.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.531 -178.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 636' ' ' GLU . 48.8 tp10 -106.82 152.44 23.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.127 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.449 ' N ' ' HG3' ' A' ' 635' ' ' GLU . 83.5 tt0 69.29 127.11 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.018 0.437 . . . . 0.0 110.543 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.689 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.4 p30 -66.25 -33.66 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.489 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.689 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.7 mt-10 -66.18 -42.24 89.17 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.82 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.63 -45.42 62.1 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.864 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.458 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -64.96 -40.91 95.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.917 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.582 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 32.3 m -62.58 -43.72 98.12 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.631 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 84.0 t -53.78 -49.23 59.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.872 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.8 t -58.82 -42.85 86.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.009 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.582 ' O ' ' OG1' ' A' ' 648' ' ' THR . 99.2 m -64.9 -36.61 84.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.369 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -62.06 -38.42 88.73 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.957 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 64.7 mtt -68.58 -47.89 65.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.32 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . 0.591 ' CD2' ' N ' ' A' ' 647' ' ' LEU . 1.6 mm? -69.48 -43.99 72.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.119 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.582 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.8 m -56.09 -40.51 73.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.867 179.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.8 72.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.555 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.95 -4.76 37.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.14 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.76 -0.36 60.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -93.57 141.7 28.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 0.0 110.648 179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -91.83 122.06 34.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.96 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . 0.434 HG13 ' HG ' ' A' ' 644' ' ' CYS . 23.1 t -120.11 135.48 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.183 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 63.4 mt -110.67 131.69 61.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.138 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.458 ' CD1' ' HB1' ' A' ' 640' ' ' ALA . 13.8 t90 -95.15 120.17 34.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.381 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.448 ' N ' HD21 ' A' ' 657' ' ' LEU . 3.3 mm? -116.16 135.13 54.2 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.483 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . 0.58 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 0.2 OUTLIER -100.41 2.54 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.295 179.629 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.58 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 80.1 m-20 -146.69 162.12 39.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.107 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -87.28 -48.75 4.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.768 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 t -57.57 -41.25 80.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.741 0.305 . . . . 0.0 111.054 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 50.6 m -62.84 -37.13 85.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.192 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.49 -40.09 96.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.818 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 39.0 mt -60.01 -43.14 95.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.016 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -63.08 -39.26 94.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -88.43 -49.92 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.391 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.4 tt -46.28 -42.67 14.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.332 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.55 -33.38 73.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.758 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 66.6 mt -74.23 -45.06 50.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.731 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.413 ' O ' ' C ' ' A' ' 671' ' ' GLN . 1.0 OUTLIER -83.19 -18.01 40.81 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 670' ' ' LEU . 76.9 mm-40 40.87 78.49 0.37 Allowed Pre-proline 0 C--N 1.33 -0.278 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.105 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.44 153.36 39.67 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 122.858 2.372 . . . . 0.0 112.774 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 78.4 mt -93.14 -19.11 6.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 121.049 0.452 . . . . 0.0 110.001 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 45.1 t -139.46 135.16 40.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.787 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 77.8 mt -123.85 121.26 61.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.968 0.413 . . . . 0.0 111.492 -179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.411 ' CD1' ' CG2' ' A' ' 630' ' ' ILE . 4.1 mp -105.39 127.52 53.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.0 mtm -140.42 133.95 30.09 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.904 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -67.99 152.62 45.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.286 178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.73 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 24.6 t-105 -110.59 -28.27 0.14 Allowed Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.282 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.73 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 34.4 Cg_endo -98.16 26.1 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 123.241 2.627 . . . . 0.0 115.42 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 71.3 Cg_endo -79.97 154.49 22.74 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.439 1.426 . . . . 0.0 112.116 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -64.26 -35.08 53.45 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.826 2.351 . . . . 0.0 112.243 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.601 ' C ' ' H ' ' A' ' 685' ' ' SER . 65.8 t0 -87.13 112.25 21.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.039 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -64.15 12.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.862 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 685' ' ' SER . . . . . 0.601 ' H ' ' C ' ' A' ' 683' ' ' ASP . 55.9 m -60.05 -29.82 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.801 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.465 ' SG ' ' HG3' ' A' ' 681' ' ' PRO . 19.4 m -59.5 -38.28 80.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.64 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 62.3 mt -67.47 -34.97 78.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.857 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.72 -42.12 82.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.886 0.374 . . . . 0.0 110.351 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . 0.445 ' C ' ' CD2' ' A' ' 689' ' ' LEU . 7.2 tt -60.57 -39.53 88.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.155 0.502 . . . . 0.0 109.875 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 9.0 tt -59.84 -41.54 91.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.648 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.58 -40.49 91.9 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.501 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -57.18 -46.03 83.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.311 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.55 -49.78 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . 0.816 HH11 HE22 ' A' ' 720' ' ' GLN . 54.0 ttt85 -69.05 -27.34 65.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.582 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . 0.661 ' O ' ' CD2' ' A' ' 696' ' ' HIS . 31.1 tp10 -62.93 -34.56 77.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.814 -178.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.661 ' CD2' ' O ' ' A' ' 695' ' ' GLU . 6.8 p80 143.97 38.49 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.246 0.341 . . . . 0.0 111.876 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -61.84 -43.73 98.26 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.778 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.597 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . -155.56 88.55 1.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.451 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.597 ' O ' ' O ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER 44.74 174.81 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.689 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 699' ' ' ASP . 27.6 Cg_exo -58.83 -9.34 7.37 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.596 2.197 . . . . 0.0 112.289 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -124.07 70.24 50.71 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.825 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -66.31 165.44 24.62 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.705 2.27 . . . . 0.0 112.521 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -41.31 168.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 123.263 2.642 . . . . 0.0 112.633 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.481 ' CD1' ' N ' ' A' ' 704' ' ' LEU . 5.6 mp -76.93 142.76 39.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.064 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.587 ' N ' ' HG ' ' A' ' 722' ' ' SER . 44.3 t -126.61 135.25 64.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.207 0.527 . . . . 0.0 111.656 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 50.8 mt -110.33 132.94 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.304 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.12 126.68 55.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.924 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 49.2 mt -95.7 150.68 20.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.536 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 94.58 -134.88 12.19 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.71 156.77 44.69 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.951 0.405 . . . . 0.0 111.053 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.57 148.47 26.13 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 123.045 2.497 . . . . 0.0 112.326 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -65.35 151.12 86.15 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 122.604 2.203 . . . . 0.0 111.458 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 43.0 t -77.94 -42.88 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.942 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -72.99 140.65 80.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -75.96 -12.21 19.69 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.622 2.214 . . . . 0.0 112.61 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 38.6 tp -69.5 -35.87 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.926 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 66.8 mt -75.21 -34.49 61.49 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 27.1 m -63.66 -42.05 98.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.093 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.16 -39.22 93.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.094 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . 0.816 HE22 HH11 ' A' ' 694' ' ' ARG . 93.1 mt-30 -77.58 -19.96 54.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.175 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -74.46 132.94 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.868 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.587 ' HG ' ' N ' ' A' ' 705' ' ' VAL . 70.4 p -85.73 -27.04 25.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.834 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -172.72 112.62 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.917 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 64.6 mt -91.1 133.51 32.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.346 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.448 ' O ' ' OG ' ' A' ' 726' ' ' SER . 35.5 mt -106.93 147.04 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.974 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 726' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' A' ' 725' ' ' LEU . 2.9 m -168.78 5.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.379 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -134.56 78.87 55.25 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.474 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.28 137.7 76.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.917 1.744 . . . . 0.0 112.198 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' A' ' 730' ' ' ASP . 30.6 tp -179.23 112.87 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.541 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.57 ' C ' ' H ' ' A' ' 732' ' ' GLN . 5.5 m-20 51.32 100.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.2 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.51 -7.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.53 0 C-N-CA 122.692 2.261 . . . . 0.0 112.257 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 730' ' ' ASP . 92.1 mt-30 -71.75 -28.28 63.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.002 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 35.6 tp -66.7 -44.58 81.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . 0.505 ' C ' ' CD2' ' A' ' 734' ' ' LEU . 7.0 tt -57.78 -47.06 83.61 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.256 0.551 . . . . 0.0 109.591 178.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.94 -37.84 88.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.569 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.2 m -58.06 -39.34 78.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.487 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.0 m -59.97 -41.94 93.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.587 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.42 -35.22 80.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.232 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.48 ' C ' ' H ' ' A' ' 741' ' ' LEU . 47.8 tt0 -62.1 -34.43 76.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.52 -13.01 0.22 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.544 ' O ' ' N ' ' A' ' 743' ' ' PRO . 14.1 tp -79.01 -25.06 43.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.58 0.229 . . . . 0.0 110.487 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.575 ' CB ' ' CD ' ' A' ' 743' ' ' PRO . 1.9 m 30.08 -85.53 0.0 OUTLIER Pre-proline 0 CA--C 1.532 0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.416 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.575 ' CD ' ' CB ' ' A' ' 742' ' ' CYS . 11.3 Cg_endo -56.44 119.18 6.22 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 120.377 1.171 . . . . 0.0 111.354 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 -1.36 11.53 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.633 2.222 . . . . 0.0 112.075 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.457 -179.903 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . 0.678 ' H1 ' ' ND1' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 82.48 22.26 58.81 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . 0.678 ' ND1' ' H1 ' ' A' ' 627' ' ' ALA . 35.1 m80 -89.74 133.51 34.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . 0.409 ' CG2' ' CD1' ' A' ' 676' ' ' LEU . 67.5 mt -113.99 135.78 52.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.627 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' A' ' 631' ' ' LEU . 2.4 mm? -110.53 137.25 48.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.629 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 17.6 tp -126.58 125.81 42.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.582 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.447 HD21 ' SG ' ' A' ' 686' ' ' CYS . 24.8 tp -110.81 115.53 29.69 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.617 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 85.7 tt0 -159.59 161.2 35.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.804 -179.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.459 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 92.5 mt-10 -112.99 158.84 19.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 74.23 119.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.208 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.555 ' O ' ' OG1' ' A' ' 641' ' ' THR . 93.3 m-20 -57.5 -36.72 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.422 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.433 ' O ' ' CG2' ' A' ' 642' ' ' VAL . 84.0 tt0 -63.69 -43.62 96.08 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.677 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -77.46 -45.42 25.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.517 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.5 -43.18 90.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.959 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.555 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 61.3 m -63.85 -42.91 97.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.215 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.433 ' CG2' ' O ' ' A' ' 638' ' ' GLU . 51.2 t -55.59 -53.27 38.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.034 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.94 -42.57 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.431 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.584 ' O ' ' OG1' ' A' ' 648' ' ' THR . 3.3 t -60.93 -41.77 96.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.579 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.02 -38.44 88.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.621 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 646' ' ' MET . . . . . 0.448 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 61.2 ttp -70.09 -52.1 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 83.6 mt -64.73 -44.9 88.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.039 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.584 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.1 m -56.66 -40.99 76.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.075 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.06 -29.41 70.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.935 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -65.27 -5.22 6.59 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.892 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.61 -8.12 71.29 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -95.41 147.93 23.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.666 0.269 . . . . 0.0 110.424 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -91.71 129.63 37.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.991 0.424 . . . . 0.0 110.604 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . 0.444 ' CG1' ' SG ' ' A' ' 644' ' ' CYS . 11.3 p -127.91 140.19 49.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.404 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 66.5 mt -108.65 133.4 53.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.129 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.617 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 18.2 t90 -91.82 126.01 36.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.947 0.403 . . . . 0.0 110.835 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.487 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 3.1 mm? -112.24 145.62 39.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.463 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 19.2 m -106.74 -3.97 10.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.753 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -151.59 132.36 14.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.693 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.25 -40.74 97.76 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 661' ' ' SER . . . . . 0.719 ' H ' ' HG ' ' A' ' 685' ' ' SER . 81.5 p -62.08 -39.96 94.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 662' ' ' THR . . . . . 0.611 ' N ' ' HG ' ' A' ' 661' ' ' SER . 54.8 m -64.44 -37.65 88.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.089 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.605 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -61.96 -41.09 97.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.327 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 86.0 mt -59.43 -41.62 89.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -63.25 -43.04 99.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.324 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -89.89 -52.15 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.175 0.512 . . . . 0.0 111.197 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.605 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.9 tt -48.24 -33.83 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.056 -178.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.618 ' OD1' ' N ' ' A' ' 669' ' ' LEU . 46.4 p-10 -57.88 -38.77 76.37 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.34 -0.544 . . . . 0.0 110.46 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . 0.618 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 63.3 mt -79.75 -24.46 41.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.967 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 23.4 mt -71.9 -38.66 69.92 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.858 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.422 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 74.6 mm-40 48.9 62.67 11.78 Favored Pre-proline 0 C--N 1.329 -0.326 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.422 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 60.6 Cg_endo -79.52 159.62 25.52 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 123.36 2.707 . . . . 0.0 112.485 -179.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 73.5 mt -94.9 -23.27 5.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.52 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 51.7 t -138.8 133.52 41.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.162 0.506 . . . . 0.0 110.7 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 77.3 mt -128.2 121.22 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.958 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.441 HD11 ' N ' ' A' ' 676' ' ' LEU . 4.9 mp -105.29 128.92 53.7 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.401 ' HB3' ' SG ' ' A' ' 686' ' ' CYS . 70.5 mtm -142.02 142.8 32.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.552 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.78 152.57 44.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.883 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.752 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 72.5 t-105 -106.07 -23.79 0.19 Allowed Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.357 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.752 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.3 Cg_endo -100.32 29.29 0.12 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 123.219 2.613 . . . . 0.0 114.6 178.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.546 ' CD ' ' C ' ' A' ' 679' ' ' TRP . 63.4 Cg_endo -77.22 143.88 22.83 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.513 1.475 . . . . 0.0 111.903 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -66.97 -20.69 50.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.486 2.124 . . . . 0.0 112.12 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 685' ' ' SER . 84.9 m-20 -87.27 117.38 25.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.109 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -65.65 -1.42 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.299 179.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 685' ' ' SER . . . . . 0.719 ' HG ' ' H ' ' A' ' 661' ' ' SER . 23.7 t -59.85 -34.44 73.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.437 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.447 ' SG ' HD21 ' A' ' 633' ' ' LEU . 0.6 OUTLIER -59.96 -41.89 92.9 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.168 0.509 . . . . 0.0 109.782 179.511 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.37 -32.72 74.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.675 179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 84.0 mt -67.82 -37.39 81.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.015 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.92 -45.33 86.72 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.467 ' N ' HD21 ' A' ' 690' ' ' LEU . 2.9 mm? -62.04 -39.72 93.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.878 178.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -62.98 -46.07 89.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.252 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -55.84 -55.03 37.32 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.33 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 697' ' ' GLN . 51.1 mt -55.8 -38.81 70.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.776 179.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -62.62 -35.75 80.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.275 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -65.68 -35.76 81.71 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.123 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.532 ' O ' ' CD ' ' A' ' 700' ' ' PRO . 0.7 OUTLIER -133.68 38.33 3.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.037 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 693' ' ' LEU . 21.2 pt20 -62.82 -26.38 68.71 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -86.28 -13.73 45.81 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.401 ' CB ' ' HD3' ' A' ' 700' ' ' PRO . 0.0 OUTLIER -73.96 -55.5 3.13 Favored Pre-proline 0 CA--C 1.534 0.329 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.942 -179.725 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.532 ' CD ' ' O ' ' A' ' 696' ' ' HIS . 85.8 Cg_endo -87.95 -158.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.862 2.375 . . . . 0.0 112.256 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -105.53 102.6 38.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.749 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -43.12 109.07 0.12 Allowed 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.509 2.139 . . . . 0.0 112.4 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.47 162.63 17.03 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.953 2.436 . . . . 0.0 112.087 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 61.4 mt -77.41 133.9 38.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.324 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.484 ' C ' ' HG ' ' A' ' 722' ' ' SER . 52.8 t -125.47 132.51 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.956 0.408 . . . . 0.0 111.428 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.44 HD11 ' N ' ' A' ' 706' ' ' LEU . 5.2 mp -116.92 134.28 54.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.188 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -110.99 127.47 55.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.93 0.395 . . . . 0.0 110.984 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . 0.56 ' CD1' ' N ' ' A' ' 708' ' ' LEU . 4.5 mp -96.74 145.54 25.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.522 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 105.3 -129.37 9.78 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.62 164.09 27.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.831 0.348 . . . . 0.0 110.507 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -72.93 160.83 45.1 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.865 2.377 . . . . 0.0 112.444 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.7 156.11 55.09 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 123.019 2.48 . . . . 0.0 112.28 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 22.0 t -83.42 10.3 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -161.76 140.43 7.19 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.324 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.07 -9.53 23.74 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.766 2.311 . . . . 0.0 112.753 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.7 tp -68.5 -35.2 77.17 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.351 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.582 ' O ' ' N ' ' A' ' 721' ' ' ALA . 81.7 mt -76.06 -31.85 59.0 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 97.4 m -61.82 -43.21 99.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.853 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.99 -40.86 95.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -74.74 -31.66 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.604 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -72.62 142.45 48.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.484 ' HG ' ' C ' ' A' ' 705' ' ' VAL . 65.2 p -85.36 -23.73 27.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.278 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.05 163.3 4.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.436 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 72.4 mt -143.09 124.35 11.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.448 ' CD1' ' N ' ' A' ' 725' ' ' LEU . 5.7 mp -104.51 153.6 20.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.615 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.43 18.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.433 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -139.3 88.47 12.9 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.447 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.658 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.3 Cg_exo -48.49 144.73 13.26 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.52 2.146 . . . . 0.0 111.894 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.658 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 13.5 tp 103.46 156.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.685 0.616 . . . . 0.0 110.246 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.466 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 1.4 t70 61.74 63.48 2.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.952 0.406 . . . . 0.0 111.062 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . 0.448 ' HB3' ' SD ' ' A' ' 646' ' ' MET . 33.4 Cg_endo -67.11 -4.59 11.86 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.961 2.441 . . . . 0.0 111.817 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -69.24 -29.29 67.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.908 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.1 -44.68 88.04 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.681 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 42.1 tp -59.43 -42.16 91.21 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.94 178.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . 0.479 ' N ' HD21 ' A' ' 735' ' ' LEU . 2.7 mm? -62.34 -41.05 98.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.192 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 36.1 m -59.23 -38.84 80.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.084 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.1 m -61.8 -43.03 99.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.796 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.94 -40.96 97.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.983 0.421 . . . . 0.0 110.129 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -64.99 -24.93 67.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.171 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.8 -20.36 0.42 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.55 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.458 HD11 ' N ' ' A' ' 741' ' ' LEU . 5.8 mp -81.22 -10.58 59.58 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.418 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 742' ' ' CYS . 36.5 t 54.52 62.37 8.43 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.905 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -78.31 116.63 3.92 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.089 1.859 . . . . 0.0 111.04 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -86.9 152.02 8.49 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.703 2.269 . . . . 0.0 112.47 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 25.0 m120 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.687 179.903 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 80.83 62.88 1.96 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . 0.499 ' CE1' ' HB3' ' A' ' 672' ' ' PRO . 13.9 p80 -84.53 164.43 18.76 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 64.1 mt -113.79 141.01 31.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.976 0.417 . . . . 0.0 111.522 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 9.9 tp -107.32 135.31 49.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.086 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 33.2 tp -133.93 118.98 18.52 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.227 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.438 HD23 ' SG ' ' A' ' 686' ' ' CYS . 8.2 tt -112.07 117.44 32.66 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.495 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.1 tt0 -159.78 162.97 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.045 -179.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.495 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 95.3 mt-10 -97.35 167.9 10.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.897 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 61.55 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 110.038 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.589 ' O ' ' OG1' ' A' ' 641' ' ' THR . 52.5 t0 -57.93 -36.95 73.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.919 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 54.7 mp0 -65.16 -43.78 90.64 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.737 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.65 -44.17 62.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.618 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.09 93.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.078 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.589 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 50.9 m -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.711 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 55.8 t -55.58 -51.91 53.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.142 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.6 t -60.68 -46.67 95.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.514 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.571 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.5 OUTLIER -66.42 -33.93 76.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.672 -179.905 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 641' ' ' THR . 85.2 tt0 -60.37 -39.53 87.58 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.319 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 7.3 tpp -65.0 -50.59 65.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.103 0.478 . . . . 0.0 109.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 85.0 mt -67.36 -45.25 76.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.204 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.571 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 28.5 m -56.13 -43.52 78.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.622 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . 0.499 ' C ' ' H ' ' A' ' 651' ' ' GLY . . . -69.66 -23.91 63.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -63.92 2.93 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.979 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 649' ' ' ALA . . . 97.12 -15.63 62.14 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -93.79 152.01 19.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -93.3 125.42 37.89 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.319 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 22.9 t -117.83 134.79 60.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.697 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 44.7 mt -109.06 131.4 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.065 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -95.53 121.66 37.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.176 -179.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 7.1 mp -116.2 146.59 42.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.685 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 8.8 p -123.26 21.45 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.625 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -152.28 163.61 39.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.563 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -100.4 -54.51 1.01 Allowed Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.98 -0.628 . . . . 0.0 111.824 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 33.7 m -57.21 -41.87 80.24 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.602 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 26.5 m -64.4 -35.15 79.96 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.584 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.44 -42.48 99.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.622 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . 0.419 HD21 ' ND1' ' A' ' 692' ' ' HIS . 80.6 mt -59.49 -43.79 93.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.852 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -62.71 -41.94 99.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.484 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -89.28 -51.31 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 111.298 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.584 ' N ' ' O ' ' A' ' 663' ' ' ALA . 3.9 tt -45.81 -37.68 6.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.265 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.511 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 90.7 m-20 -56.14 -38.63 71.1 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.923 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.48 -31.46 53.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.101 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.493 ' HB3' ' CE1' ' A' ' 629' ' ' HIS . 11.1 mt -72.48 -38.48 68.19 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.247 -178.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 10.0 mm-40 46.82 65.55 6.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 110.192 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.499 ' HB3' ' CE1' ' A' ' 629' ' ' HIS . 30.5 Cg_endo -68.99 152.81 73.23 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 123.159 2.572 . . . . 0.0 112.952 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . 0.447 HG21 ' N ' ' A' ' 674' ' ' VAL . 19.3 tt -95.5 -22.21 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.696 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . 0.447 ' N ' HG21 ' A' ' 673' ' ' ILE . 76.1 t -140.1 133.69 35.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.468 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 78.4 mt -123.31 122.31 64.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.574 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.435 ' N ' HD13 ' A' ' 676' ' ' LEU . 5.0 mp -106.53 138.97 41.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.538 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.543 ' SD ' ' CD2' ' A' ' 690' ' ' LEU . 83.8 mtp -139.1 128.15 23.78 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.51 144.04 53.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.567 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.745 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 0.5 OUTLIER -113.68 -29.96 0.11 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.151 179.474 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.745 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 41.0 Cg_exo -50.87 -40.09 57.92 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.293 1.996 . . . . 0.0 113.288 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 23.4 Cg_exo -60.58 166.19 10.22 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.97 1.78 . . . . 0.0 111.961 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.512 ' O ' ' O ' ' A' ' 683' ' ' ASP . 32.1 Cg_exo -52.0 -17.97 6.35 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.532 2.154 . . . . 0.0 112.009 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 682' ' ' PRO . 1.0 OUTLIER 58.24 132.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.988 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -176.8 -78.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.736 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 77.3 p -64.08 -30.65 71.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.969 0.414 . . . . 0.0 109.941 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.438 ' SG ' HD23 ' A' ' 633' ' ' LEU . 2.4 m -62.42 -32.69 73.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.019 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.0 mt -64.58 -31.56 72.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.486 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.7 mt -63.27 -42.67 99.14 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.036 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 25.4 tp -60.36 -42.83 96.56 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.543 ' CD2' ' SD ' ' A' ' 677' ' ' MET . 82.1 mt -61.58 -40.64 95.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.778 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.88 -40.29 97.09 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.062 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.419 ' ND1' HD21 ' A' ' 664' ' ' LEU . 12.1 t-80 -57.5 -51.54 69.02 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.456 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.559 ' O ' ' N ' ' A' ' 697' ' ' GLN . 62.5 mt -55.13 -43.15 73.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.345 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -64.44 -35.66 81.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -65.91 -32.25 73.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.121 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -149.92 49.62 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.454 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.689 HE21 ' CG ' ' A' ' 702' ' ' PRO . 60.8 tt0 -60.43 -48.83 80.05 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.169 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.543 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . 35.75 -147.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.282 0.563 . . . . 0.0 111.723 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.543 ' O ' ' O ' ' A' ' 698' ' ' ALA . 41.1 t0 38.83 104.73 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.0 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -48.63 147.02 10.04 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 C-N-CA 122.394 2.063 . . . . 0.0 111.348 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.504 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 0.0 OUTLIER 48.46 53.41 14.32 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 -178.953 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . 0.689 ' CG ' HE21 ' A' ' 697' ' ' GLN . 6.8 Cg_endo -51.44 171.55 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 123.02 2.48 . . . . 0.0 112.176 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -53.38 144.15 51.19 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.583 2.189 . . . . 0.0 111.789 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 5.6 mp -79.39 138.42 37.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.359 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.437 HG13 ' CE2' ' A' ' 707' ' ' PHE . 36.1 t -118.28 127.0 75.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.875 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.529 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 3.8 mp -115.63 129.85 56.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.942 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . 0.437 ' CE2' HG13 ' A' ' 705' ' ' VAL . 96.4 m-85 -109.15 128.23 54.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.014 0.435 . . . . 0.0 110.801 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 43.7 mt -95.44 149.97 20.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.561 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 101.34 -137.65 13.41 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -91.45 167.2 16.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.463 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.4 155.35 25.73 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.548 2.166 . . . . 0.0 112.483 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . 0.446 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 22.5 Cg_endo -63.34 161.12 32.14 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 123.26 2.64 . . . . 0.0 112.07 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.1 -71.62 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.5 OUTLIER -70.97 148.07 94.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.663 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.91 -14.19 32.27 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.732 2.288 . . . . 0.0 112.222 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 74.2 mt -70.88 -31.52 68.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 53.3 mt -77.03 -32.46 57.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 47.7 m -64.9 -43.54 92.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.039 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -66.18 -39.92 90.08 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.02 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -82.52 -11.55 58.38 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.454 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -75.13 129.36 37.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.46 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.6 m -85.88 -23.0 27.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.057 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -168.44 139.37 2.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.351 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 78.9 mt -123.73 126.11 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.656 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.55 ' CD1' ' N ' ' A' ' 725' ' ' LEU . 5.3 mp -106.82 151.9 24.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.679 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 726' ' ' SER . . . . . 0.407 ' H ' ' H ' ' A' ' 727' ' ' LYS . 60.7 p -167.1 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.062 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . 0.407 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.0 OUTLIER -130.86 74.99 79.38 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.018 179.652 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -48.95 125.29 12.82 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.397 2.065 . . . . 0.0 111.858 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.647 ' O ' ' CD2' ' A' ' 729' ' ' LEU . 0.5 OUTLIER -179.78 134.27 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.488 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.585 ' C ' ' H ' ' A' ' 732' ' ' GLN . 4.1 m-20 56.03 75.1 0.62 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.723 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.59 -7.56 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.625 2.217 . . . . 0.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . 0.585 ' H ' ' C ' ' A' ' 730' ' ' ASP . 14.4 mm100 -70.7 -26.41 63.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.299 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.43 -47.56 75.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.927 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 47.0 tp -58.13 -47.26 83.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.17 0.51 . . . . 0.0 109.662 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.6 tp -63.28 -38.65 91.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.133 179.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 736' ' ' THR . . . . . 0.499 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 59.5 m -58.29 -41.56 84.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.51 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.2 m -61.32 -41.21 96.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.922 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 13.6 tp -63.64 -39.04 93.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.364 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' A' ' 741' ' ' LEU . 55.0 tp60 -65.29 -32.5 74.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.985 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -46.72 -11.15 0.05 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.983 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.499 ' H ' ' C ' ' A' ' 739' ' ' GLN . 84.1 mt -79.86 -49.08 12.46 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.647 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 75.7 m 50.24 60.18 15.42 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.782 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -80.74 116.47 3.19 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.223 1.949 . . . . 0.0 111.247 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -86.19 150.0 9.32 Favored 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.662 2.242 . . . . 0.0 112.385 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 21.1 m120 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.506 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 72.58 52.58 9.79 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -87.55 144.18 26.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.716 0.293 . . . . 0.0 110.738 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 67.8 mt -119.21 132.37 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.621 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 51.2 tp -115.3 134.51 55.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.982 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.592 ' C ' ' CD1' ' A' ' 632' ' ' LEU . 0.2 OUTLIER -136.41 134.39 37.71 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.628 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 25.9 tp -108.41 123.2 48.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.45 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 86.2 tt0 -159.45 155.32 26.35 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.509 -179.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.45 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 75.8 mm-40 -95.76 167.01 11.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.492 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 62.48 112.41 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.654 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.9 p30 -64.94 -25.87 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.32 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.654 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.7 mt-10 -63.74 -40.62 97.18 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.37 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.8 -41.65 68.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.292 179.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.477 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -67.44 -39.87 85.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.09 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 40.8 m -62.35 -44.09 97.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.796 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 81.1 t -57.71 -50.47 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.66 -39.86 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.574 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.8 OUTLIER -59.04 -39.56 82.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -63.48 -36.79 84.93 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.782 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 59.8 mtt -68.75 -54.37 16.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.124 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . 0.431 ' CD1' ' N ' ' A' ' 647' ' ' LEU . 10.5 mp -67.08 -42.74 84.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.284 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.574 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 43.8 m -55.42 -42.53 74.27 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.456 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.07 -25.88 62.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.691 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.68 -5.01 40.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.992 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -9.57 70.48 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -98.2 134.13 41.68 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -92.62 127.45 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.121 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . 0.411 HG12 ' SG ' ' A' ' 644' ' ' CYS . 14.4 p -122.84 139.78 48.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.041 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . 0.439 HD12 HG22 ' A' ' 655' ' ' ILE . 67.7 mt -107.33 131.0 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.72 -179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.545 ' CZ2' ' CG1' ' A' ' 658' ' ' VAL . 10.3 t90 -94.78 117.36 30.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.473 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.471 ' HG ' ' H ' ' A' ' 659' ' ' ASP . 27.8 tp -116.44 149.73 38.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.546 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . 0.545 ' CG1' ' CZ2' ' A' ' 656' ' ' TRP . 23.4 m -110.52 27.46 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.743 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.471 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 67.9 m-20 -148.82 164.68 33.74 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.976 0.417 . . . . 0.0 111.143 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -109.47 -63.53 0.53 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 46.8 t -58.6 -40.78 84.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.0 110.725 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.6 m -62.64 -35.59 80.09 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 109.561 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.636 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -60.13 -45.55 92.62 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.418 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . 0.571 ' CD1' ' C ' ' A' ' 664' ' ' LEU . 0.1 OUTLIER -57.97 -42.72 85.61 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.377 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . 0.498 ' N ' ' HG ' ' A' ' 664' ' ' LEU . 14.5 t70 -57.29 -39.6 76.05 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.158 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -94.56 -25.81 16.66 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.196 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.636 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.5 tt -53.24 -35.22 59.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.022 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.682 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 66.2 m-20 -54.92 -37.66 66.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.386 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 71.2 mt -76.76 -35.8 57.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.089 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.412 ' O ' ' C ' ' A' ' 671' ' ' GLN . 12.8 mt -70.44 -41.31 73.03 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.089 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.682 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 13.3 mt-30 41.35 64.64 5.15 Favored Pre-proline 0 C--N 1.331 -0.201 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -78.4 158.3 29.29 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 123.092 2.528 . . . . 0.0 113.47 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . 0.429 HG21 ' N ' ' A' ' 674' ' ' VAL . 5.9 tp -93.77 -21.28 6.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.554 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . 0.429 ' N ' HG21 ' A' ' 673' ' ' ILE . 62.1 t -142.19 137.75 29.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.539 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 64.7 mt -127.07 120.24 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.517 ' N ' ' CD2' ' A' ' 676' ' ' LEU . 0.0 OUTLIER -107.37 134.1 50.93 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.156 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.9 mtm -139.13 136.2 34.89 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.404 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -66.59 144.88 56.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.382 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.676 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 4.7 t-105 -113.13 -33.56 0.11 Allowed Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.715 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.676 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 20.1 Cg_exo -56.1 -43.0 60.65 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.013 1.809 . . . . 0.0 112.696 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 84.7 Cg_endo -83.59 165.37 14.05 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.739 2.293 . . . . 0.0 111.684 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.94 -82.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.381 2.054 . . . . 0.0 111.655 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 56.07 43.67 26.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.876 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -57.71 -30.35 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.428 -179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 94.2 p -64.61 -26.28 68.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.667 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -28.29 67.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.544 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 71.0 mt -62.7 -36.26 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.969 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 90.0 mt -68.42 -37.84 80.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.768 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 8.6 tt -56.58 -46.37 80.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.608 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.44 -39.0 91.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.734 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -61.66 -41.04 96.97 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.394 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 32.2 t-80 -59.91 -48.39 81.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.911 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.95 -42.03 68.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.612 -0.435 . . . . 0.0 109.939 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 57.0 ttm-85 -65.73 -28.02 68.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.5 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.32 -39.32 89.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.901 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.463 ' CG ' ' N ' ' A' ' 697' ' ' GLN . 2.2 p80 -140.88 -38.42 0.43 Allowed 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 119.844 -0.742 . . . . 0.0 112.342 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.463 ' N ' ' CG ' ' A' ' 696' ' ' HIS . 59.2 tp60 -59.66 -24.99 64.35 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.962 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.646 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -85.18 144.57 28.08 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.657 0.265 . . . . 0.0 111.531 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.646 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 38.3 t0 107.71 -39.4 0.0 OUTLIER Pre-proline 0 N--CA 1.469 0.486 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.049 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.525 ' CD ' ' C ' ' A' ' 698' ' ' ALA . 79.4 Cg_endo -85.32 -94.76 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 122.294 1.996 . . . . 0.0 111.534 179.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -130.61 76.33 77.56 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.769 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -48.39 128.04 16.87 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.871 2.38 . . . . 0.0 112.426 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -73.81 163.31 37.44 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 C-N-CA 122.653 2.235 . . . . 0.0 112.015 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.448 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 1.6 mm? -78.01 140.41 39.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.104 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 31.8 t -121.88 134.5 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.879 0.371 . . . . 0.0 111.127 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 47.4 mt -115.52 132.35 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.012 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -111.96 126.25 54.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.145 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.64 148.32 22.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.387 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 90.38 -128.89 9.48 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.27 163.13 37.94 Favored Pre-proline 0 CA--C 1.532 0.274 0 C-N-CA 121.264 -0.174 . . . . 0.0 110.763 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -68.45 138.9 43.59 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.157 1.904 . . . . 0.0 112.036 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . 0.412 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -47.64 151.96 3.05 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.388 2.059 . . . . 0.0 112.496 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 8.1 p -83.78 -46.61 18.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.115 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.24 147.56 90.58 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.423 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.22 -24.99 16.25 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.913 2.408 . . . . 0.0 113.175 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 77.0 mt -70.22 -29.61 66.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.923 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.487 ' CD1' ' N ' ' A' ' 717' ' ' LEU . 7.4 mp -77.76 -41.5 37.34 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.892 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 41.6 m -63.91 -42.81 97.31 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.03 90.4 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.969 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -83.82 -13.96 52.45 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.979 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -71.43 128.56 36.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.031 0.443 . . . . 0.0 110.809 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 31.9 t -85.5 -24.65 27.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.466 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.27 159.52 5.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.182 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 70.6 mt -136.39 125.93 38.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.779 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 50.7 mt -107.68 126.89 53.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.937 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 36.5 t -69.6 -87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.912 0.387 . . . . 0.0 110.358 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . 0.823 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 9.8 tttp -134.83 -34.49 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.833 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.823 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 36.9 Cg_exo -57.48 149.62 65.16 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.31 2.007 . . . . 0.0 112.659 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.48 -80.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.83 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 54.07 58.58 12.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.101 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -63.9 -15.77 50.99 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 C-N-CA 122.745 2.297 . . . . 0.0 112.165 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -70.78 -34.69 72.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.319 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.2 tp -68.85 -44.06 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.227 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 62.1 tp -53.19 -45.16 68.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.738 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.65 -40.22 96.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.218 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 58.3 m -58.6 -38.95 79.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.933 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 88.1 m -60.6 -39.69 89.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.994 179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 23.5 mt -63.57 -42.38 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.659 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 741' ' ' LEU . 25.0 mt-30 -65.88 -28.71 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.244 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . 0.553 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -22.7 -45.76 0.01 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.56 ' N ' ' O ' ' A' ' 739' ' ' GLN . 0.1 OUTLIER -86.62 -109.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.242 179.769 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 86.4 m 58.12 60.95 5.77 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.576 -0.283 . . . . 0.0 111.066 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -81.23 117.04 3.1 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.144 1.896 . . . . 0.0 110.907 179.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . 0.601 ' O ' ' OD1' ' A' ' 745' ' ' ASN . 94.5 Cg_endo -86.0 142.55 7.7 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.619 2.213 . . . . 0.0 112.964 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . 0.601 ' OD1' ' O ' ' A' ' 744' ' ' PRO . 71.0 m-20 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.255 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -63.8 140.2 43.88 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . 0.465 ' HE2' HD13 ' A' ' 655' ' ' ILE . 21.7 t-80 -85.76 120.65 27.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.582 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 52.9 mt -117.68 135.48 57.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.755 0.312 . . . . 0.0 111.467 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 7.6 tt -108.17 127.62 53.99 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.047 0.451 . . . . 0.0 110.316 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . 0.403 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 50.9 tp -110.15 125.05 52.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 9.0 tt -112.2 110.49 20.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.418 ' OE2' ' CB ' ' A' ' 678' ' ' ALA . 75.9 mm-40 -155.72 166.46 33.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.944 -179.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -111.98 165.36 12.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.23 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.3 tp10 65.76 121.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 111.078 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.526 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 81.6 m-20 -58.51 -37.18 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.023 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.27 -45.26 81.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.061 -179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.7 -39.49 70.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.421 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . 0.443 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -68.35 -43.09 78.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.505 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 72.3 m -60.91 -43.55 98.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 49.4 t -56.13 -54.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.771 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.65 -45.27 94.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.074 0.464 . . . . 0.0 110.112 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.607 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.4 OUTLIER -67.35 -41.0 85.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.893 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 641' ' ' THR . 86.0 tt0 -57.94 -40.6 80.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 80.8 mtp -67.04 -52.05 47.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.926 0.393 . . . . 0.0 110.428 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 80.4 mt -68.9 -43.28 75.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.826 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.607 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 34.5 m -56.24 -40.78 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.245 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.26 -25.85 62.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.684 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.71 -3.51 22.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.56 2.41 65.39 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.096 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -96.45 141.87 29.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 117.386 0.593 . . . . 0.0 110.651 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -87.85 110.89 20.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.215 0.531 . . . . 0.0 109.691 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . 0.403 ' CG1' ' HB2' ' A' ' 632' ' ' LEU . 81.5 t -116.52 136.85 52.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.97 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . 0.485 HG22 HD11 ' A' ' 655' ' ' ILE . 63.3 mt -108.9 133.42 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.851 179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . 0.526 ' CH2' ' OD1' ' A' ' 637' ' ' ASP . 23.8 t90 -92.96 111.59 23.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.756 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.419 ' HG ' ' H ' ' A' ' 659' ' ' ASP . 22.7 tp -123.81 135.56 53.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.766 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 21.1 m -105.72 -9.34 10.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.278 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.419 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 89.6 m-20 -100.95 152.04 21.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -102.78 -56.7 0.8 Allowed Glycine 0 CA--C 1.531 1.047 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.5 t -58.66 -40.78 84.47 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.888 0.375 . . . . 0.0 110.675 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 28.3 m -61.03 -38.85 87.61 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.619 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.55 -40.7 95.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.617 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . 0.439 ' O ' ' CG ' ' A' ' 668' ' ' ASP . 44.5 mt -57.8 -46.42 84.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.808 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.61 -43.49 93.59 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.817 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -84.67 -44.87 13.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.952 0.406 . . . . 0.0 111.391 -178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.619 ' N ' ' O ' ' A' ' 663' ' ' ALA . 9.6 tt -50.32 -35.06 25.97 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.5 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 664' ' ' LEU . 89.0 m-20 -55.36 -40.51 71.36 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.179 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 58.0 mt -74.5 -28.99 61.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 179.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 31.4 mt -72.39 -35.17 68.37 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.268 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.533 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 13.4 mm-40 43.4 62.23 9.19 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.533 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 3.6 Cg_exo -72.35 156.59 54.59 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.397 2.732 . . . . 0.0 113.335 -178.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . 0.472 HG22 HD11 ' A' ' 673' ' ' ILE . 70.9 mt -98.54 -27.52 3.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.263 179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 38.8 t -137.04 132.97 47.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.511 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 63.7 mt -128.67 125.21 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.227 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . 0.583 ' CD1' ' N ' ' A' ' 676' ' ' LEU . 5.1 mp -103.82 129.69 51.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.898 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.461 ' SD ' HD23 ' A' ' 690' ' ' LEU . 10.6 ptp -143.52 140.1 30.12 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.253 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . 0.418 ' CB ' ' OE2' ' A' ' 634' ' ' GLU . . . -67.04 152.58 45.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.374 178.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.732 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 63.3 t-105 -106.4 -26.69 0.19 Allowed Pre-proline 0 C--O 1.233 0.217 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.362 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.8 Cg_endo -101.55 29.22 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 123.428 2.752 . . . . 0.0 114.6 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 66.1 Cg_endo -77.13 151.18 30.12 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.645 1.564 . . . . 0.0 111.966 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -71.82 -14.16 29.64 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.319 2.013 . . . . 0.0 112.376 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -87.63 112.47 22.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.777 0.323 . . . . 0.0 111.484 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -65.51 -8.98 22.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 87.9 p -64.53 -23.16 67.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -178.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.551 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -62.57 -38.61 90.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.052 0.453 . . . . 0.0 109.839 179.088 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . 0.551 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 76.0 mt -66.16 -35.83 81.51 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.992 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 63.3 mt -66.52 -36.39 82.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.685 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 14.9 tp -59.56 -40.75 88.34 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . 0.461 HD23 ' SD ' ' A' ' 677' ' ' MET . 46.7 mt -59.61 -39.01 82.82 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.901 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.14 -42.21 94.39 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.62 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . 0.688 ' HE2' ' CE1' ' A' ' 696' ' ' HIS . 4.1 t60 -62.63 -61.09 2.67 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.536 ' O ' ' N ' ' A' ' 697' ' ' GLN . 1.6 pp -54.55 -33.13 59.61 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.868 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . 0.462 ' O ' ' OE1' ' A' ' 697' ' ' GLN . 23.5 ttt85 -60.82 -42.46 97.73 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.027 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -69.2 -39.79 78.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.688 ' CE1' ' HE2' ' A' ' 692' ' ' HIS . 64.5 m170 -96.11 14.3 24.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.632 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 693' ' ' LEU . 20.1 pt20 -58.07 -29.73 65.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.101 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -83.81 118.63 24.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.922 0.391 . . . . 0.0 111.039 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 701' ' ' HIS . 20.9 p-10 -172.96 135.57 0.73 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.426 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -43.62 -11.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.253 1.969 . . . . 0.0 111.937 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.585 ' N ' ' O ' ' A' ' 699' ' ' ASP . 0.3 OUTLIER -126.34 71.1 70.88 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.211 179.468 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.93 114.02 0.84 Allowed 'Trans proline' 0 C--N 1.307 -1.622 0 C-N-CA 122.802 2.334 . . . . 0.0 112.126 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.58 140.44 23.92 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 122.303 2.002 . . . . 0.0 112.183 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.708 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER -81.0 142.68 33.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.716 -179.771 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.4 ' O ' ' OG ' ' A' ' 722' ' ' SER . 40.5 t -126.05 125.98 68.89 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.041 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . 0.534 ' CD1' ' N ' ' A' ' 706' ' ' LEU . 4.9 mp -122.4 135.6 54.72 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.067 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -111.23 130.3 55.69 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.132 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 72.4 mt -96.85 146.46 24.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.541 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 88.2 -136.38 13.72 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.31 151.04 50.54 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.082 0.468 . . . . 0.0 110.85 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.17 156.14 65.78 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 123.112 2.541 . . . . 0.0 112.945 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . 0.662 ' C ' ' H ' ' A' ' 714' ' ' ASP . 29.4 Cg_endo -67.53 3.68 1.68 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.871 2.38 . . . . 0.0 112.292 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 55.2 t 60.42 -38.84 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.684 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . 0.662 ' H ' ' C ' ' A' ' 712' ' ' PRO . 52.1 m-20 -70.08 133.15 87.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.38 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -73.91 -19.53 20.61 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 122.312 2.008 . . . . 0.0 113.088 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . 0.438 ' H ' HD11 ' A' ' 716' ' ' LEU . 5.3 mp -71.36 -40.82 70.38 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.295 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.56 -37.09 57.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.652 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 31.8 m -63.37 -39.68 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.64 91.96 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.784 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -78.97 -20.23 49.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.548 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.38 142.79 50.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.53 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.409 ' HG ' ' N ' ' A' ' 723' ' ' ALA . 91.9 p -85.95 -29.02 23.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.33 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . 0.409 ' N ' ' HG ' ' A' ' 722' ' ' SER . . . -167.2 129.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 18.2 mm -98.19 128.3 49.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.542 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 725' ' ' LEU . 6.1 mp -107.68 145.02 33.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.674 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 12.3 t -164.86 -16.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.062 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.96 74.81 80.25 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.136 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -50.36 142.93 28.23 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.845 2.364 . . . . 0.0 112.748 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . 0.422 ' O ' ' O ' ' A' ' 730' ' ' ASP . 39.6 tp -174.43 93.17 0.08 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.402 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 729' ' ' LEU . 25.2 m-20 57.76 147.06 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.47 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -68.98 3.22 2.52 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 123.142 2.561 . . . . 0.0 112.319 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -67.42 -31.61 71.92 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.731 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 24.9 tp -67.69 -53.72 25.35 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.094 -0.642 . . . . 0.0 110.667 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 9.1 tt -57.15 -41.37 79.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.038 0.447 . . . . 0.0 110.76 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 24.2 tp -60.03 -39.52 86.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 35.4 m -58.33 -39.42 79.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.388 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 52.2 m -60.8 -43.33 98.28 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.901 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 57.6 mt -63.22 -37.01 85.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.108 0.48 . . . . 0.0 110.388 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.627 ' O ' ' SG ' ' A' ' 742' ' ' CYS . 91.2 mt-30 -64.67 -29.18 70.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.082 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.69 -20.3 3.92 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 67.4 mt -81.66 -74.2 0.35 Allowed 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.436 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.627 ' SG ' ' O ' ' A' ' 739' ' ' GLN . 98.5 m 51.36 59.62 15.35 Favored Pre-proline 0 C--N 1.326 -0.456 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.293 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -77.54 116.5 4.09 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 C-N-CA 122.465 2.11 . . . . 0.0 111.44 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . 0.557 ' HG2' ' H ' ' A' ' 745' ' ' ASN . 90.6 Cg_endo -86.44 -75.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.46 2.107 . . . . 0.0 112.469 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . 0.557 ' H ' ' HG2' ' A' ' 744' ' ' PRO . 25.6 t-20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.046 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 108.62 78.41 1.07 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -89.09 131.27 35.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 110.376 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 630' ' ' ILE . . . . . 0.43 HG12 ' CG1' ' A' ' 674' ' ' VAL . 54.6 mt -114.67 141.54 30.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 631' ' ' LEU . . . . . 0.405 ' N ' HG21 ' A' ' 630' ' ' ILE . 83.2 mt -103.9 131.5 51.06 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.209 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 10.6 tp -124.18 117.36 24.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.011 -179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.469 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 9.4 tt -117.21 120.1 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.386 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 634' ' ' GLU . . . . . 0.469 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 92.4 mt-10 -158.56 170.29 22.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.194 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 635' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 636' ' ' GLU . 96.4 mt-10 -110.06 158.52 18.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.352 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 636' ' ' GLU . . . . . 0.453 ' HG2' ' H ' ' A' ' 638' ' ' GLU . 83.3 tt0 62.16 127.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.925 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 637' ' ' ASP . . . . . 0.706 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 51.6 p30 -61.94 -29.97 70.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 638' ' ' GLU . . . . . 0.706 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 50.8 tp10 -63.29 -41.11 98.95 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.058 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.62 59.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 110.278 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.97 76.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.064 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 641' ' ' THR . . . . . 0.59 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 67.1 m -62.47 -46.18 89.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.085 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 642' ' ' VAL . . . . . 0.452 ' CG2' ' O ' ' A' ' 638' ' ' GLU . 89.4 t -56.77 -52.66 51.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.285 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 98.4 t -60.31 -41.9 88.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.803 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 644' ' ' CYS . . . . . 0.505 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.7 OUTLIER -58.58 -42.39 87.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.779 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.1 -39.28 91.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.171 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.0 mtt -66.97 -50.14 63.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.061 0.457 . . . . 0.0 110.109 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 73.1 mt -69.08 -46.03 68.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.293 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 648' ' ' THR . . . . . 0.505 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 61.7 m -56.3 -41.98 76.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.105 0.479 . . . . 0.0 109.858 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.95 -24.97 64.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.649 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.72 -6.24 39.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.905 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.41 -12.76 66.29 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.758 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -96.03 142.35 28.35 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.742 179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -92.77 134.34 35.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.184 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 4.0 m -122.99 153.66 28.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.025 0.441 . . . . 0.0 111.099 -179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 69.6 mt -108.96 135.44 47.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.708 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 18.9 t90 -92.7 126.1 37.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 111.241 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 657' ' ' LEU . . . . . 0.465 ' N ' ' CD2' ' A' ' 657' ' ' LEU . 3.9 mm? -115.12 143.2 45.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.677 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 658' ' ' VAL . . . . . 0.612 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 82.2 t -98.28 -18.95 6.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.17 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 659' ' ' ASP . . . . . 0.612 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 98.6 m-20 -147.85 150.13 33.58 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.473 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -65.49 -39.68 95.79 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 18.9 t -58.16 -40.34 81.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.759 0.314 . . . . 0.0 110.796 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.6 m -64.64 -38.94 92.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 663' ' ' ALA . . . . . 0.532 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.63 -46.41 85.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.495 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 67.5 mt -59.39 -42.19 91.12 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.811 -0.355 . . . . 0.0 111.134 -179.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -62.74 -40.13 96.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.804 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -84.63 -42.93 14.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.097 0.475 . . . . 0.0 110.66 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 667' ' ' LEU . . . . . 0.532 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.7 tt -45.29 -44.6 11.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.215 -179.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -58.56 -35.02 71.7 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.25 -38.52 56.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.928 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.492 ' CD2' ' N ' ' A' ' 670' ' ' LEU . 0.1 OUTLIER -77.41 -41.7 38.98 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.709 -178.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 671' ' ' GLN . . . . . 0.457 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 8.0 mm-40 58.88 62.71 4.18 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 0.0 109.899 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 672' ' ' PRO . . . . . 0.457 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 50.5 Cg_endo -80.35 165.76 20.76 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.365 2.71 . . . . 0.0 112.554 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 97.2 mt -94.92 -19.63 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.139 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 674' ' ' VAL . . . . . 0.43 ' CG1' HG12 ' A' ' 630' ' ' ILE . 14.9 p -141.05 141.92 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.309 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . 0.426 HD11 HG21 ' A' ' 675' ' ' ILE . 12.9 mm -119.93 124.51 72.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.134 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 51.1 mt -107.07 126.8 52.82 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 677' ' ' MET . . . . . 0.416 ' SD ' HG11 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -141.9 135.16 29.19 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.931 -0.707 . . . . 0.0 112.383 -178.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 678' ' ' ALA . . . . . 0.589 ' O ' ' SG ' ' A' ' 686' ' ' CYS . . . -68.09 152.55 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.67 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 679' ' ' TRP . . . . . 0.599 ' CG ' ' O ' ' A' ' 679' ' ' TRP . 74.6 t-105 -125.23 49.73 3.63 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.286 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . 0.5 ' HD3' ' N ' ' A' ' 679' ' ' TRP . 95.0 Cg_endo -84.2 135.07 6.18 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.547 2.165 . . . . 0.0 111.319 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 681' ' ' PRO . . . . . 0.638 ' C ' ' H ' ' A' ' 683' ' ' ASP . 16.3 Cg_exo -51.27 -47.42 25.99 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 121.93 1.754 . . . . 0.0 113.305 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 682' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 32.7 Cg_endo -65.91 29.58 0.1 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.69 1.594 . . . . 0.0 111.163 -179.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 683' ' ' ASP . . . . . 0.638 ' H ' ' C ' ' A' ' 681' ' ' PRO . 21.9 t70 -151.27 71.93 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.043 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.53 0.35 0.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.532 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 685' ' ' SER . . . . . 0.482 ' H ' ' C ' ' A' ' 683' ' ' ASP . 20.4 m -61.45 -33.41 73.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.299 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 686' ' ' CYS . . . . . 0.589 ' SG ' ' O ' ' A' ' 678' ' ' ALA . 91.0 m -59.05 -27.34 65.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.919 0.39 . . . . 0.0 110.342 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.68 -33.3 75.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.31 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.56 -39.1 84.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.301 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.53 -42.26 96.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.416 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.5 -44.1 96.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.868 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -61.99 -38.78 89.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.904 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -56.86 -50.12 73.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.0 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 693' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 697' ' ' GLN . 61.3 mt -55.07 -42.85 73.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.999 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 694' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 698' ' ' ALA . 84.2 mtp180 -67.68 -33.1 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -65.81 -32.15 73.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.488 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 696' ' ' HIS . . . . . 0.647 ' C ' ' H ' ' A' ' 698' ' ' ALA . 84.6 m-70 -126.25 -59.42 1.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.613 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 697' ' ' GLN . . . . . 0.639 ' N ' ' OE1' ' A' ' 697' ' ' GLN . 1.0 OUTLIER -63.85 19.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.374 -179.372 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.647 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . -86.02 21.7 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.898 0.38 . . . . 0.0 110.568 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 699' ' ' ASP . . . . . 0.537 ' H ' ' HD2' ' A' ' 700' ' ' PRO . 0.1 OUTLIER -168.73 -51.08 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.578 179.871 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 700' ' ' PRO . . . . . 0.537 ' HD2' ' H ' ' A' ' 699' ' ' ASP . 53.1 Cg_exo -52.41 -135.35 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.801 2.334 . . . . 0.0 112.054 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 701' ' ' HIS . . . . . 0.484 ' CD2' ' O ' ' A' ' 701' ' ' HIS . 39.6 p-80 -116.64 89.67 28.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.197 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.89 130.78 19.99 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.738 2.292 . . . . 0.0 112.549 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.97 166.35 29.41 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.687 2.258 . . . . 0.0 111.791 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.402 ' HG ' ' CB ' ' A' ' 722' ' ' SER . 6.4 tt -77.26 125.58 29.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . 0.416 HG11 ' SD ' ' A' ' 677' ' ' MET . 61.2 t -122.81 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.121 0.486 . . . . 0.0 111.706 -179.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 706' ' ' LEU . . . . . . . . . . . . . 19.7 mt -118.35 135.92 54.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.692 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -107.88 121.57 45.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.599 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 40.3 mt -98.94 134.55 41.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.164 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 134.1 -138.01 9.74 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.411 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 710' ' ' GLU . . . . . 0.603 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.9 OUTLIER -93.59 -176.93 0.62 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.674 0.273 . . . . 0.0 111.017 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' A' ' 710' ' ' GLU . 19.4 Cg_exo -61.74 157.49 42.36 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.719 2.28 . . . . 0.0 112.323 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.45 146.07 84.36 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.174 2.583 . . . . 0.0 112.778 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 54.4 t -84.22 -15.65 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.715 179.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -162.12 150.08 12.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.905 0.383 . . . . 0.0 110.398 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.4 -9.75 21.36 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.913 2.408 . . . . 0.0 112.939 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.4 mt -70.15 -39.88 75.1 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.767 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.523 ' C ' ' CD1' ' A' ' 717' ' ' LEU . 1.9 pp -80.56 -37.34 31.57 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 718' ' ' THR . . . . . 0.419 ' N ' ' HG ' ' A' ' 717' ' ' LEU . 30.9 m -63.83 -40.85 97.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.608 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.04 91.43 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-O 121.029 0.442 . . . . 0.0 109.998 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -74.25 -37.72 63.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.378 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.57 48.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.594 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 722' ' ' SER . . . . . 0.402 ' CB ' ' HG ' ' A' ' 704' ' ' LEU . 4.7 m -85.65 -23.15 27.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.47 163.99 8.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.371 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 31.6 mt -139.88 128.77 27.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.927 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 37.0 mt -106.9 125.41 50.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.131 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 59.0 m -72.1 -90.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.404 -179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 727' ' ' LYS . . . . . 0.804 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 26.9 tttt -130.71 -32.44 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 728' ' ' PRO . . . . . 0.804 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 48.0 Cg_exo -53.78 151.15 26.79 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.26 1.973 . . . . 0.0 112.08 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.54 -51.11 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.673 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 730' ' ' ASP . . . . . 0.469 ' N ' ' HD3' ' A' ' 731' ' ' PRO . 82.2 m-20 40.74 57.22 8.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.966 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 731' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 68.1 Cg_endo -82.55 -28.11 1.91 Allowed 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.567 2.178 . . . . 0.0 112.045 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -73.5 -37.39 65.7 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 49.5 tp -67.31 -40.51 86.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.862 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 27.5 tp -55.55 -47.22 76.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.932 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 9.4 tt -64.21 -44.42 91.99 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.271 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 91.3 m -61.2 -38.2 85.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.598 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 39.9 m -60.93 -42.54 98.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.202 -179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.6 -38.78 92.42 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.389 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 739' ' ' GLN . . . . . 0.532 ' C ' ' H ' ' A' ' 741' ' ' LEU . 97.0 mt-30 -64.49 -34.5 78.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.937 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -60.64 1.68 0.69 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 741' ' ' LEU . . . . . 0.532 ' H ' ' C ' ' A' ' 739' ' ' GLN . 63.1 tp -82.84 -15.87 49.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.797 0.332 . . . . 0.0 110.602 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 742' ' ' CYS . . . . . 0.452 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 0.5 OUTLIER 60.22 65.74 2.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.015 0.436 . . . . 0.0 110.594 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 743' ' ' PRO . . . . . 0.452 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 3.0 Cg_exo -70.5 116.34 4.59 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.133 1.889 . . . . 0.0 110.583 179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 744' ' ' PRO . . . . . 0.511 ' HG2' ' H ' ' A' ' 745' ' ' ASN . 94.4 Cg_endo -88.52 -72.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.448 2.099 . . . . 0.0 112.611 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 745' ' ' ASN . . . . . 0.511 ' H ' ' HG2' ' A' ' 744' ' ' PRO . 4.5 p30 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.501 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -96.09 135.18 38.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.789 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' A' ' 654' ' ' VAL . 57.5 mt -118.87 134.11 63.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.193 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.791 HD21 ' HB1' ' A' ' 663' ' ' ALA . 27.1 tp -107.21 131.67 53.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.097 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.456 HD12 ' HB2' ' A' ' 676' ' ' LEU . 4.6 tp -133.06 127.36 33.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.889 0.376 . . . . 0.0 111.877 -178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 633' ' ' LEU . 7.9 mp -109.68 119.12 38.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.57 ' OE2' ' HB1' ' A' ' 639' ' ' ALA . 83.9 tt0 -159.06 156.97 30.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.012 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.65 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 85.3 tt0 -115.59 138.17 51.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.65 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 69.1 tt0 103.56 113.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.47 ' O ' ' OG1' ' A' ' 641' ' ' THR . 62.1 t0 -57.54 -36.04 71.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.333 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.4 -44.47 82.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.664 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.57 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -70.58 -43.2 69.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.832 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.35 87.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 86.9 m -62.22 -44.28 96.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.686 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 56.6 t -57.75 -53.73 40.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.46 -46.26 92.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.149 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.566 ' O ' ' OG1' ' A' ' 648' ' ' THR . 73.2 m -61.46 -35.74 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.031 -179.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -62.48 -40.32 96.3 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.913 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 89.5 mtp -67.36 -51.61 50.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.944 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.678 HD22 HG21 ' A' ' 654' ' ' VAL . 6.6 mp -67.89 -42.68 80.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.675 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.566 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 87.1 m -55.64 -42.08 74.5 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.759 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.06 -29.57 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.029 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.31 -6.65 47.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.735 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.25 2.4 73.98 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 652' ' ' PHE . . . . . 0.621 ' CE2' HD22 ' A' ' 735' ' ' LEU . 84.2 m-85 -96.88 145.15 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.122 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -93.43 128.92 39.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.689 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.678 HG21 HD22 ' A' ' 647' ' ' LEU . 71.8 t -124.61 138.01 55.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.552 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 53.3 mt -105.66 130.74 56.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 0.0 110.495 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.535 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 24.4 t90 -96.66 111.51 23.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.429 ' CD1' ' HA ' ' A' ' 663' ' ' ALA . 64.6 mt -116.4 141.86 47.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.708 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.532 ' O ' HG12 ' A' ' 658' ' ' VAL . 18.4 t -101.35 2.28 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -148.42 136.33 20.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 0.0 110.879 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.484 ' H ' ' HB2' ' A' ' 685' ' ' SER . . . -61.48 -37.9 94.9 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 90.0 p -60.02 -34.98 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.832 0.349 . . . . 0.0 110.229 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 19.2 m -64.75 -39.6 93.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.642 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.791 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -63.87 -43.61 95.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.043 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.72 -39.31 84.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.37 . . . . 0.0 110.834 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 665' ' ' ASP . . . . . 0.576 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 23.4 t70 -62.43 -41.52 98.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.949 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.574 ' O ' HD23 ' A' ' 670' ' ' LEU . 42.5 mt-30 -90.08 -45.23 9.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.126 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 663' ' ' ALA . 0.9 OUTLIER -44.56 -44.64 8.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.2 -179.132 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 668' ' ' ASP . . . . . 0.576 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 30.1 p-10 -61.81 -35.74 79.08 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.45 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.482 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 65.3 mt -78.23 -48.16 16.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.933 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.574 HD23 ' O ' ' A' ' 666' ' ' GLN . 0.7 OUTLIER -82.62 -29.32 30.2 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.527 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 667' ' ' LEU . 6.6 mt-30 45.56 81.17 0.26 Allowed Pre-proline 0 C--N 1.329 -0.321 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.115 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.69 157.19 18.69 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 123.028 2.485 . . . . 0.0 112.427 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.745 HG13 HG23 ' A' ' 674' ' ' VAL . 26.3 pt -94.02 -10.7 9.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.69 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.745 HG23 HG13 ' A' ' 673' ' ' ILE . 83.4 t -139.7 134.05 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.49 HD11 HD11 ' A' ' 667' ' ' LEU . 62.2 mt -128.93 119.54 49.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.05 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.456 ' HB2' HD12 ' A' ' 632' ' ' LEU . 3.5 mp -107.68 137.68 45.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.071 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.572 ' CE ' ' HG ' ' A' ' 686' ' ' CYS . 74.8 mtm -138.17 133.44 33.31 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.197 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.587 ' O ' ' OD2' ' A' ' 683' ' ' ASP . . . -67.51 145.05 55.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.248 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.767 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 32.9 t-105 -113.21 -15.1 0.11 Allowed Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.767 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 75.4 Cg_exo -46.6 162.79 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.711 1.607 . . . . 0.0 112.296 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.537 ' N ' ' HD2' ' A' ' 682' ' ' PRO . 23.8 Cg_exo -50.47 -49.99 14.91 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.678 2.252 . . . . 0.0 114.112 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 10.7 Cg_endo -55.79 -6.12 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 121.51 1.474 . . . . 0.0 111.234 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.587 ' OD2' ' O ' ' A' ' 678' ' ' ALA . 27.3 t0 -83.53 155.23 23.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.96 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -179.09 -31.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.508 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 685' ' ' SER . . . . . 0.484 ' HB2' ' H ' ' A' ' 660' ' ' GLY . 83.7 p -66.3 -28.31 68.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.592 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.572 ' HG ' ' CE ' ' A' ' 677' ' ' MET . 1.6 t -61.25 -22.25 64.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 687' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 687' ' ' LEU . 88.1 mt -64.79 -34.61 78.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.913 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.2 -39.86 86.4 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.968 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.616 ' O ' HD23 ' A' ' 689' ' ' LEU . 7.3 tt -61.85 -40.88 96.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.022 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.46 HD13 HD22 ' A' ' 717' ' ' LEU . 95.4 mt -60.26 -38.56 83.89 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.335 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 691' ' ' GLN . . . . . 0.476 ' HA ' ' NH1' ' A' ' 694' ' ' ARG . 60.8 tt0 -61.01 -42.14 97.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.978 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -58.36 -49.35 77.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.105 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.53 -38.77 69.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.523 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.476 ' NH1' ' HA ' ' A' ' 691' ' ' GLN . 34.0 ttm105 -65.24 -37.57 87.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -68.41 -37.79 80.66 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.738 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 33.0 m80 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.428 179.878 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 702' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 703' ' ' PRO . 11.8 Cg_endo . . . . . 0 N--CA 1.494 1.512 0 CA-C-O 120.492 0.121 . . . . 0.0 112.4 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 703' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 702' ' ' PRO . 46.5 Cg_exo -51.35 -149.61 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 94.8 mt -154.25 123.25 6.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.328 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.524 ' O ' ' OG ' ' A' ' 722' ' ' SER . 21.1 t -107.36 127.17 63.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.17 0.509 . . . . 0.0 111.499 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.622 ' N ' HD12 ' A' ' 706' ' ' LEU . 5.2 mp -121.35 139.37 53.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.363 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -106.78 128.79 54.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.105 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.6 mt -93.71 146.79 23.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.598 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 86.66 -126.04 7.7 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -90.26 159.44 41.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 110.779 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.513 ' HB3' HD13 ' A' ' 724' ' ' ILE . 72.6 Cg_endo -79.04 149.05 22.23 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.787 2.324 . . . . 0.0 112.338 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -64.92 145.61 86.09 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.71 2.274 . . . . 0.0 112.052 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 79.7 t -80.13 -37.68 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 714' ' ' ASP . . . . . 0.636 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.3 OUTLIER -71.98 139.57 82.7 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.494 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.28 -17.01 21.88 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.599 2.199 . . . . 0.0 112.925 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 21.3 tp -70.05 -38.93 75.95 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.829 -0.349 . . . . 0.0 111.015 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.513 ' CD1' ' CH2' ' A' ' 679' ' ' TRP . 48.5 mt -77.06 -34.86 57.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 61.0 m -64.98 -41.14 95.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.922 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.89 96.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.429 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -82.76 -8.22 59.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.56 131.66 41.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 705' ' ' VAL . 83.4 p -86.42 -29.18 23.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.667 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.08 131.77 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.513 HD13 ' HB3' ' A' ' 711' ' ' PRO . 60.9 mt -93.16 128.48 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.119 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 33.8 mt -107.79 148.48 29.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.387 . . . . 0.0 111.252 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.5 t -167.42 -66.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.517 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 727' ' ' LYS . . . . . 0.441 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 0.7 OUTLIER -135.06 59.74 35.72 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.207 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 63.5 Cg_endo -79.72 141.14 15.19 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.915 2.41 . . . . 0.0 112.295 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.517 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.2 OUTLIER -67.01 109.3 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.771 179.698 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.517 ' O ' ' O ' ' A' ' 729' ' ' LEU . 31.1 m-20 54.85 147.84 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.39 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -63.32 0.25 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 123.083 2.522 . . . . 0.0 111.898 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 730' ' ' ASP . 95.0 mt-30 -68.13 -29.95 68.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.581 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.8 tp -63.71 -42.86 97.89 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.55 -43.65 89.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.193 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 735' ' ' LEU . . . . . 0.621 HD22 ' CE2' ' A' ' 652' ' ' PHE . 31.4 mt -61.53 -36.9 81.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.168 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.7 m -58.9 -42.26 89.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.331 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.8 m -62.0 -42.78 99.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.609 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.5 tt -64.78 -43.95 91.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.668 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 741' ' ' LEU . 96.9 mm-40 -66.53 -32.33 73.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.889 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.39 -5.93 0.37 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.145 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 739' ' ' GLN . 38.7 tp . . . . . 0 C--N 1.328 -0.337 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.783 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.78 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -93.98 135.64 35.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.62 HG23 HG13 ' A' ' 674' ' ' VAL . 59.1 mt -115.82 135.93 54.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.366 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 1.096 HD22 HD12 ' A' ' 667' ' ' LEU . 16.3 tp -111.0 130.41 55.6 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.868 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.458 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 19.0 tp -116.09 125.65 52.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.771 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 14.7 tp -118.37 112.93 20.65 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.575 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 84.2 tt0 -160.35 164.96 32.06 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.719 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 77.5 mm-40 -106.07 168.2 9.29 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.409 ' HB3' ' O ' ' A' ' 635' ' ' GLU . 43.3 tp10 67.7 110.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.42 . . . . 0.0 110.48 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.563 ' OD1' ' OG1' ' A' ' 641' ' ' THR . 63.0 t0 -56.99 -36.02 69.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.292 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -62.67 -42.13 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.353 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.32 -45.99 57.53 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.563 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.474 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -65.1 -36.39 84.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.576 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.563 ' OG1' ' OD1' ' A' ' 637' ' ' ASP . 77.2 m -63.34 -46.55 86.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.646 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 41.7 t -54.69 -50.25 61.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.515 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 98.8 t -58.92 -43.52 88.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.87 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.588 ' O ' ' OG1' ' A' ' 648' ' ' THR . 71.1 m -67.34 -37.51 83.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.796 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -62.25 -39.48 93.01 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.352 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.6 mtm -65.8 -49.75 67.14 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.942 -0.703 . . . . 0.0 109.855 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.719 ' CD1' HG21 ' A' ' 654' ' ' VAL . 42.0 mt -70.52 -43.58 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.663 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 85.0 m -55.83 -42.36 75.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.938 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.91 -33.79 76.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -76.14 -5.46 46.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.43 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.74 14.8 66.91 Favored Glycine 0 CA--C 1.53 1.023 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 652' ' ' PHE . . . . . 0.568 ' CZ ' HD11 ' A' ' 735' ' ' LEU . 9.2 m-85 -91.33 143.68 26.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -91.37 114.54 27.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.719 HG21 ' CD1' ' A' ' 647' ' ' LEU . 61.1 t -128.82 134.25 64.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.095 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 655' ' ' ILE . . . . . 0.459 ' HB ' HD12 ' A' ' 631' ' ' LEU . 53.0 mt -112.49 125.02 69.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.403 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.575 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 22.6 t90 -94.53 119.92 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.502 HD12 ' HB2' ' A' ' 663' ' ' ALA . 52.8 mt -119.58 149.31 42.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.992 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.574 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 30.6 m -113.38 10.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.635 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 85.5 m-20 -149.86 121.06 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.271 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.92 -42.29 99.62 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 79.9 p -58.93 -37.67 77.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.074 0.464 . . . . 0.0 110.22 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 29.0 m -65.27 -39.69 92.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.103 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -64.62 -41.78 95.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.184 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.19 -46.12 89.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 111.446 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -61.78 -40.38 94.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.022 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -88.61 -54.79 4.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.476 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 1.096 HD12 HD22 ' A' ' 631' ' ' LEU . 10.3 tt -48.32 -35.19 11.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.484 -178.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -53.55 -40.61 65.68 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.193 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 57.0 mt -79.51 -24.98 41.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.724 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 32.3 mt -71.57 -35.61 70.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.801 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.499 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.2 mm-40 47.23 63.87 9.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 5.9 Cg_exo -73.11 160.02 46.38 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 123.178 2.586 . . . . 0.0 112.857 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 81.1 mt -94.53 -23.1 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.992 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.62 HG13 HG23 ' A' ' 630' ' ' ILE . 10.5 p -145.82 141.07 21.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.067 0.461 . . . . 0.0 111.13 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 79.0 mt -124.32 119.35 56.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.192 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.439 HD23 ' HB2' ' A' ' 706' ' ' LEU . 70.2 mt -105.5 131.44 52.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.36 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 7.2 ptm -145.83 138.29 25.58 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.99 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.38 149.31 48.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.743 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 28.3 t-105 -110.63 -34.33 0.13 Allowed Pre-proline 0 C--N 1.328 -0.334 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.993 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.743 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 39.0 Cg_exo -52.56 -41.48 67.99 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.23 1.954 . . . . 0.0 112.762 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 24.0 Cg_exo -59.63 134.52 58.32 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.133 1.889 . . . . 0.0 112.094 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.35 33.33 0.52 Allowed 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.883 2.389 . . . . 0.0 112.437 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -81.45 111.76 18.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.153 0.502 . . . . 0.0 110.873 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -61.04 -24.94 66.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.68 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 38.6 m -59.95 -36.54 77.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.511 ' O ' ' CD1' ' A' ' 690' ' ' LEU . 73.6 m -59.97 -34.55 73.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.58 -34.91 79.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.416 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.773 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -70.48 -35.65 73.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.24 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.489 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 4.9 tp -60.47 -43.71 96.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.71 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.511 ' CD1' ' O ' ' A' ' 686' ' ' CYS . 7.0 mp -61.94 -38.89 90.18 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.857 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -60.13 -41.98 93.84 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.206 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -61.6 -54.63 40.46 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.575 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.609 HD13 ' NE2' ' A' ' 696' ' ' HIS . 1.7 mm? -55.17 -37.66 67.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.124 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -60.37 -37.16 79.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.263 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -68.44 -40.89 80.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.164 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.628 ' C ' ' HD1' ' A' ' 696' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.236 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 N--CA 1.488 1.177 0 CA-C-O 120.764 0.235 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -69.59 149.16 67.65 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.721 2.281 . . . . 0.0 111.914 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 37.1 mt -78.71 141.35 37.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.661 ' C ' HD12 ' A' ' 706' ' ' LEU . 59.8 t -121.84 125.96 73.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.309 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.661 HD12 ' C ' ' A' ' 705' ' ' VAL . 5.4 mp -131.2 138.17 49.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.072 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 707' ' ' PHE . . . . . 0.852 ' CE2' ' HB2' ' A' ' 721' ' ' ALA . 13.0 m-85 -113.37 130.31 56.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.505 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.711 ' N ' HD12 ' A' ' 708' ' ' LEU . 5.4 mp -94.88 148.72 22.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.408 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 709' ' ' GLY . . . . . 0.581 ' O ' ' O ' ' A' ' 725' ' ' LEU . . . 101.83 -134.93 11.94 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.36 154.09 48.73 Favored Pre-proline 0 CA--C 1.529 0.173 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -81.87 131.83 7.24 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 C-N-CA 122.655 2.236 . . . . 0.0 112.586 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.474 ' HB3' HD23 ' A' ' 717' ' ' LEU . 24.2 Cg_exo -52.17 152.01 15.75 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.106 1.871 . . . . 0.0 111.636 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 76.9 t -80.99 -21.9 10.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.868 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -72.53 132.27 83.81 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.678 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -74.45 -30.22 8.41 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.281 1.987 . . . . 0.0 111.886 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.507 ' HG ' ' N ' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -75.69 -32.18 60.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.957 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.507 ' N ' ' HG ' ' A' ' 716' ' ' LEU . 42.3 tp -76.78 -42.91 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 718' ' ' THR . . . . . 0.409 HG23 ' CD1' ' A' ' 724' ' ' ILE . 30.4 m -64.4 -39.41 93.79 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.72 -32.1 73.46 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -71.06 -31.43 67.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.853 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 721' ' ' ALA . . . . . 0.852 ' HB2' ' CE2' ' A' ' 707' ' ' PHE . . . -70.87 150.46 45.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.683 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.498 ' N ' ' O ' ' A' ' 705' ' ' VAL . 74.2 m -84.18 -26.95 28.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.148 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 159.45 5.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.359 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.409 ' CD1' HG23 ' A' ' 718' ' ' THR . 73.9 mt -142.45 131.99 22.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.157 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.581 ' O ' ' O ' ' A' ' 709' ' ' GLY . 5.3 mp -102.93 148.43 25.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.242 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 20.6 p -165.71 6.63 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.128 0.49 . . . . 0.0 110.06 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -139.22 64.12 31.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.953 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -55.91 126.4 22.3 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.269 1.979 . . . . 0.0 112.477 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.938 ' O ' HD12 ' A' ' 729' ' ' LEU . 0.3 OUTLIER 178.49 -14.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.907 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -143.87 75.23 16.08 Favored Pre-proline 0 CA--C 1.528 0.12 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.378 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -56.52 -9.89 4.34 Favored 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.621 2.214 . . . . 0.0 111.408 179.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.521 ' O ' ' OE1' ' A' ' 732' ' ' GLN . 0.0 OUTLIER -72.64 -22.48 60.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.438 -179.462 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.71 -47.63 68.81 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 66.9 tp -59.97 -43.96 94.75 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.676 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 735' ' ' LEU . . . . . 0.568 HD11 ' CZ ' ' A' ' 652' ' ' PHE . 24.4 tp -59.06 -38.46 79.47 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 94.1 m -60.45 -37.1 79.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.505 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 57.7 m -59.85 -47.72 84.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.418 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.503 ' O ' HD23 ' A' ' 738' ' ' LEU . 8.2 tt -66.73 -38.77 87.34 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.504 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.612 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.4 mm-40 -64.61 -28.92 69.95 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.916 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -55.11 3.21 0.02 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.612 ' H ' ' C ' ' A' ' 739' ' ' GLN . 39.6 tp . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.805 0.336 . . . . 0.0 110.906 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.671 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -88.0 136.21 33.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.968 0.414 . . . . 0.0 110.925 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.836 ' HB ' HG12 ' A' ' 654' ' ' VAL . 78.6 mt -115.69 140.17 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.459 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.734 HD23 HD12 ' A' ' 667' ' ' LEU . 63.2 tp -108.76 132.08 54.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.964 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.649 HD23 ' C ' ' A' ' 632' ' ' LEU . 8.4 tt -135.19 123.32 22.88 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.189 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.719 HD22 HD22 ' A' ' 689' ' ' LEU . 9.6 mp -107.59 115.48 30.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.094 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.481 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.9 tt0 -159.92 157.59 29.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.886 0.374 . . . . 0.0 111.177 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.654 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.1 tt0 -115.37 144.52 43.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.394 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.654 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 42.6 tp10 110.96 109.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.724 0.64 . . . . 0.0 110.338 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.702 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.0 p30 -66.62 -34.42 77.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.745 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.702 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.8 mt-10 -67.43 -50.7 58.25 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.679 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -68.23 -36.14 79.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.171 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 656' ' ' TRP . . . -68.85 -40.15 79.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.23 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 62.4 m -60.89 -47.63 85.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.023 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 92.0 t -58.11 -53.37 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.467 . . . . 0.0 110.439 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.96 -46.43 94.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.252 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.527 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.7 t -56.09 -39.96 72.9 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.574 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -61.38 -37.32 82.97 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.95 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.1 mtt -66.12 -54.18 28.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.324 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.05 -43.68 78.13 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.539 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.527 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 29.3 m -55.86 -42.38 75.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.251 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.92 64.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.758 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -68.99 -4.93 18.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.611 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.35 -0.85 78.62 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -98.19 137.3 37.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.164 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -93.6 126.91 39.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.866 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.836 HG12 ' HB ' ' A' ' 630' ' ' ILE . 10.5 m -126.04 151.59 32.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 110.986 -179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 19.1 mm -108.91 127.48 65.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.62 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.533 ' CE2' ' HB1' ' A' ' 640' ' ' ALA . 3.6 t-105 -96.16 119.3 34.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.05 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.906 HD23 ' HB2' ' A' ' 663' ' ' ALA . 16.7 tp -132.62 139.08 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.969 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 17.6 m -99.13 -7.81 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.143 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.573 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 93.0 m-20 -98.39 155.15 17.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -97.24 -64.14 0.9 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.95 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.8 t -57.78 -39.9 78.56 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 121.128 -0.229 . . . . 0.0 111.441 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 60.2 m -62.78 -37.95 88.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.936 0.398 . . . . 0.0 110.406 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.906 ' HB2' HD23 ' A' ' 657' ' ' LEU . . . -62.6 -41.3 98.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.528 HD13 ' ND1' ' A' ' 692' ' ' HIS . 61.1 mt -58.82 -47.45 84.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.065 0.459 . . . . 0.0 110.719 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -61.4 -38.82 88.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.688 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -83.87 -34.1 24.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.72 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.781 ' O ' HD23 ' A' ' 667' ' ' LEU . 8.1 tt -50.93 -39.25 54.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.659 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -56.06 -35.95 67.52 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 669' ' ' LEU . 74.5 mt -75.81 -30.54 59.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.459 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.58 ' CD1' HD13 ' A' ' 631' ' ' LEU . 28.4 mt -71.79 -37.41 70.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.187 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.483 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 42.2 mm-40 45.36 60.78 13.04 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.647 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 95.6 Cg_endo -89.67 157.93 5.21 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 123.43 2.754 . . . . 0.0 112.552 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.542 HG13 HG23 ' A' ' 674' ' ' VAL . 24.0 pt -97.33 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.783 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.646 HG21 ' HG ' ' A' ' 738' ' ' LEU . 41.7 t -142.66 139.52 28.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.928 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 73.4 mt -124.73 126.05 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.431 HD21 HD11 ' A' ' 734' ' ' LEU . 5.1 mp -104.63 137.8 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.737 ' SD ' ' N ' ' A' ' 678' ' ' ALA . 0.2 OUTLIER -137.22 121.97 18.67 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.03 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.737 ' N ' ' SD ' ' A' ' 677' ' ' MET . . . -66.63 153.91 41.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.79 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 56.9 t-105 -110.19 66.19 0.44 Allowed Pre-proline 0 C--N 1.328 -0.336 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.564 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.418 ' HD3' ' C ' ' A' ' 678' ' ' ALA . 40.2 Cg_endo -69.54 169.17 19.26 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.962 2.442 . . . . 0.0 111.454 178.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 682' ' ' PRO . 2.7 Cg_endo -50.02 172.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.243 1.962 . . . . 0.0 111.225 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.703 ' O ' ' N ' ' A' ' 684' ' ' GLN . 60.3 Cg_exo -25.73 -65.52 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.267 2.645 . . . . 0.0 112.989 -179.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.66 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 91.9 m-20 54.11 -70.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.482 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 684' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 682' ' ' PRO . 7.1 tp60 103.37 -29.2 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.592 0.558 . . . . 0.0 111.113 179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 86.5 p -66.04 -42.05 90.06 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 90.6 m -65.98 -36.65 83.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 110.578 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.4 mt -64.59 -32.79 74.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.869 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.819 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.95 -36.01 74.94 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.038 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.719 HD22 HD22 ' A' ' 633' ' ' LEU . 6.3 tp -59.51 -47.38 85.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.378 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.458 HD13 HD12 ' A' ' 693' ' ' LEU . 4.6 mm? -61.76 -41.58 97.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.388 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.36 -42.78 96.5 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.623 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.528 ' ND1' HD13 ' A' ' 664' ' ' LEU . 5.7 t60 -58.07 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.569 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.458 HD12 HD13 ' A' ' 690' ' ' LEU . 88.2 mt -54.56 -42.75 71.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.115 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -65.11 -34.37 78.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.358 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.79 -36.54 78.4 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.487 ' CD2' ' HE2' ' A' ' 692' ' ' HIS . 2.0 m-70 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.423 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 N--CA 1.49 1.269 0 CA-C-O 120.865 0.277 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -49.26 155.67 2.97 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.716 2.277 . . . . 0.0 111.596 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 27.0 mt -77.03 138.62 39.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.691 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 24.8 t -121.69 132.59 70.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.651 HD21 HG21 ' A' ' 737' ' ' THR . 67.9 mt -111.19 137.51 48.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.634 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -113.77 121.83 45.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.259 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.713 ' N ' HD12 ' A' ' 708' ' ' LEU . 4.1 mp -98.72 142.24 30.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.892 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 104.63 -134.3 11.93 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -92.14 157.29 41.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.946 0.403 . . . . 0.0 110.784 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -70.94 145.16 49.64 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.747 2.298 . . . . 0.0 111.719 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.72 145.81 70.67 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.636 2.224 . . . . 0.0 112.282 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.51 -40.09 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.7 144.53 86.03 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.373 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.38 -14.87 14.42 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 112.292 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.61 -32.21 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.652 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -76.67 -34.95 58.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.513 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 25.6 m -62.83 -41.88 99.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.782 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.82 92.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.032 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tp60 -75.95 -28.96 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.579 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.5 126.53 30.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.949 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 84.8 p -86.61 -24.18 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.85 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.602 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -170.78 126.75 0.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.386 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.5 mt -90.19 131.06 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.624 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.4 HD11 HD13 ' A' ' 706' ' ' LEU . 18.6 mt -107.52 155.78 19.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.902 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 2.2 p -166.48 60.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.921 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 727' ' ' LYS . . . . . 0.472 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 15.1 tttt 57.65 61.77 5.78 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.308 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.472 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 62.7 Cg_endo -86.42 145.41 8.2 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.535 ' C ' ' CG ' ' A' ' 730' ' ' ASP . 1.6 mp -67.11 151.66 47.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.51 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.679 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.0 OUTLIER 50.88 93.43 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.13 8.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.847 2.364 . . . . 0.0 111.794 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.679 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -68.02 -25.66 65.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.671 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.03 -46.78 79.89 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.618 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.451 ' C ' HD23 ' A' ' 734' ' ' LEU . 10.1 tt -58.57 -44.78 89.87 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 735' ' ' LEU . . . . . 0.462 HD23 ' C ' ' A' ' 735' ' ' LEU . 9.7 tt -61.73 -39.56 91.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.577 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 31.8 m -60.09 -36.85 78.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.101 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 737' ' ' THR . . . . . 0.651 HG21 HD21 ' A' ' 706' ' ' LEU . 44.6 m -60.56 -46.41 90.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.604 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.646 ' HG ' HG21 ' A' ' 674' ' ' VAL . 6.5 mp -65.45 -39.52 92.13 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.677 ' C ' ' H ' ' A' ' 741' ' ' LEU . 6.2 tp-100 -63.86 -28.02 69.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.367 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.68 2.86 0.01 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.677 ' H ' ' C ' ' A' ' 739' ' ' GLN . 20.0 tp . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.652 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -88.37 135.35 33.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.944 0.402 . . . . 0.0 110.64 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.592 HG23 HG13 ' A' ' 674' ' ' VAL . 90.9 mt -112.67 138.51 41.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.286 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 17.3 tp -107.49 127.59 53.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.402 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.55 HD23 ' C ' ' A' ' 632' ' ' LEU . 9.6 tt -131.63 123.41 27.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.664 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.468 ' CD1' HD13 ' A' ' 689' ' ' LEU . 47.9 mt -106.76 124.21 49.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.902 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.521 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.2 tt0 -159.47 163.53 35.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.672 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 78.5 tt0 -105.4 159.83 15.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.576 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.483 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 84.6 tt0 68.42 117.51 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.57 ' O ' ' OG1' ' A' ' 641' ' ' THR . 4.2 p30 -63.21 -34.58 77.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.669 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.93 -45.29 82.37 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.214 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.83 77.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.04 0.447 . . . . 0.0 110.127 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.548 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -66.44 -35.64 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.595 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.57 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.0 m -62.32 -46.63 87.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.694 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 55.2 t -56.91 -51.94 61.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.552 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.97 -48.1 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.667 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 656' ' ' TRP . 71.7 m -67.04 -30.53 70.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 645' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 641' ' ' THR . 51.2 tp10 -61.34 -43.39 98.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.024 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 9.1 mmt -67.28 -43.88 80.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.182 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.69 -45.98 77.07 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.92 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 26.8 m -56.34 -42.83 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.465 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.66 65.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.449 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.23 -4.99 28.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.365 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.55 -4.98 73.59 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.56 139.48 32.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -94.07 126.94 39.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.43 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.2 p -130.54 142.96 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.571 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 18.7 mm -108.19 122.89 63.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.329 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.548 ' CG ' ' HB1' ' A' ' 640' ' ' ALA . 19.5 t90 -95.75 117.07 29.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.766 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 66.0 mt -118.57 147.49 43.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 658' ' ' VAL . 3.6 p -110.12 20.64 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.265 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -149.44 123.67 9.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.677 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.35 -40.03 96.95 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.544 -0.623 . . . . 0.0 111.544 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 55.5 p -60.26 -38.72 84.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.081 0.467 . . . . 0.0 110.17 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.3 m -65.23 -35.46 81.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.902 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.78 -45.1 91.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.228 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 44.6 mt -59.75 -41.06 90.14 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.558 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -63.0 -42.72 99.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.425 ' O ' HD23 ' A' ' 670' ' ' LEU . 96.5 mm-40 -86.25 -42.6 13.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.973 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 663' ' ' ALA . 1.1 tt -45.24 -44.67 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.889 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.97 -34.54 76.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.513 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 50.8 mt -78.4 -45.94 21.11 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.4 OUTLIER -83.49 -13.55 54.38 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.183 -0.607 . . . . 0.0 112.07 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.456 ' C ' ' O ' ' A' ' 670' ' ' LEU . 1.5 mt-30 38.24 74.82 0.61 Allowed Pre-proline 0 C--N 1.327 -0.393 0 C-N-CA 120.375 -0.53 . . . . 0.0 109.997 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -76.89 146.39 26.08 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.84 2.36 . . . . 0.0 112.289 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 21.8 pt -92.55 -13.13 8.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.592 HG13 HG23 ' A' ' 630' ' ' ILE . 14.5 p -145.02 139.06 22.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.215 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.16 125.09 70.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.934 0.397 . . . . 0.0 111.204 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.4 mp -105.26 136.9 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.431 ' CE ' HD12 ' A' ' 633' ' ' LEU . 92.5 mtp -140.36 117.58 11.29 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.731 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.405 ' C ' ' HD3' ' A' ' 680' ' ' PRO . . . -67.59 153.02 44.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.981 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.425 ' NE1' ' HA ' ' A' ' 712' ' ' PRO . 6.2 t-105 -120.98 57.97 6.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.209 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.444 ' O ' ' CB ' ' A' ' 683' ' ' ASP . 72.5 Cg_endo -77.0 152.78 31.97 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.891 2.394 . . . . 0.0 111.591 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.655 ' C ' ' H ' ' A' ' 683' ' ' ASP . 1.7 Cg_endo -51.11 -57.45 2.23 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.292 1.994 . . . . 0.0 112.523 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.487 ' HD2' ' CD ' ' A' ' 681' ' ' PRO . 10.0 Cg_endo -53.55 6.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.333 2.022 . . . . 0.0 111.987 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.655 ' H ' ' C ' ' A' ' 681' ' ' PRO . 56.8 t0 -76.45 148.93 36.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 684' ' ' GLN . . . . . 0.555 ' N ' ' OD1' ' A' ' 683' ' ' ASP . 10.3 pt20 -175.18 -43.85 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 34.1 t -64.09 -30.14 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.024 0.44 . . . . 0.0 110.382 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 87.6 m -58.84 -23.58 60.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.953 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.68 -37.97 89.36 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.508 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.697 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.8 OUTLIER -71.23 -39.55 71.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.941 -179.652 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.494 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 10.0 tt -60.84 -42.07 97.07 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.621 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 83.5 mt -60.48 -45.9 92.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.184 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -63.15 -40.99 99.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.199 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -60.27 -60.94 3.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.798 ' C ' HD12 ' A' ' 693' ' ' LEU . 0.4 OUTLIER -55.46 -39.87 70.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.5 ' N ' ' HG ' ' A' ' 693' ' ' LEU . 79.3 ttt180 -65.02 -33.86 77.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.026 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 695' ' ' GLU . . . . . 0.544 ' HG2' ' CD2' ' A' ' 696' ' ' HIS . 78.2 tt0 -65.64 -36.66 84.33 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.276 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.544 ' CD2' ' HG2' ' A' ' 695' ' ' GLU . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.117 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 120.743 0.226 . . . . 0.0 112.403 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.2 173.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.579 2.186 . . . . 0.0 111.784 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.706 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.3 OUTLIER -77.15 137.36 38.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.461 HG12 ' CE1' ' A' ' 707' ' ' PHE . 44.1 t -122.05 131.18 73.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.067 0.46 . . . . 0.0 111.896 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.749 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.8 mp -112.35 134.63 53.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.731 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 707' ' ' PHE . . . . . 0.461 ' CE1' HG12 ' A' ' 705' ' ' VAL . 90.2 m-85 -115.64 129.92 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.465 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.411 ' O ' ' N ' ' A' ' 679' ' ' TRP . 62.0 mt -106.11 140.49 39.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.884 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 117.32 -142.86 17.65 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -92.52 165.83 18.42 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.027 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.37 154.96 10.35 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.418 2.079 . . . . 0.0 112.022 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.425 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 17.0 Cg_endo -60.06 169.22 5.04 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 123.076 2.518 . . . . 0.0 112.129 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.561 HG12 ' O ' ' A' ' 713' ' ' VAL . 42.7 t -80.53 0.36 3.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.297 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 714' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -161.8 143.05 8.33 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.02 -10.98 25.11 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.694 2.263 . . . . 0.0 112.431 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.584 HD22 ' N ' ' A' ' 716' ' ' LEU . 3.5 mm? -69.52 -35.3 75.35 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.313 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.85 -31.43 59.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.8 m -60.98 -44.23 97.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.665 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.68 -37.12 85.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.871 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -77.37 -19.97 55.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.669 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.76 137.79 49.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.14 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.433 ' CB ' ' H ' ' A' ' 705' ' ' VAL . 67.3 m -86.26 -29.77 22.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.584 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.88 105.65 0.2 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 60.1 mt -93.13 129.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.658 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.476 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.4 mp -111.36 97.94 7.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 110.32 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 50.2 p -75.42 0.22 17.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.664 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 727' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -126.63 89.4 52.25 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.927 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.634 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 49.0 Cg_exo -51.99 154.65 9.86 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 123.016 2.477 . . . . 0.0 112.533 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.634 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 1.5 tp 98.15 -157.41 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.272 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 50.18 62.76 11.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.86 -19.43 62.02 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.445 2.097 . . . . 0.0 111.714 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.62 -36.31 65.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -70.13 -50.03 44.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.327 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 10.5 tp -58.02 -42.16 84.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.885 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 26.3 tp -62.84 -39.04 93.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.145 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.6 m -58.48 -47.62 83.47 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.412 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.9 m -65.15 -40.87 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.578 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.539 HD11 HG11 ' A' ' 674' ' ' VAL . 5.7 tt -64.09 -45.72 87.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.657 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.672 ' O ' ' N ' ' A' ' 741' ' ' LEU . 98.1 mt-30 -66.08 -27.7 68.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.103 0.478 . . . . 0.0 109.955 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 740' ' ' GLY . . . . . 0.505 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -27.75 -33.01 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.432 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.676 ' N ' HD12 ' A' ' 741' ' ' LEU . 6.3 mp . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.852 0.358 . . . . 0.0 110.163 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.639 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -95.72 134.02 39.14 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 64.7 mt -116.92 136.71 53.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 120.966 0.413 . . . . 0.0 110.461 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.927 HD22 ' CD1' ' A' ' 667' ' ' LEU . 21.1 tp -104.66 129.96 52.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.659 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 8.0 tt -127.47 121.96 32.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.183 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.869 HD12 ' O ' ' A' ' 657' ' ' LEU . 12.2 tp -110.17 121.51 45.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.429 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.541 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 85.9 tt0 -159.47 165.97 31.93 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.195 -0.602 . . . . 0.0 111.345 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.541 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 94.4 mt-10 -107.62 160.65 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.97 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 71.31 108.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 27.1 p-10 -57.19 -37.74 72.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.073 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.596 ' O ' HG23 ' A' ' 642' ' ' VAL . 85.7 tt0 -63.76 -43.15 97.26 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.857 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.6 -36.92 70.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.483 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.04 -42.64 80.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.023 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 645' ' ' GLU . 31.6 m -63.26 -45.84 89.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.801 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 638' ' ' GLU . 86.5 t -56.62 -53.55 39.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.825 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.05 -47.59 92.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.403 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.525 ' O ' ' OG1' ' A' ' 648' ' ' THR . 70.2 m -65.35 -29.91 70.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.111 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 645' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 641' ' ' THR . 73.8 tt0 -61.55 -45.81 92.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.671 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 92.0 mmm -70.27 -42.86 71.54 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.784 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.616 ' CB ' HG21 ' A' ' 654' ' ' VAL . 73.5 mt -66.73 -43.01 85.36 Favored 'General case' 0 CA--C 1.522 -0.121 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.525 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 83.5 m -55.71 -40.15 72.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.28 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.81 -21.2 61.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.531 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 650' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 647' ' ' LEU . . . -65.19 -5.1 6.03 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.809 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 102.45 -19.23 48.81 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -98.46 152.32 19.65 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.98 129.65 37.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.988 0.423 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.616 HG21 ' CB ' ' A' ' 647' ' ' LEU . 16.2 t -119.85 133.21 67.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 27.1 mm -108.95 135.87 46.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.61 ' C ' HD22 ' A' ' 657' ' ' LEU . 23.3 t90 -89.85 114.02 25.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.514 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.869 ' O ' HD12 ' A' ' 633' ' ' LEU . 4.6 mm? -112.27 136.24 51.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.047 0.451 . . . . 0.0 110.288 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.61 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 4.4 p -117.42 19.95 6.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.994 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.61 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 89.4 m-20 -150.62 174.27 13.17 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.457 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -105.14 -63.47 0.65 Allowed Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.421 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 23.0 t -57.69 -36.99 72.69 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 51.1 m -62.86 -39.34 94.1 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.552 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.59 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -63.46 -39.67 95.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.585 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 664' ' ' LEU . 61.9 mt -59.34 -39.42 83.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.003 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.78 -47.5 83.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.379 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -89.71 -42.68 11.19 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.683 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.927 ' CD1' HD22 ' A' ' 631' ' ' LEU . 8.6 tt -50.13 -36.78 31.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.041 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -56.22 -36.66 68.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.844 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 39.4 mt -77.47 -26.41 51.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.304 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 37.6 mt -73.05 -32.93 65.38 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.687 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.446 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 39.3 mm-40 46.3 58.87 16.15 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-O 121.207 0.527 . . . . 0.0 110.167 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.446 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 50.9 Cg_endo -74.06 150.07 42.48 Favored 'Trans proline' 0 C--N 1.302 -1.921 0 C-N-CA 123.459 2.773 . . . . 0.0 112.83 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.747 HG13 HG23 ' A' ' 674' ' ' VAL . 24.6 pt -100.54 -19.49 5.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.747 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.747 HG23 HG13 ' A' ' 673' ' ' ILE . 76.8 t -137.12 137.51 46.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.416 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 631' ' ' LEU . 65.9 mt -127.25 118.65 50.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 8.8 tt -105.1 130.81 53.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.838 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.449 ' HE3' HD22 ' A' ' 689' ' ' LEU . 61.4 mtt -138.53 133.1 32.18 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.481 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -71.0 150.84 45.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.695 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.783 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -116.88 -24.79 0.1 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 C-N-CA 120.274 -0.571 . . . . 0.0 112.302 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.783 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -48.61 -39.71 37.6 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 121.887 1.724 . . . . 0.0 113.14 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 15.0 Cg_exo -65.43 155.29 69.57 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.653 1.568 . . . . 0.0 111.799 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -53.55 -19.41 13.7 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.284 1.989 . . . . 0.0 112.093 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 61.55 161.2 0.07 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.507 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 179.77 -80.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.148 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 31.3 m -63.11 -32.87 74.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.573 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 5.9 p -60.94 -24.12 65.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.748 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.44 -35.3 80.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.559 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 1.0 OUTLIER -73.47 -37.77 65.65 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.308 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.559 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 8.4 tt -61.7 -46.94 87.54 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.79 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.402 HD21 ' SD ' ' A' ' 677' ' ' MET . 82.6 mt -63.04 -42.42 99.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.515 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.12 -39.59 93.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.828 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -57.9 -53.55 56.92 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.801 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.0 mt -55.82 -37.68 69.0 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.531 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.674 ' NE ' ' OE1' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.78 -40.28 94.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.52 -39.2 77.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.754 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.721 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo . . . . . 0 N--CA 1.49 1.309 0 CA-C-O 120.682 0.201 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -74.81 151.14 40.13 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.164 1.91 . . . . 0.0 112.069 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 48.0 mt -74.95 139.97 43.38 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' A' ' 722' ' ' SER . 46.1 t -123.73 129.04 74.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.918 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.552 ' C ' HD23 ' A' ' 706' ' ' LEU . 9.2 tt -116.22 133.58 55.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.935 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 707' ' ' PHE . . . . . 0.515 ' N ' HD23 ' A' ' 706' ' ' LEU . 97.2 m-85 -116.22 137.51 52.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.01 0.434 . . . . 0.0 111.614 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 708' ' ' LEU . 80.6 mt -99.77 154.76 18.06 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.037 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 84.89 -132.9 11.38 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -87.21 151.83 51.96 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 0.0 111.076 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.21 165.38 19.73 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 123.059 2.506 . . . . 0.0 112.325 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -62.51 160.47 31.75 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.868 2.378 . . . . 0.0 112.138 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.538 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.1 t -91.06 23.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.472 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 714' ' ' ASP . . . . . 0.538 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 12.7 m-20 -161.3 141.71 8.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.038 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.27 -15.62 35.22 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.801 2.334 . . . . 0.0 112.972 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.535 ' H ' HD12 ' A' ' 716' ' ' LEU . 5.9 mp -69.77 -35.28 74.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.024 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 89.1 mt -75.46 -31.53 60.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 45.4 m -64.22 -43.91 93.52 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.14 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.12 -40.11 95.49 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.088 0.47 . . . . 0.0 109.956 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.674 ' OE1' ' NE ' ' A' ' 694' ' ' ARG . 31.8 tt0 -73.62 -29.28 62.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.813 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -68.59 140.45 55.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.94 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 705' ' ' VAL . 34.5 t -87.28 -28.13 22.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.292 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.68 168.54 6.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.186 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 53.2 mt -151.17 113.01 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.624 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.6 mp -105.89 136.53 45.37 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.132 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.0 t -69.17 -81.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -103.39 128.36 27.68 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.64 142.29 52.75 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 121.997 1.798 . . . . 0.0 112.006 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 20.2 tp -176.38 138.8 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.404 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.4 OUTLIER 57.72 74.13 0.68 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.763 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.92 -5.19 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.492 2.128 . . . . 0.0 111.691 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.568 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -69.84 -30.26 67.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.219 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.7 -45.31 79.21 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 25.5 tp -57.26 -41.66 80.09 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.3 -40.37 96.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.208 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 87.9 m -59.28 -40.64 86.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.292 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 26.1 m -61.08 -41.76 97.25 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.154 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.37 -44.29 95.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.012 0.434 . . . . 0.0 110.374 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.519 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.7 mm-40 -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.568 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -59.0 4.77 0.09 OUTLIER Glycine 0 CA--C 1.529 0.914 0 C-N-CA 121.211 -0.519 . . . . 0.0 111.92 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.519 ' H ' ' C ' ' A' ' 739' ' ' GLN . 27.0 tp . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 117.0 0.4 . . . . 0.0 110.284 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.697 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -94.84 139.04 31.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.863 0.363 . . . . 0.0 111.296 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.498 ' CG2' HD13 ' A' ' 676' ' ' LEU . 89.9 mt -114.3 145.56 19.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.289 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.898 HD22 HD12 ' A' ' 667' ' ' LEU . 10.1 tp -107.69 134.5 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.765 0.317 . . . . 0.0 110.69 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' ' 633' ' ' LEU . 0.2 OUTLIER -129.13 116.9 19.93 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 632' ' ' LEU . 6.6 tt -109.41 120.38 42.32 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.505 ' N ' HD23 ' A' ' 633' ' ' LEU . 85.6 tt0 -159.41 153.96 24.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.479 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.658 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 82.6 tt0 -112.68 138.81 48.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.174 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.658 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 81.8 tt0 106.02 115.62 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.69 0.619 . . . . 0.0 110.381 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -60.65 -37.08 80.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.044 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -67.46 -50.1 60.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.301 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.37 87.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.973 0.416 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.641 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.54 -38.78 81.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.808 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 53.1 m -62.67 -44.39 96.37 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.782 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.85 -54.05 34.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.458 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.81 -41.26 87.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.452 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.772 ' SG ' ' CZ3' ' A' ' 656' ' ' TRP . 91.3 m -55.78 -43.47 76.8 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.454 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.17 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 90.1 mtp -68.08 -50.73 53.22 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.594 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 650' ' ' ALA . 74.8 mt -68.25 -43.54 77.65 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.143 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 90.5 m -56.43 -42.27 77.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.98 -28.7 69.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.372 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 650' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 647' ' ' LEU . . . -63.51 -17.03 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 86.5 2.68 84.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -95.04 149.17 21.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.052 0.453 . . . . 0.0 111.002 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -92.22 123.47 35.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.848 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.434 HG12 ' HB ' ' A' ' 630' ' ' ILE . 5.4 m -126.34 150.05 31.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.815 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 26.9 mm -108.49 125.45 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.772 ' CZ3' ' SG ' ' A' ' 644' ' ' CYS . 0.5 OUTLIER -95.24 125.71 40.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 111.383 -179.073 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 663' ' ' ALA . 86.7 mt -124.45 143.52 50.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.457 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 7.6 m -101.15 2.91 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.048 0.452 . . . . 0.0 109.989 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.406 ' OD1' ' C ' ' A' ' 659' ' ' ASP . 57.1 p30 -153.21 173.62 15.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.909 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.415 ' O ' ' HG ' ' A' ' 664' ' ' LEU . . . -102.23 -35.25 3.96 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.144 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 13.3 m -55.8 -44.29 77.68 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.863 0.363 . . . . 0.0 110.959 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 70.2 m -62.69 -36.78 84.03 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.66 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.25 -38.7 92.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.597 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 660' ' ' GLY . 18.3 mt -57.75 -47.68 81.8 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.881 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -63.83 -40.86 97.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.532 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -89.78 -54.56 4.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.947 0.403 . . . . 0.0 111.757 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.898 HD12 HD22 ' A' ' 631' ' ' LEU . 8.1 tt -45.05 -39.17 5.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.73 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -55.33 -37.28 67.21 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.535 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.17 -30.94 49.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.627 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 13.9 mt -71.91 -38.45 69.91 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.636 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 48.01 66.34 5.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -78.36 160.64 29.04 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 123.133 2.556 . . . . 0.0 113.156 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 74.7 mt -96.25 -23.03 4.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.098 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 40.6 t -143.73 140.12 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 120.872 0.368 . . . . 0.0 111.114 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.864 HG22 ' SD ' ' A' ' 677' ' ' MET . 76.0 mt -126.46 121.89 59.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.032 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 676' ' ' LEU . 2.8 mp -114.75 133.91 55.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.864 ' SD ' HG22 ' A' ' 675' ' ' ILE . 3.5 mpp? -138.87 139.17 38.02 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.54 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.24 146.16 53.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.603 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.776 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -132.1 14.25 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.776 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 6.6 Cg_exo -50.89 -44.17 43.13 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 121.423 1.415 . . . . 0.0 112.353 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 40.7 Cg_endo -86.88 164.31 8.91 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 123.098 2.532 . . . . 0.0 112.827 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -71.04 -65.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.969 2.446 . . . . 0.0 111.937 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.462 ' OD1' ' O ' ' A' ' 683' ' ' ASP . 50.2 p30 -82.5 156.91 23.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 684' ' ' GLN . . . . . 0.515 ' O ' HD12 ' A' ' 687' ' ' LEU . 49.5 tt0 -177.48 135.96 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.381 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 685' ' ' SER . . . . . 0.428 ' C ' ' N ' ' A' ' 687' ' ' LEU . 37.0 m -61.18 -27.99 68.81 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.856 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.718 ' SG ' ' CZ3' ' A' ' 679' ' ' TRP . 25.8 p -52.84 -14.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.01 0.434 . . . . 0.0 109.867 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 687' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 684' ' ' GLN . 32.3 mt -64.22 -38.92 92.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.777 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.495 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 2.3 pp -70.46 -35.59 73.4 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.495 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 22.4 tp -57.84 -42.95 85.46 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.308 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.426 HD23 HD12 ' A' ' 693' ' ' LEU . 47.1 mt -62.18 -36.46 81.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.021 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 691' ' ' GLN . . . . . 0.412 ' HG3' HH21 ' A' ' 694' ' ' ARG . 49.8 tt0 -56.79 -41.75 78.27 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.434 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 29.3 t-80 -59.96 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.292 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.426 HD12 HD23 ' A' ' 690' ' ' LEU . 40.8 mt -54.81 -40.36 69.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.718 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.412 HH21 ' HG3' ' A' ' 691' ' ' GLN . 66.2 mtm180 -63.97 -35.45 80.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -69.38 -35.94 76.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.012 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.616 ' CG ' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.236 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.216 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 120.497 0.124 . . . . 0.0 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.62 135.86 63.28 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.312 2.008 . . . . 0.0 112.45 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.711 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.5 mp -80.87 141.91 34.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.998 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.795 HG23 ' O ' ' A' ' 675' ' ' ILE . 14.6 p -130.57 136.3 58.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.336 0.588 . . . . 0.0 110.998 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.819 HD12 ' O ' ' A' ' 723' ' ' ALA . 12.4 tp -118.45 133.1 56.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.948 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -110.02 130.33 55.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.014 0.435 . . . . 0.0 111.487 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.67 147.0 25.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.414 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 99.05 -131.58 10.62 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.639 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.2 162.92 35.98 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.21 151.93 20.85 Favored 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.631 2.22 . . . . 0.0 112.616 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.404 ' CB ' ' HB2' ' A' ' 717' ' ' LEU . 58.5 Cg_exo -45.06 171.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.891 2.394 . . . . 0.0 112.868 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 713' ' ' VAL . 96.9 t -83.63 3.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 714' ' ' ASP . . . . . 0.533 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -161.68 152.77 15.3 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.029 0.443 . . . . 0.0 110.817 -179.588 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -69.63 -8.8 24.53 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.941 2.427 . . . . 0.0 112.41 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.45 -34.35 74.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.665 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 1.6 mm? -77.22 -36.04 55.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.7 m -62.56 -41.78 99.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.864 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.95 92.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.209 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -75.59 -28.9 59.1 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 721' ' ' ALA . . . . . 0.419 ' HA ' ' CG1' ' A' ' 705' ' ' VAL . . . -69.67 153.78 42.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.849 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 57.6 p -85.18 -31.61 23.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.819 ' O ' HD12 ' A' ' 706' ' ' LEU . . . -174.35 151.1 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.403 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.463 ' C ' HD12 ' A' ' 725' ' ' LEU . 65.6 mt -133.15 127.91 55.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.93 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.797 ' CD1' HD11 ' A' ' 706' ' ' LEU . 8.9 mp -105.09 158.8 16.32 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.86 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.43 9.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.518 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 727' ' ' LYS . . . . . 0.46 ' CB ' ' HZ3' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -132.85 92.58 25.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.498 179.633 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.52 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 53.2 Cg_exo -47.48 149.18 4.69 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.611 2.208 . . . . 0.0 112.415 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 59.3 mt 98.85 172.99 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.132 0.895 . . . . 0.0 110.148 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 61.77 62.81 2.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.054 179.82 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -64.36 -8.46 16.92 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.918 2.412 . . . . 0.0 112.272 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -69.4 -29.71 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.209 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 11.4 tp -66.63 -43.01 85.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.461 ' CD1' HD22 ' A' ' 706' ' ' LEU . 53.0 tp -57.97 -43.72 86.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.301 179.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.08 -38.6 86.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 75.5 m -57.66 -41.46 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.3 m -62.23 -46.46 88.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.497 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 63.1 mt -66.06 -40.12 90.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 741' ' ' LEU . 41.9 tt0 -66.21 -21.04 66.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.593 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.1 -2.73 0.01 OUTLIER Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.664 ' N ' ' O ' ' A' ' 739' ' ' GLN . 69.7 mt . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.685 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 629' ' ' HIS . . . . . 0.433 ' HB2' HD11 ' A' ' 670' ' ' LEU . 72.9 m80 -94.64 136.75 34.58 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.499 ' CD1' HD22 ' A' ' 647' ' ' LEU . 75.6 mt -117.19 135.74 56.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.874 0.369 . . . . 0.0 111.054 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.555 HD13 HD12 ' A' ' 667' ' ' LEU . 8.4 tt -109.03 128.65 55.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.784 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.711 HD23 ' C ' ' A' ' 632' ' ' LEU . 8.6 tt -127.16 127.38 44.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.952 0.406 . . . . 0.0 111.913 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.497 ' N ' HD23 ' A' ' 632' ' ' LEU . 44.6 tp -108.74 111.76 23.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.768 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.842 ' OE1' ' HB2' ' A' ' 678' ' ' ALA . 45.9 tp10 -160.28 156.9 27.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.933 0.397 . . . . 0.0 111.229 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 634' ' ' GLU . 85.4 tt0 -96.53 156.25 16.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.942 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.475 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 77.6 tt0 71.72 119.57 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.262 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 40.9 p-10 -62.99 -31.91 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.534 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.3 mt-10 -65.0 -40.83 95.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.336 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.84 62.3 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.918 0.389 . . . . 0.0 110.644 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -62.06 -35.28 78.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.946 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.41 ' O ' ' N ' ' A' ' 645' ' ' GLU . 86.6 m -62.79 -44.82 95.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.935 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 43.5 t -55.19 -53.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.448 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 58.4 t -60.77 -43.26 94.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.207 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.0 OUTLIER -67.39 -30.67 70.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.921 -179.676 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 645' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 641' ' ' THR . 41.6 tp10 -61.4 -45.49 94.11 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.163 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 93.6 mmm -65.3 -44.29 88.39 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.912 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.936 HD21 HD21 ' A' ' 734' ' ' LEU . 34.6 mt -67.71 -43.45 80.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.252 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.5 m -55.9 -42.04 75.42 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -62.83 -32.34 73.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.329 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.43 -6.34 45.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.827 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 92.46 -0.21 70.82 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.293 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -91.61 148.25 22.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 117.073 0.436 . . . . 0.0 110.829 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -91.05 130.73 36.92 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.68 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.437 HG21 ' HB2' ' A' ' 647' ' ' LEU . 24.6 t -116.86 137.06 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.257 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.42 127.13 66.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.703 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -95.49 114.51 26.28 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 111.355 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 53.1 mt -116.46 145.23 43.44 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 2.4 p -116.17 10.86 7.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.183 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -149.64 128.25 12.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.459 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.472 ' HA2' HD23 ' A' ' 689' ' ' LEU . . . -61.49 -38.09 95.22 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 m -59.2 -38.59 80.24 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.843 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 86.4 m -63.91 -40.31 96.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.859 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.7 -41.88 98.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.848 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.511 HD22 ' CE1' ' A' ' 692' ' ' HIS . 54.3 mt -59.2 -43.5 92.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -63.94 -38.75 92.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.376 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 670' ' ' LEU . 83.7 mt-30 -89.68 -49.86 6.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.083 0.468 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.1 tt -46.08 -46.2 16.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.427 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 668' ' ' ASP . . . . . 0.597 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 52.3 t0 -62.6 -41.08 98.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 72.7 mt -77.2 -36.88 54.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.361 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 1.052 HD12 ' O ' ' A' ' 670' ' ' LEU . 0.1 OUTLIER -82.25 -39.99 22.23 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.137 -179.327 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 3.4 mt-30 54.08 75.38 0.63 Allowed Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 121.262 0.553 . . . . 0.0 110.236 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.33 165.3 32.13 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 123.684 2.923 . . . . 0.0 112.463 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 75.3 mt -93.25 -26.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.163 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.426 HG13 HG23 ' A' ' 630' ' ' ILE . 10.9 p -142.68 138.62 28.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.069 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 71.9 mt -116.6 129.42 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.179 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 706' ' ' LEU . 0.0 OUTLIER -106.5 130.43 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 38.9 ttm -141.08 137.59 32.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.317 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.842 ' HB2' ' OE1' ' A' ' 634' ' ' GLU . . . -67.66 153.06 44.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.495 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.76 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 37.9 t-105 -103.53 -19.82 0.19 Allowed Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.788 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.76 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 85.9 Cg_endo -85.51 121.45 2.24 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.966 1.778 . . . . 0.0 110.937 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -74.94 111.97 3.45 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.422 2.081 . . . . 0.0 112.748 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.8 -18.49 2.96 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.833 2.355 . . . . 0.0 111.061 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.531 ' O ' ' HB2' ' A' ' 684' ' ' GLN . 22.3 t70 -160.31 -11.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.43 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 684' ' ' GLN . . . . . 0.531 ' HB2' ' O ' ' A' ' 683' ' ' ASP . 90.3 mt-30 100.89 2.03 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 O-C-N 124.092 0.87 . . . . 0.0 110.873 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 21.9 m -65.13 -37.67 88.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.77 0.319 . . . . 0.0 111.158 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 78.8 m -62.13 -34.22 75.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.95 -32.83 74.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.186 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.2 -37.13 77.95 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.237 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.623 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.2 OUTLIER -62.16 -41.55 98.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.245 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.799 HD13 ' C ' ' A' ' 690' ' ' LEU . 3.0 tm? -59.82 -40.63 89.1 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.47 -42.63 96.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.781 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.511 ' CE1' HD22 ' A' ' 664' ' ' LEU . 24.0 t-80 -57.73 -50.18 74.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.505 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.447 HD13 HG21 ' A' ' 705' ' ' VAL . 79.4 mt -54.95 -39.74 69.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.558 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -62.74 -33.55 75.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.646 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -67.5 -35.99 80.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.084 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 24.2 m80 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.212 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.489 1.222 0 CA-C-O 120.737 0.224 . . . . 0.0 111.874 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.19 151.56 43.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.816 2.344 . . . . 0.0 112.021 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.8 mp -77.51 140.13 39.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.138 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 722' ' ' SER . 44.4 t -120.29 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.113 0.482 . . . . 0.0 111.097 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.624 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 5.5 mp -118.84 134.63 55.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -110.05 130.93 55.46 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.947 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.668 HD12 ' C ' ' A' ' 708' ' ' LEU . 0.9 OUTLIER -101.05 140.48 35.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 709' ' ' GLY . . . . . 0.429 ' N ' HD12 ' A' ' 708' ' ' LEU . . . 119.12 -131.77 9.25 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 158.24 48.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.768 0.318 . . . . 0.0 110.352 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -75.14 116.31 4.52 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.786 2.324 . . . . 0.0 112.127 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.45 ' HD2' HD13 ' A' ' 724' ' ' ILE . 51.5 Cg_exo -49.88 142.59 25.8 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.048 . . . . 0.0 111.997 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 93.3 t -82.75 -20.09 9.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.811 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.4 128.22 89.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.673 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -73.14 -30.14 10.95 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.213 1.942 . . . . 0.0 111.635 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.86 -35.12 69.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.208 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.613 ' CD2' ' CZ3' ' A' ' 679' ' ' TRP . 66.1 tp -73.3 -37.7 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.55 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 718' ' ' THR . . . . . 0.493 HG23 HD11 ' A' ' 724' ' ' ILE . 33.2 m -63.48 -40.07 96.14 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.857 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.09 89.82 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.352 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -74.69 -29.62 61.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.441 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -69.13 139.59 54.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.522 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.616 ' N ' ' O ' ' A' ' 705' ' ' VAL . 80.5 p -85.25 -28.59 25.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.502 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.624 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -173.93 121.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.208 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.493 HD11 HG23 ' A' ' 718' ' ' THR . 54.3 mt -91.65 124.14 44.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.893 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.582 HD11 HD13 ' A' ' 734' ' ' LEU . 59.9 mt -103.14 124.37 48.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.726 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 5.1 m -72.93 -79.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.746 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -142.84 167.4 16.21 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.176 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -60.99 119.65 6.92 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 121.81 1.673 . . . . 0.0 111.477 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.691 ' O ' HD23 ' A' ' 729' ' ' LEU . 7.1 tt -178.65 -40.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.823 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 730' ' ' ASP . 0.0 OUTLIER -129.82 72.17 81.99 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.955 0.407 . . . . 0.0 110.909 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -71.55 7.49 1.52 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.866 2.378 . . . . 0.0 111.9 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.478 ' HG3' ' N ' ' A' ' 733' ' ' LEU . 21.5 pt20 -71.92 -36.22 69.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.455 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 733' ' ' LEU . . . . . 0.478 ' N ' ' HG3' ' A' ' 732' ' ' GLN . 14.4 tp -66.93 -42.91 84.54 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.078 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.936 HD21 HD21 ' A' ' 647' ' ' LEU . 14.2 tp -56.63 -50.14 72.91 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.42 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 85.6 mt -62.27 -37.12 84.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.147 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 66.1 m -59.0 -40.33 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.349 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 86.5 m -61.26 -47.5 85.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.622 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.529 HD12 ' N ' ' A' ' 738' ' ' LEU . 7.0 mp -66.28 -45.08 81.69 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.511 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -66.35 -28.21 68.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.276 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.25 -36.9 16.94 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 179.548 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.683 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -89.81 136.1 33.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.773 0.321 . . . . 0.0 110.525 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.4 mm -112.11 134.78 53.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.661 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.689 ' CD2' HD12 ' A' ' 667' ' ' LEU . 56.1 tp -114.11 136.01 53.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.746 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.827 HD23 ' C ' ' A' ' 632' ' ' LEU . 6.8 tt -133.96 125.1 27.51 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.038 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.742 ' N ' HD23 ' A' ' 632' ' ' LEU . 9.3 tt -118.9 127.74 53.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.751 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.796 ' CD ' ' HB2' ' A' ' 640' ' ' ALA . 0.0 OUTLIER -159.06 171.57 19.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 0.0 111.028 -179.509 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -107.33 163.2 13.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.28 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 66.75 118.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.402 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -58.21 -37.33 74.61 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.185 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -64.91 -41.82 95.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.083 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -65.45 -39.11 91.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.906 0.384 . . . . 0.0 110.448 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.796 ' HB2' ' CD ' ' A' ' 634' ' ' GLU . . . -66.7 -39.51 88.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.727 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 59.6 m -62.06 -47.05 86.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.006 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.6 t -57.38 -53.67 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 643' ' ' VAL . . . . . 0.665 HG11 HD11 ' A' ' 632' ' ' LEU . 61.1 t -60.53 -42.82 92.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.904 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.656 ' SG ' ' O ' ' A' ' 640' ' ' ALA . 74.9 m -56.89 -36.78 70.52 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -62.35 -40.07 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.293 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 16.3 mmt -65.38 -50.25 66.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.962 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.605 ' N ' HD12 ' A' ' 647' ' ' LEU . 10.0 mp -70.35 -45.55 65.88 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.434 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 48.5 m -55.87 -42.98 76.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.038 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.06 65.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.581 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.42 -11.3 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.18 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.12 -3.88 67.14 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.73 149.24 21.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.647 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -93.36 127.73 39.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.019 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.5 p -126.52 142.0 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.966 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 655' ' ' ILE . . . . . 0.424 HG22 ' CD2' ' A' ' 657' ' ' LEU . 14.9 mm -103.5 133.67 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.726 ' C ' HD22 ' A' ' 657' ' ' LEU . 16.4 t90 -91.42 112.82 24.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.979 0.418 . . . . 0.0 111.509 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.726 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.8 mm? -111.93 138.49 48.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.89 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 35.4 m -110.88 8.51 8.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.465 ' C ' HD11 ' A' ' 633' ' ' LEU . 18.6 t70 -150.48 130.82 13.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.51 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.449 ' CA ' HD23 ' A' ' 689' ' ' LEU . . . -63.63 -45.09 95.42 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.269 -0.491 . . . . 0.0 111.99 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 19.8 m -60.84 -44.71 96.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 111.117 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.9 m -64.55 -35.15 80.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.04 -43.19 99.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.465 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.906 HD22 ' ND1' ' A' ' 692' ' ' HIS . 90.8 mt -59.73 -47.26 86.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.348 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 665' ' ' ASP . . . . . 0.554 ' OD1' ' C ' ' A' ' 665' ' ' ASP . 0.5 OUTLIER -64.48 -37.55 87.92 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.97 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.544 ' N ' ' OD1' ' A' ' 665' ' ' ASP . 75.4 mt-30 -83.36 -43.77 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.702 HD23 ' C ' ' A' ' 667' ' ' LEU . 9.8 tt -48.57 -36.46 15.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.48 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -54.62 -39.83 68.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.022 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 73.6 mt -78.3 -27.65 47.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.357 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 15.7 mt -73.06 -38.82 66.33 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.594 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.437 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.4 mm-40 46.35 63.74 9.3 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 74.4 Cg_endo -83.56 152.95 13.54 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 C-N-CA 123.227 2.618 . . . . 0.0 112.61 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.77 HG23 HG23 ' A' ' 674' ' ' VAL . 19.5 tt -93.46 -18.75 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.272 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.77 HG23 HG23 ' A' ' 673' ' ' ILE . 59.7 t -145.24 137.57 20.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.01 0.434 . . . . 0.0 110.938 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.428 ' O ' HG23 ' A' ' 705' ' ' VAL . 59.3 mt -126.08 122.49 61.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.011 -179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.616 HD12 ' N ' ' A' ' 676' ' ' LEU . 4.5 mp -109.66 133.73 52.78 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 76.1 mtm -144.69 133.79 22.76 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.987 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 680' ' ' PRO . . . -66.14 154.13 40.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.786 178.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -117.05 80.45 11.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.78 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.409 ' C ' ' HD2' ' A' ' 682' ' ' PRO . 90.1 Cg_endo -94.7 114.61 0.19 Allowed 'Trans proline' 0 C--N 1.31 -1.489 0 C-N-CA 123.426 2.751 . . . . 0.0 112.142 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.55 ' N ' ' CD ' ' A' ' 682' ' ' PRO . 20.3 Cg_exo -53.79 -42.59 65.1 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.207 1.938 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.599 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 31.9 Cg_exo -52.73 -5.17 0.17 Allowed 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.02 1.813 . . . . 0.0 111.033 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.599 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 83.2 m-20 -150.44 73.67 1.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.874 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.16 8.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.629 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 685' ' ' SER . . . . . 0.539 ' H ' ' C ' ' A' ' 683' ' ' ASP . 43.8 m -59.75 -27.47 66.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.806 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.421 ' O ' HD23 ' A' ' 690' ' ' LEU . 85.6 m -57.01 -23.19 44.49 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.539 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 82.0 mt -63.76 -32.92 74.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.363 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.655 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.7 OUTLIER -69.68 -36.28 75.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.468 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.634 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.2 OUTLIER -61.63 -43.24 99.23 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.514 HD11 ' CZ ' ' A' ' 707' ' ' PHE . 3.8 mm? -60.83 -36.87 80.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.01 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -60.05 -43.55 95.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.906 ' ND1' HD22 ' A' ' 664' ' ' LEU . 15.5 t-80 -59.15 -49.75 76.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.511 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.14 -40.38 70.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.29 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.413 ' NH2' HD21 ' A' ' 717' ' ' LEU . 37.8 ttm180 -61.99 -33.8 74.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.985 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -67.08 -33.78 76.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.416 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.565 ' NE2' ' NE2' ' A' ' 692' ' ' HIS . 96.1 m-70 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.626 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo . . . . . 0 N--CA 1.489 1.245 0 N-CA-C 111.576 -0.202 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.81 146.2 23.36 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.798 2.332 . . . . 0.0 113.201 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.712 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.4 mp -81.5 143.89 31.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.659 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.662 ' C ' HD12 ' A' ' 706' ' ' LEU . 12.3 p -133.25 137.89 52.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.53 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.851 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.3 mp -119.37 135.56 54.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.25 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 707' ' ' PHE . . . . . 0.514 ' CZ ' HD11 ' A' ' 690' ' ' LEU . 95.3 m-85 -117.88 131.5 56.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.689 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 54.6 mt -99.89 142.52 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.805 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 709' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 726' ' ' SER . . . 110.71 -140.85 16.16 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -87.09 152.95 53.92 Favored Pre-proline 0 C--N 1.328 -0.326 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.523 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -74.19 153.1 45.85 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.547 2.165 . . . . 0.0 112.482 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -48.38 162.4 0.33 Allowed 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.757 2.305 . . . . 0.0 112.863 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 2.2 t -84.46 16.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.056 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.63 148.21 11.27 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.983 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.83 -10.76 23.46 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.766 2.311 . . . . 0.0 112.958 -178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.672 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 0.9 OUTLIER -70.58 -37.34 73.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.5 -179.63 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.413 HD21 ' NH2' ' A' ' 694' ' ' ARG . 48.1 mt -78.09 -38.8 43.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 86.7 m -63.8 -40.61 97.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.852 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.91 89.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.24 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -76.57 -25.36 53.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.357 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.4 146.69 48.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 19.0 t -85.38 -27.36 25.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.669 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -169.84 154.77 5.45 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.165 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 39.0 mt -148.98 120.03 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.063 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 25.4 mt -104.23 115.12 29.84 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.784 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 726' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 709' ' ' GLY . 8.8 m -70.08 -36.65 75.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.663 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -134.74 96.38 14.9 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -48.11 133.53 23.95 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.282 1.988 . . . . 0.0 111.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 16.6 tp -176.39 138.53 0.31 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.419 ' C ' ' H ' ' A' ' 732' ' ' GLN . 29.6 m-20 62.06 75.69 0.42 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.734 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.54 -9.3 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.715 2.277 . . . . 0.0 111.77 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 730' ' ' ASP . 93.1 mt-30 -69.89 -35.79 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 32.6 tp -67.3 -39.75 85.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 13.0 tp -57.32 -41.04 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.05 -38.95 93.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.752 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 71.9 m -59.2 -46.83 87.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.968 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.8 m -63.43 -41.68 98.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.583 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.423 ' C ' HD23 ' A' ' 738' ' ' LEU . 9.8 tt -63.32 -37.92 89.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.106 0.479 . . . . 0.0 110.045 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 741' ' ' LEU . 55.3 tt0 -64.84 -30.43 71.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.797 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.42 -5.06 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.16 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.674 ' N ' ' O ' ' A' ' 739' ' ' GLN . 19.1 tp . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.194 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.637 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -88.13 163.59 16.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.754 0.311 . . . . 0.0 110.538 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 65.4 mt -111.58 141.74 26.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.959 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.79 HD13 ' C ' ' A' ' 631' ' ' LEU . 2.8 tm? -110.96 123.75 50.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.309 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.778 ' N ' HD13 ' A' ' 631' ' ' LEU . 10.2 tt -123.1 126.66 47.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.993 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 41.8 tp -111.13 117.08 32.29 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.498 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 84.2 tt0 -159.7 159.91 33.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.729 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.599 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 84.7 tt0 -106.91 141.08 38.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.382 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.599 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 28.6 tp10 93.23 115.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.443 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.7 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 57.3 p30 -63.6 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.7 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 49.5 tp10 -63.81 -47.2 81.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.941 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.37 -43.51 66.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.977 0.418 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.45 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -65.14 -40.49 94.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.128 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 645' ' ' GLU . 90.3 m -61.73 -45.35 94.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.924 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 52.1 t -55.89 -52.0 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.237 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.53 -46.7 95.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.726 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 644' ' ' CYS . . . . . . . . . . . . . 72.6 m -69.36 -32.99 72.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.015 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 645' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 641' ' ' THR . 85.0 tt0 -60.23 -43.48 96.01 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.575 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 73.6 mtp -71.25 -40.73 70.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.367 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.44 ' HA ' HD23 ' A' ' 647' ' ' LEU . 83.1 mt -67.84 -45.45 74.6 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.958 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 30.0 m -56.16 -42.59 77.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.72 -31.07 69.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.492 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -75.7 -1.97 27.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.535 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 84.64 10.42 79.42 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -94.92 136.14 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.439 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -95.82 121.52 37.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.933 0.396 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 13.0 p -136.6 140.24 43.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.313 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.47 128.69 65.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.45 ' CG ' ' HB1' ' A' ' 640' ' ' ALA . 26.3 t90 -95.38 117.64 30.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.342 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 657' ' ' LEU . 69.2 mt -118.69 150.79 39.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.542 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.632 ' O ' HG22 ' A' ' 658' ' ' VAL . 14.5 p -103.91 7.36 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.267 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.8 t0 -148.09 119.98 8.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -55.78 -35.85 64.15 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 661' ' ' SER . . . . . 0.52 ' HA ' HD12 ' A' ' 664' ' ' LEU . 37.5 m -58.88 -40.42 84.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.881 0.372 . . . . 0.0 110.467 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 53.2 m -63.76 -38.66 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.872 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.581 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -62.31 -40.27 95.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.973 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.6 HD21 HD12 ' A' ' 689' ' ' LEU . 60.7 mt -59.94 -37.58 79.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.636 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -63.04 -44.59 95.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.319 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -90.38 -41.68 11.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.623 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.5 tt -47.0 -46.02 21.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.27 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -61.85 -35.19 77.54 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.488 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 45.1 mt -76.97 -44.21 32.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.237 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.41 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.9 OUTLIER -83.55 -12.83 55.67 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.629 -178.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.41 ' C ' ' O ' ' A' ' 670' ' ' LEU . 16.4 mm100 40.09 74.36 0.72 Allowed Pre-proline 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.35 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.463 ' CD ' ' HG ' ' A' ' 667' ' ' LEU . 56.2 Cg_endo -73.14 150.79 48.54 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.909 2.406 . . . . 0.0 112.448 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.82 HG13 HG23 ' A' ' 674' ' ' VAL . 27.5 pt -95.3 -12.13 8.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.461 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.82 HG23 HG13 ' A' ' 673' ' ' ILE . 88.4 t -140.13 134.77 36.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.304 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.3 mt -128.7 124.91 62.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.982 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.3 mp -103.38 143.59 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.932 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.46 ' HE1' ' SG ' ' A' ' 686' ' ' CYS . 80.3 mtp -139.12 116.25 11.03 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.002 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.72 146.19 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.003 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.778 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 20.6 t-105 -118.22 -35.67 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.74 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.778 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 26.0 Cg_exo -54.0 -42.54 65.96 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.252 1.968 . . . . 0.0 113.053 -179.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.511 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 74.1 Cg_endo -84.47 157.26 12.48 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.312 2.008 . . . . 0.0 112.07 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -48.54 -81.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.702 2.268 . . . . 0.0 111.528 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 686' ' ' CYS . 85.4 m-20 53.35 57.13 6.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.587 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -53.67 -32.0 49.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.891 0.377 . . . . 0.0 110.26 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 17.3 m -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.212 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.46 ' SG ' ' HE1' ' A' ' 677' ' ' MET . 4.5 t -57.19 -29.55 63.79 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.286 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.88 -38.16 88.06 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.751 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.756 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.4 OUTLIER -70.45 -37.89 74.4 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.468 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.6 HD12 HD21 ' A' ' 664' ' ' LEU . 9.7 tp -60.07 -41.56 92.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.831 HD13 ' C ' ' A' ' 690' ' ' LEU . 3.1 tm? -59.72 -42.73 93.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.515 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -60.29 -43.33 96.37 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.821 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -59.29 -51.65 69.03 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.085 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 74.2 mt -54.24 -43.33 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.275 0.56 . . . . 0.0 109.822 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -65.31 -30.56 71.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.106 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 695' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 696' ' ' HIS . 40.6 tp10 -65.3 -50.96 63.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.441 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.214 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.72 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo . . . . . 0 N--CA 1.491 1.367 0 CA-C-O 120.751 0.229 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -47.17 155.01 1.13 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.938 2.426 . . . . 0.0 111.861 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.433 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 34.0 mt -76.69 146.53 38.01 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.737 ' C ' HD12 ' A' ' 706' ' ' LEU . 13.7 p -123.74 135.72 62.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.22 0.533 . . . . 0.0 110.931 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.809 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.3 mp -122.16 138.14 54.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.654 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -107.3 130.08 54.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.908 0.385 . . . . 0.0 110.188 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 1.159 HD12 ' N ' ' A' ' 709' ' ' GLY . 0.1 OUTLIER -94.9 136.88 34.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.392 -179.711 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 709' ' ' GLY . . . . . 1.159 ' N ' HD12 ' A' ' 708' ' ' LEU . . . 99.62 -132.74 11.04 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -90.01 149.39 41.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.886 0.374 . . . . 0.0 110.67 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.518 ' HB3' HG21 ' A' ' 724' ' ' ILE . 57.1 Cg_endo -73.75 151.27 45.98 Favored 'Trans proline' 0 C--N 1.307 -1.626 0 C-N-CA 122.866 2.378 . . . . 0.0 112.158 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.53 157.39 41.81 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 122.675 2.25 . . . . 0.0 111.789 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 80.5 t -77.98 -38.54 24.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.795 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -72.73 136.27 80.5 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.562 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -74.76 -12.88 22.09 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 C-N-CA 122.596 2.197 . . . . 0.0 112.495 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.4 mt -70.86 -31.44 68.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 61.4 mt -76.48 -33.71 58.68 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 62.2 m -63.11 -42.48 99.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.885 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.77 91.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.354 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -78.55 -22.63 46.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.729 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.97 138.09 47.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.453 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.433 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 22.2 t -85.56 -26.79 25.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.147 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.526 ' HB3' ' HG ' ' A' ' 706' ' ' LEU . . . -169.19 152.43 5.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.518 HG21 ' HB3' ' A' ' 711' ' ' PRO . 69.3 mt -130.11 128.83 65.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.012 0.434 . . . . 0.0 110.642 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.529 ' O ' ' O ' ' A' ' 709' ' ' GLY . 58.1 mt -104.59 149.76 25.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.143 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 726' ' ' SER . . . . . 0.428 ' H ' ' H ' ' A' ' 727' ' ' LYS . 55.7 p -165.45 -2.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.81 0.338 . . . . 0.0 110.626 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 727' ' ' LYS . . . . . 0.428 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.3 OUTLIER -127.07 81.9 69.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.828 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.654 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.5 Cg_exo -49.67 147.99 12.65 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.061 2.507 . . . . 0.0 112.57 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.654 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 15.9 tp 105.5 154.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.945 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 732' ' ' GLN . 17.3 t0 63.19 62.65 1.71 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 731' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 28.6 Cg_exo -57.44 -0.06 0.3 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.869 2.379 . . . . 0.0 111.868 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 730' ' ' ASP . 12.1 mm100 -69.91 -29.77 67.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.595 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.66 -45.84 81.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.555 HD11 HD22 ' A' ' 706' ' ' LEU . 37.6 tp -58.37 -40.87 83.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.573 178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.6 -38.72 88.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.265 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 28.3 m -57.76 -40.24 79.27 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 82.9 m -60.96 -40.91 95.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.011 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.711 HD11 HG21 ' A' ' 674' ' ' VAL . 4.1 mm? -64.63 -38.38 90.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -63.49 -35.19 79.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -62.2 -11.25 31.92 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 53.3 tp . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.992 -179.896 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.58 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -90.89 148.99 22.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.076 0.465 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.6 mm -112.18 134.92 53.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.202 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.817 HD13 ' N ' ' A' ' 632' ' ' LEU . 1.0 OUTLIER -107.44 124.61 50.12 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.237 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.817 ' N ' HD13 ' A' ' 631' ' ' LEU . 9.1 tt -131.33 127.05 36.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.648 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.859 HD22 ' SG ' ' A' ' 686' ' ' CYS . 6.7 tt -109.47 116.3 31.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.127 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.499 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 82.9 tt0 -159.97 158.15 30.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.599 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.519 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 22.2 pt-20 -100.5 162.46 12.92 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.519 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.8 tp10 83.56 112.65 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.458 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.686 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 93.2 m-20 -63.9 -36.0 82.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.625 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.414 ' CG ' ' N ' ' A' ' 639' ' ' ALA . 5.3 pt-20 -67.21 -37.33 83.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.138 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.414 ' N ' ' CG ' ' A' ' 638' ' ' GLU . . . -71.29 -45.3 63.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.388 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.453 ' HB1' ' HB2' ' A' ' 656' ' ' TRP . . . -66.89 -35.68 80.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.749 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 89.5 m -62.29 -48.08 81.49 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.741 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.79 -47.43 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.147 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 643' ' ' VAL . . . . . 0.544 HG11 HD13 ' A' ' 632' ' ' LEU . 57.4 t -61.07 -42.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.581 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.705 ' SG ' HG13 ' A' ' 654' ' ' VAL . 0.8 OUTLIER -62.43 -45.64 92.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -61.78 -38.38 87.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.905 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.96 -52.34 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.796 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.408 ' N ' HD12 ' A' ' 647' ' ' LEU . 8.0 mp -68.46 -46.42 69.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.961 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.577 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.0 m -55.66 -39.86 71.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.773 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.24 -29.36 68.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.776 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -79.33 -3.18 44.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.02 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.71 -10.11 68.61 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 652' ' ' PHE . . . . . 0.592 ' CG ' HD13 ' A' ' 738' ' ' LEU . 81.9 m-85 -94.46 130.02 40.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -94.71 133.33 38.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.402 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.705 HG13 ' SG ' ' A' ' 644' ' ' CYS . 9.0 p -131.0 140.88 47.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.194 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 11.5 mm -103.01 134.02 45.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.686 ' CH2' ' OD1' ' A' ' 637' ' ' ASP . 9.5 t90 -93.21 115.11 27.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.65 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.607 HD11 HD21 ' A' ' 631' ' ' LEU . 54.3 mt -114.84 141.57 47.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.606 ' CG2' ' CZ2' ' A' ' 656' ' ' TRP . 40.2 t -98.39 -0.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.777 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.571 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 74.4 m-20 -150.76 146.91 26.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.789 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -69.32 -40.62 80.46 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.104 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 95.9 p -59.43 -37.93 79.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.718 0.294 . . . . 0.0 111.215 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.5 m -62.17 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 109.787 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.77 -43.21 97.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.005 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.58 -45.51 81.29 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.831 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 665' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 88.9 m-20 -64.08 -43.61 94.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.836 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.404 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 86.6 mt-30 -86.67 -52.6 5.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.091 0.472 . . . . 0.0 111.226 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 667' ' ' LEU . 8.6 tt -45.08 -37.83 4.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.139 -178.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 668' ' ' ASP . . . . . 0.559 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 21.4 p-10 -56.26 -40.02 73.53 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.047 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.518 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 33.7 mt -79.3 -26.94 42.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 10.6 mt -72.23 -41.95 66.27 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.422 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 51.76 67.53 4.04 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.64 159.13 25.18 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.41 2.74 . . . . 0.0 113.369 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 61.1 mt -95.1 -23.37 5.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.988 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 17.3 t -143.54 139.39 26.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.556 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.603 HG23 ' HB3' ' A' ' 631' ' ' LEU . 63.5 mt -124.1 130.89 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.982 0.42 . . . . 0.0 111.539 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.735 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -105.06 146.11 29.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.699 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.36 119.22 14.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.529 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.95 144.96 54.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.597 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.786 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.8 t-105 -118.16 -32.36 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.786 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.1 Cg_exo -49.33 -41.09 43.6 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.001 1.801 . . . . 0.0 112.769 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 11.0 Cg_exo -67.44 159.43 52.44 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.287 1.991 . . . . 0.0 111.513 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.39 -7.38 1.24 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.518 2.145 . . . . 0.0 111.349 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.642 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 13.6 t70 56.27 -129.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.458 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 684' ' ' GLN . . . . . 0.642 ' CB ' ' O ' ' A' ' 683' ' ' ASP . 3.3 tm0? 100.84 -78.31 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.372 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 60.5 p -66.88 -26.75 67.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.965 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.859 ' SG ' HD22 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -61.25 -22.04 64.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.562 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.9 mt -62.72 -34.41 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.422 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 77.1 mt -67.76 -38.03 82.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.677 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.17 -47.64 84.57 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.03 0.443 . . . . 0.0 110.215 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.472 HD12 ' H ' ' A' ' 690' ' ' LEU . 6.5 mp -62.16 -32.88 73.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.62 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -60.29 -41.53 93.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.658 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.643 ' NE2' ' ND1' ' A' ' 696' ' ' HIS . 19.1 t-160 -56.93 -49.53 75.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.45 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.472 HD21 HD12 ' A' ' 675' ' ' ILE . 97.0 mt -56.32 -41.31 75.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.691 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -63.18 -39.82 95.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.948 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -69.78 -32.26 70.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.771 -0.371 . . . . 0.0 110.81 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.643 ' ND1' ' NE2' ' A' ' 692' ' ' HIS . 55.1 m170 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.315 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo . . . . . 0 N--CA 1.488 1.165 0 CA-C-O 120.549 0.145 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.85 149.08 32.89 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.579 2.186 . . . . 0.0 112.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.617 ' H ' HD12 ' A' ' 704' ' ' LEU . 5.3 mp -78.69 145.98 34.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.963 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 58.6 t -121.61 126.39 74.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.017 0.437 . . . . 0.0 111.087 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.917 HD22 ' HB3' ' A' ' 723' ' ' ALA . 44.6 mt -117.66 140.1 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.396 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -111.92 132.16 54.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.443 HD11 HD11 ' A' ' 632' ' ' LEU . 23.9 mt -94.84 148.29 22.46 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.391 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 709' ' ' GLY . . . . . 0.445 ' O ' ' OG ' ' A' ' 726' ' ' SER . . . 69.63 -119.51 9.21 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.4 148.57 40.79 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.854 0.359 . . . . 0.0 110.851 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.804 ' HB3' HD13 ' A' ' 724' ' ' ILE . 73.9 Cg_endo -76.0 161.05 36.3 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.182 2.588 . . . . 0.0 112.937 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.7 154.21 70.61 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 123.252 2.635 . . . . 0.0 111.91 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 92.7 t -79.44 -34.77 16.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.44 127.61 92.71 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.24 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -69.63 -25.12 29.53 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.676 HD22 ' N ' ' A' ' 716' ' ' LEU . 3.7 mm? -71.49 -33.89 69.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 85.5 mt -78.13 -36.0 48.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 718' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 721' ' ' ALA . 91.9 m -64.33 -44.91 90.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.919 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.05 -36.77 82.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.366 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -77.78 -6.9 55.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.114 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 721' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 718' ' ' THR . . . -73.98 144.27 45.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.245 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.419 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 38.0 m -85.45 -33.47 21.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.443 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.917 ' HB3' HD22 ' A' ' 706' ' ' LEU . . . -171.5 131.83 0.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.804 HD13 ' HB3' ' A' ' 711' ' ' PRO . 78.0 mt -92.8 123.94 45.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.68 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.6 mt -109.52 150.91 27.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.657 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 726' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 709' ' ' GLY . 0.7 OUTLIER -168.27 -57.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -103.58 145.31 30.38 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.295 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.3 149.39 88.46 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.722 2.281 . . . . 0.0 111.707 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.512 ' O ' HD23 ' A' ' 729' ' ' LEU . 7.0 tt -177.87 85.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.696 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.619 ' C ' ' H ' ' A' ' 732' ' ' GLN . 39.0 m-20 53.49 86.71 0.16 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.307 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.17 -0.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.568 2.179 . . . . 0.0 111.753 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.619 ' H ' ' C ' ' A' ' 730' ' ' ASP . 97.1 mt-30 -68.12 -28.87 67.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.482 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.46 -44.16 91.97 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.676 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.37 -43.51 92.87 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.73 -39.58 92.05 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.688 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 736' ' ' THR . . . . . 0.459 ' O ' ' N ' ' A' ' 740' ' ' GLY . 58.4 m -60.16 -39.8 87.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.62 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 30.2 m -59.36 -46.15 89.44 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.949 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.592 HD13 ' CG ' ' A' ' 652' ' ' PHE . 87.9 mt -68.03 -50.71 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.981 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -66.94 -27.25 67.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.344 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 740' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 736' ' ' THR . . . -49.83 -29.89 14.15 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.731 ' N ' HD12 ' A' ' 741' ' ' LEU . 5.5 mp . . . . . 0 C--N 1.329 -0.292 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.456 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -90.72 136.59 32.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.407 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.82 HG23 HG13 ' A' ' 674' ' ' VAL . 74.3 mt -114.93 135.79 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 667' ' ' LEU . 8.1 tt -122.46 125.51 45.96 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.519 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.566 HD12 ' N ' ' A' ' 632' ' ' LEU . 4.5 mp -117.28 135.2 54.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.127 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.461 ' HB3' ' SG ' ' A' ' 686' ' ' CYS . 5.0 mp -107.96 111.41 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.65 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.488 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 87.2 tt0 -160.05 157.08 28.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.646 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.644 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 94.1 mt-10 -111.07 150.63 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.105 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.644 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 72.8 tt0 103.76 102.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.666 0.604 . . . . 0.0 109.705 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.512 ' O ' ' OG1' ' A' ' 641' ' ' THR . 54.4 t0 -56.19 -36.08 67.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.637 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.706 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.65 -45.49 52.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.937 0.398 . . . . 0.0 110.449 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.514 ' HB2' ' NE1' ' A' ' 656' ' ' TRP . . . -65.2 -38.79 91.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.913 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.2 m -62.37 -46.48 88.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.844 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 42.1 t -56.24 -53.51 38.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.777 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 643' ' ' VAL . . . . . 0.406 HG11 ' HH2' ' A' ' 656' ' ' TRP . 76.2 t -59.22 -42.78 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.724 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.502 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.3 m -58.17 -40.86 82.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.16 -38.39 88.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.192 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 12.2 mmm -68.03 -49.14 63.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.279 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.523 HD13 HG11 ' A' ' 654' ' ' VAL . 39.4 mt -68.73 -43.08 76.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.973 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.502 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 65.6 m -56.05 -41.32 74.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.787 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.21 70.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.24 -5.39 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.781 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.73 5.98 83.45 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -95.47 135.41 37.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.879 0.371 . . . . 0.0 110.867 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 653' ' ' LYS . . . . . 0.45 ' HZ2' HD11 ' A' ' 655' ' ' ILE . 20.2 tttm -93.78 122.66 36.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.64 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.786 HG12 ' HB ' ' A' ' 630' ' ' ILE . 6.2 m -128.31 150.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 111.276 -179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 655' ' ' ILE . . . . . 0.56 HG21 ' NE2' ' A' ' 666' ' ' GLN . 27.4 mm -114.16 129.87 69.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.005 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.791 ' C ' HD22 ' A' ' 657' ' ' LEU . 1.4 t-105 -96.77 133.86 40.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.88 0.371 . . . . 0.0 111.475 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.791 HD22 ' C ' ' A' ' 656' ' ' TRP . 4.3 mm? -120.12 140.94 50.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.589 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 19.3 m -107.53 6.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.957 0.408 . . . . 0.0 109.975 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.486 ' C ' ' OD1' ' A' ' 659' ' ' ASP . 48.6 p30 -153.36 -168.76 3.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.337 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -113.12 -37.24 1.38 Allowed Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 24.4 m -58.84 -45.77 89.29 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 662' ' ' THR . . . . . 0.499 HG22 ' OE1' ' A' ' 666' ' ' GLN . 53.7 m -65.01 -36.71 85.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.228 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.13 -45.9 91.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.797 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' A' ' 689' ' ' LEU . 94.4 mt -57.88 -45.08 86.9 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.323 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -63.1 -41.16 99.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.004 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.67 ' OE1' HD11 ' A' ' 657' ' ' LEU . 19.8 pt20 -94.46 -45.75 7.3 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.561 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.9 tt -48.15 -41.54 27.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.833 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -61.58 -35.27 77.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.701 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 90.1 mt -76.5 -44.2 36.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.194 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' A' ' 667' ' ' LEU . 1.4 pp -81.54 -15.69 54.07 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.866 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 670' ' ' LEU . 3.3 mm100 37.97 77.99 0.38 Allowed Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.385 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -69.35 156.98 62.87 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.555 2.17 . . . . 0.0 112.465 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 10.0 mm -93.16 -24.95 5.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.323 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.82 HG13 HG23 ' A' ' 630' ' ' ILE . 13.2 p -143.57 142.11 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.371 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.2 mt -127.82 127.27 68.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.101 0.477 . . . . 0.0 111.755 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.36 131.47 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.416 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 65.7 ttp -139.92 127.61 21.79 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.3 152.22 44.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.864 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.407 ' CZ3' ' CD2' ' A' ' 687' ' ' LEU . 32.2 t-105 -124.93 72.09 62.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -87.51 144.37 6.65 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.118 2.545 . . . . 0.0 112.11 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.73 ' O ' ' N ' ' A' ' 683' ' ' ASP . 5.8 Cg_exo -51.25 -50.39 14.09 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.651 2.234 . . . . 0.0 113.26 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 52.8 Cg_exo -38.35 -11.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 122.538 2.159 . . . . 0.0 112.064 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.73 ' N ' ' O ' ' A' ' 681' ' ' PRO . 13.2 t0 73.72 78.15 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 684' ' ' GLN . . . . . 0.531 ' O ' HD12 ' A' ' 687' ' ' LEU . 8.9 tt0 -60.35 138.8 57.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.465 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 685' ' ' SER . . . . . 0.442 ' C ' ' N ' ' A' ' 687' ' ' LEU . 38.1 m -62.27 -29.34 70.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.623 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.522 ' HB2' ' NE2' ' A' ' 684' ' ' GLN . 83.7 m -53.59 -14.05 0.77 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 687' ' ' LEU . . . . . 0.588 ' CD1' ' OD1' ' A' ' 683' ' ' ASP . 47.2 mt -62.65 -32.38 73.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.146 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 56.5 mt -64.26 -39.73 94.53 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.88 HD13 ' C ' ' A' ' 689' ' ' LEU . 2.4 tm? -60.22 -44.11 95.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.182 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 19.5 tp -59.22 -39.57 83.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.749 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -60.2 -39.21 85.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.91 0.386 . . . . 0.0 110.064 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -57.51 -50.0 74.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.963 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.92 -35.41 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.576 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.512 HH22 ' HA ' ' A' ' 717' ' ' LEU . 24.4 mmt180 -62.04 -36.76 82.59 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.107 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -68.74 -33.86 74.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.467 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 70.9 m80 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.166 -179.754 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo . . . . . 0 N--CA 1.49 1.274 0 CA-C-O 120.694 0.206 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -63.05 161.16 30.9 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.703 2.269 . . . . 0.0 111.722 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.3 tp -76.63 124.9 28.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.975 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.499 ' C ' HD12 ' A' ' 706' ' ' LEU . 61.0 t -122.56 132.26 71.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 121.157 0.503 . . . . 0.0 111.874 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.641 ' N ' HD12 ' A' ' 706' ' ' LEU . 5.2 mp -125.01 145.68 49.78 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.438 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -106.25 123.37 47.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.979 0.418 . . . . 0.0 110.585 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.2 mt -96.76 150.83 20.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.575 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -123.7 6.46 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.04 156.1 46.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -71.05 156.4 59.98 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 123.099 2.533 . . . . 0.0 112.286 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.521 ' HD2' HD13 ' A' ' 724' ' ' ILE . 36.8 Cg_endo -68.29 -153.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.898 2.399 . . . . 0.0 111.771 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 1.5 t -145.12 -52.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.498 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.09 145.07 90.83 Favored Pre-proline 0 C--N 1.327 -0.374 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.191 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.53 -17.62 33.96 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.592 2.195 . . . . 0.0 112.437 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 60.7 tp -70.27 -34.98 73.45 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.613 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.512 ' HA ' HH22 ' A' ' 694' ' ' ARG . 71.0 mt -76.38 -37.91 56.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.484 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 39.7 m -65.66 -43.0 90.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.261 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.62 -41.12 93.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.465 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.503 ' CD ' ' CZ ' ' A' ' 694' ' ' ARG . 42.7 tt0 -78.37 -22.97 47.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.72 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -72.92 139.47 46.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.56 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.468 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -86.89 -30.27 21.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.63 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.49 124.25 0.69 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.767 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.521 HD13 ' HD2' ' A' ' 712' ' ' PRO . 62.6 mt -91.41 125.56 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.82 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.669 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.9 mp -107.2 147.91 29.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.535 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.1 m -166.89 -3.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.431 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 9.4 tptm -133.24 79.63 61.05 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.328 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.07 141.0 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.794 2.33 . . . . 0.0 112.087 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.3 OUTLIER -179.09 116.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.492 ' O ' ' O ' ' A' ' 729' ' ' LEU . 57.3 t0 56.42 121.2 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.721 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.2 -11.85 30.99 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.327 2.018 . . . . 0.0 112.205 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -71.42 -27.45 63.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.443 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 46.8 tp -66.13 -49.75 66.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.364 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.475 ' H ' HD12 ' A' ' 734' ' ' LEU . 4.7 mp -58.84 -42.9 90.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.955 0.407 . . . . 0.0 110.079 179.134 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.319 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 56.1 m -60.53 -39.66 88.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.637 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 737' ' ' THR . . . . . 0.532 HG21 HD21 ' A' ' 706' ' ' LEU . 48.9 m -61.5 -44.18 97.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.7 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.489 ' CD2' HG21 ' A' ' 674' ' ' VAL . 39.8 mt -65.59 -37.35 86.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.122 0.486 . . . . 0.0 109.944 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.669 ' O ' ' N ' ' A' ' 741' ' ' LEU . 47.2 tt0 -64.55 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.4 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.96 -6.52 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.478 -0.649 . . . . 0.0 111.478 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.669 ' N ' ' O ' ' A' ' 739' ' ' GLN . 66.1 mt . . . . . 0 C--N 1.329 -0.313 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.543 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.607 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -90.52 128.92 36.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.436 HG23 ' O ' ' A' ' 674' ' ' VAL . 38.7 mt -118.35 142.9 30.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.753 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 1.023 HD21 ' HB1' ' A' ' 663' ' ' ALA . 23.6 tp -106.89 133.06 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.572 ' CD1' HG11 ' A' ' 643' ' ' VAL . 9.3 tt -130.41 120.22 23.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 657' ' ' LEU . 14.3 tp -107.28 119.25 38.87 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.64 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 87.7 tt0 -159.72 158.33 31.12 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.274 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.653 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.8 tt0 -109.02 133.43 53.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.776 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.653 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 75.3 tt0 105.47 113.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.653 0.596 . . . . 0.0 109.677 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.678 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.8 p30 -61.94 -33.49 74.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.38 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.678 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.6 mt-10 -65.77 -41.54 91.94 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.792 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.547 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -76.24 -46.04 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.168 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.4 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -62.39 -41.19 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.539 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 87.1 m -63.87 -43.27 96.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.306 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 638' ' ' GLU . 41.4 t -54.5 -52.76 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.154 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 643' ' ' VAL . . . . . 0.572 HG11 ' CD1' ' A' ' 632' ' ' LEU . 87.6 t -58.15 -41.82 81.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.523 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.459 ' HA ' HG11 ' A' ' 654' ' ' VAL . 73.0 m -59.91 -39.09 84.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.6 -36.92 84.29 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.098 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 67.9 mmm -68.69 -48.88 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.477 ' N ' HD12 ' A' ' 647' ' ' LEU . 9.5 mp -69.08 -43.31 74.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 32.1 m -55.58 -41.42 73.32 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.34 -29.68 69.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.28 -5.23 30.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -8.23 70.39 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -97.41 138.34 35.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 15.9 ttmm -92.1 133.11 36.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.947 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.459 HG11 ' HA ' ' A' ' 644' ' ' CYS . 7.1 p -125.6 141.38 45.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.964 0.411 . . . . 0.0 111.195 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 655' ' ' ILE . . . . . 0.489 HG22 ' CD2' ' A' ' 657' ' ' LEU . 59.6 mt -107.35 129.76 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.921 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.64 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 19.9 t90 -93.85 118.96 32.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.82 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.605 ' O ' HD12 ' A' ' 633' ' ' LEU . 2.7 mm? -109.12 143.22 38.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.665 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.69 ' O ' HG12 ' A' ' 658' ' ' VAL . 88.5 t -103.95 4.45 10.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.591 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 97.3 m-20 -145.77 121.27 10.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.06 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.427 ' CA ' HD12 ' A' ' 689' ' ' LEU . . . -57.06 -43.17 93.31 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.271 -0.731 . . . . 0.0 111.271 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 88.5 p -61.34 -40.25 93.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.718 0.294 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 34.0 m -64.1 -38.28 90.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.122 0.487 . . . . 0.0 110.184 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 1.023 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -63.75 -44.6 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.458 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.08 -44.72 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.9 0.381 . . . . 0.0 111.161 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -59.24 -41.04 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.568 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.571 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 97.9 mt-30 -86.73 -23.99 25.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.028 0.442 . . . . 0.0 109.99 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.566 ' N ' ' O ' ' A' ' 663' ' ' ALA . 2.8 tp -50.44 -45.67 56.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.32 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -62.59 -30.33 71.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.866 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 29.1 mt -73.88 -47.2 39.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.925 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.571 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.82 -17.75 42.88 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.488 -179.467 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 670' ' ' LEU . 12.9 mm-40 41.35 64.16 5.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.931 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -72.38 155.52 55.51 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 123.106 2.537 . . . . 0.0 112.79 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 95.9 mt -93.88 -22.18 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.194 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 630' ' ' ILE . 22.0 t -138.41 136.44 44.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.475 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.69 HG22 ' SD ' ' A' ' 677' ' ' MET . 75.6 mt -120.98 123.31 69.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.579 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.585 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.5 mp -106.9 128.52 54.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.449 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.69 ' SD ' HG22 ' A' ' 675' ' ' ILE . 1.7 mpp? -141.02 141.17 34.36 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.259 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.717 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -65.2 153.91 39.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.749 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.755 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 57.9 t-105 -99.56 -25.59 0.23 Allowed Pre-proline 0 C--N 1.328 -0.341 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.872 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 2.8 Cg_exo -70.29 149.18 63.11 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 121.893 1.729 . . . . 0.0 110.316 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.77 110.66 2.95 Favored 'Trans proline' 0 C--N 1.301 -1.938 0 C-N-CA 122.447 2.098 . . . . 0.0 112.444 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.583 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 62.0 Cg_endo -91.76 -33.14 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.899 2.4 . . . . 0.0 111.487 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.583 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 81.7 m-20 -157.01 -81.05 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 179.72 -25.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.768 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 22.7 t -64.18 -33.74 76.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -59.99 -33.81 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.79 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 687' ' ' LEU . . . . . 0.465 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 80.9 mt -66.76 -39.22 87.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.897 0.379 . . . . 0.0 110.554 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.777 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.96 -34.64 73.67 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.489 HD23 ' C ' ' A' ' 689' ' ' LEU . 9.7 tt -58.83 -41.66 87.4 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 49.9 tp -59.68 -43.06 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.092 179.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.02 -42.96 99.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.796 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -57.91 -48.05 81.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.384 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 91.8 mt -55.53 -37.77 68.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.969 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -63.19 -40.52 97.75 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.778 -0.369 . . . . 0.0 110.909 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.72 -33.61 74.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.68 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.713 179.898 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo . . . . . 0 N--CA 1.489 1.212 0 CA-C-O 120.537 0.141 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.07 150.39 42.93 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.457 2.105 . . . . 0.0 111.919 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 737' ' ' THR . 52.5 mt -78.15 138.72 38.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 29.4 t -115.99 129.33 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.095 0.474 . . . . 0.0 111.323 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.46 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.5 mp -117.07 136.63 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.659 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 707' ' ' PHE . . . . . 0.4 ' CE1' ' HE2' ' A' ' 677' ' ' MET . 94.8 m-85 -110.86 137.08 48.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.125 0.488 . . . . 0.0 111.77 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 56.6 mt -96.63 156.4 16.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.452 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -140.03 17.9 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.72 150.07 47.46 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.965 0.412 . . . . 0.0 110.983 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.76 146.08 33.26 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.966 2.444 . . . . 0.0 112.582 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -50.85 154.26 7.26 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.216 1.944 . . . . 0.0 111.178 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 54.2 t -77.7 -42.89 29.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.488 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -72.96 137.76 79.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.21 -13.48 18.94 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.391 2.061 . . . . 0.0 112.322 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.94 -36.53 75.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.802 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 80.1 mt -75.48 -34.23 60.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 91.6 m -63.79 -43.46 96.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.082 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.24 -37.35 86.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.603 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -73.26 -27.28 61.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.184 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.16 149.29 46.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.396 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 8.1 t -85.65 -31.15 22.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.235 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -172.28 160.52 5.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.476 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.4 HD13 HG21 ' A' ' 724' ' ' ILE . 54.3 mt -147.1 120.99 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.707 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.5 mt -112.94 129.52 56.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.804 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 14.8 m -68.12 -40.48 82.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.058 0.456 . . . . 0.0 109.947 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.81 145.23 27.08 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.011 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 129.57 30.16 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.243 1.962 . . . . 0.0 111.651 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.458 ' HG ' ' N ' ' A' ' 730' ' ' ASP . 34.8 tp -179.5 149.8 0.4 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.458 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 2.4 m-20 57.66 68.02 2.12 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.761 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.31 -15.7 8.73 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.923 2.415 . . . . 0.0 112.052 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -69.86 -33.35 72.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.257 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 25.4 tp -67.05 -42.36 84.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.965 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.447 ' CD1' HD22 ' A' ' 706' ' ' LEU . 43.1 tp -56.45 -43.97 80.03 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.037 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.46 -39.64 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.22 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.8 m -59.05 -40.41 85.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 737' ' ' THR . . . . . 0.494 ' O ' ' CD1' ' A' ' 704' ' ' LEU . 73.4 m -63.35 -39.92 95.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.126 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.684 ' C ' HD23 ' A' ' 738' ' ' LEU . 7.3 tt -63.97 -47.78 79.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.357 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.578 ' C ' ' H ' ' A' ' 741' ' ' LEU . 2.8 pt20 -69.14 -22.34 63.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.91 0.15 0.06 OUTLIER Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 1.074 ' O ' HD12 ' A' ' 741' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 120.844 0.354 . . . . 0.0 110.486 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -90.25 133.21 35.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.971 0.415 . . . . 0.0 111.029 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 63.8 mt -118.29 141.96 35.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.914 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.574 HD21 ' HB1' ' A' ' 663' ' ' ALA . 1.2 tp -106.06 129.09 54.23 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.44 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.433 HD23 ' C ' ' A' ' 632' ' ' LEU . 9.6 tt -134.33 120.58 20.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.751 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.55 HD23 ' C ' ' A' ' 633' ' ' LEU . 8.3 tt -108.43 120.09 41.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.913 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.524 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 81.7 tt0 -159.78 161.21 34.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.535 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.601 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 93.9 mt-10 -113.55 155.73 24.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.19 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.601 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.4 tp10 91.65 113.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.889 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -58.15 -38.23 76.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.145 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.733 ' O ' HG23 ' A' ' 642' ' ' VAL . 76.3 mm-40 -66.88 -41.44 87.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.118 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 636' ' ' GLU . . . -76.23 -45.15 34.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.811 0.339 . . . . 0.0 110.948 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.9 -46.2 82.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.05 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 58.4 m -63.63 -44.46 93.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 638' ' ' GLU . 41.1 t -55.86 -52.88 44.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.802 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 643' ' ' VAL . . . . . 0.418 HG11 HD11 ' A' ' 632' ' ' LEU . 70.7 t -60.29 -44.42 95.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 645' ' ' GLU . 0.5 OUTLIER -62.55 -37.32 85.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.745 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 645' ' ' GLU . . . . . 0.486 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 84.2 tt0 -62.37 -39.46 93.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.688 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 43.0 tpp -67.92 -50.31 56.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.722 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 647' ' ' LEU . 7.9 mp -68.57 -44.74 73.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.551 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 62.5 m -56.26 -43.46 78.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.021 0.438 . . . . 0.0 109.975 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.36 -23.74 63.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.54 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.25 -3.07 21.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.53 -9.81 69.04 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -95.31 138.55 32.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 110.604 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.27 129.74 38.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.134 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 9.5 p -129.12 138.7 53.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 3.1 mp -106.37 131.36 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.921 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.67 ' C ' HD22 ' A' ' 657' ' ' LEU . 16.0 t90 -90.56 122.22 33.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.11 -178.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.67 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.5 mm? -111.06 140.31 45.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.712 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.57 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 1.5 t -109.35 5.71 9.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.319 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.57 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 62.9 m-20 -147.34 137.72 23.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.357 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.447 ' O ' HD23 ' A' ' 689' ' ' LEU . . . -65.17 -46.7 86.92 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 -179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 21.4 m -60.05 -38.37 82.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 110.956 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 46.4 m -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.502 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.574 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.017 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.585 HD21 HD21 ' A' ' 689' ' ' LEU . 39.1 mt -59.05 -40.33 84.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.901 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 665' ' ' ASP . . . . . 0.582 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 86.3 m-20 -62.37 -42.33 99.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.161 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.569 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 88.4 mt-30 -87.84 -36.23 17.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.931 0.396 . . . . 0.0 110.92 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.494 HD11 HD11 ' A' ' 675' ' ' ILE . 0.8 OUTLIER -48.54 -44.44 36.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.995 -179.614 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 668' ' ' ASP . . . . . 0.582 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 50.7 p-10 -63.71 -32.02 73.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.383 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.546 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 81.4 mt -72.39 -46.71 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.91 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.569 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.87 -15.76 50.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.798 -179.121 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 670' ' ' LEU . 5.0 mm100 40.72 61.1 7.21 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.1 0.476 . . . . 0.0 110.111 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.06 151.76 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.352 2.701 . . . . 0.0 112.447 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.586 HG13 HG23 ' A' ' 674' ' ' VAL . 7.0 pt -95.94 -11.54 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.586 HG23 HG13 ' A' ' 673' ' ' ILE . 63.6 t -138.68 135.2 43.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.458 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.494 HD11 HD11 ' A' ' 667' ' ' LEU . 67.0 mt -127.85 124.16 62.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.809 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.5 mp -102.74 138.03 40.18 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 74.1 mtp -139.27 134.38 32.56 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.086 -0.646 . . . . 0.0 111.623 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.52 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -67.71 150.84 48.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.594 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.75 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 25.2 t-105 -115.03 -21.03 0.11 Allowed Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 66.2 Cg_exo -47.74 158.67 0.7 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.859 1.706 . . . . 0.0 112.104 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.641 ' C ' ' H ' ' A' ' 683' ' ' ASP . 2.5 Cg_endo -50.2 -54.85 4.77 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.894 2.396 . . . . 0.0 113.402 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 2.1 Cg_endo -49.17 0.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.059 1.839 . . . . 0.0 111.945 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.641 ' H ' ' C ' ' A' ' 681' ' ' PRO . 84.8 m-20 -82.48 45.5 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.822 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -58.65 -38.45 78.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.103 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 685' ' ' SER . . . . . 0.4 ' O ' ' HG ' ' A' ' 688' ' ' LEU . 59.8 p -67.35 -30.09 69.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.104 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.06 -25.13 67.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.149 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 77.2 mt -66.19 -39.66 89.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.752 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.697 ' C ' HD12 ' A' ' 688' ' ' LEU . 1.2 pp -72.75 -43.26 63.13 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.717 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.792 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.5 OUTLIER -61.49 -41.23 96.96 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 690' ' ' LEU . 8.9 tt -59.61 -42.16 92.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.601 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.51 -40.54 94.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.227 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.664 ' NE2' ' NE2' ' A' ' 696' ' ' HIS . 5.8 t60 -57.83 -47.51 82.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.263 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 693' ' ' LEU . 44.8 mt -54.68 -39.81 68.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -63.34 -34.13 77.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.142 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.2 -31.46 71.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.664 ' NE2' ' NE2' ' A' ' 692' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.157 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo . . . . . 0 N--CA 1.491 1.328 0 CA-C-O 120.747 0.228 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.73 152.62 34.01 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.664 2.243 . . . . 0.0 112.197 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.423 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 29.2 mt -76.87 139.09 40.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.286 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 722' ' ' SER . 16.9 t -122.94 130.98 74.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.12 0.486 . . . . 0.0 111.554 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.6 mp -119.23 138.96 52.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.996 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 707' ' ' PHE . . . . . 0.544 ' CE2' HD21 ' A' ' 717' ' ' LEU . 35.8 m-85 -108.93 126.8 53.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.918 0.39 . . . . 0.0 110.89 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.9 mt -97.46 145.91 25.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.308 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 97.77 -127.64 9.29 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.825 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 710' ' ' GLU . . . . . 0.52 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.1 OUTLIER -87.15 153.99 54.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.993 0.425 . . . . 0.0 111.245 -178.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.02 161.99 24.18 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.916 2.411 . . . . 0.0 112.425 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.673 ' HB3' HD23 ' A' ' 717' ' ' LEU . 26.5 Cg_endo -62.85 151.03 86.38 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 123.39 2.727 . . . . 0.0 112.683 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.544 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.7 t -86.91 16.15 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.381 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 714' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.5 OUTLIER -161.81 143.24 8.41 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.0 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.41 -20.43 31.8 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.643 2.228 . . . . 0.0 111.881 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 716' ' ' LEU . 84.8 mt -70.06 -34.08 72.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.673 HD23 ' HB3' ' A' ' 712' ' ' PRO . 59.6 tp -75.5 -35.18 60.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.692 179.468 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 718' ' ' THR . . . . . 0.409 ' OG1' ' HG2' ' A' ' 712' ' ' PRO . 57.3 m -62.6 -41.55 99.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.9 92.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.094 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -75.11 -28.54 60.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.14 144.58 51.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.598 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.612 ' N ' ' O ' ' A' ' 705' ' ' VAL . 32.7 t -86.16 -27.28 24.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.443 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 122.88 0.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.837 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 28.8 mm -89.55 122.83 41.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.53 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 5.0 mp -109.05 146.21 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.971 0.415 . . . . 0.0 110.796 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.6 p -167.93 -22.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.954 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.67 81.03 64.95 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.665 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -46.22 122.53 5.56 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.751 2.301 . . . . 0.0 112.453 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 24.2 tp 179.2 141.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.57 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 60.94 68.75 1.2 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.915 0.388 . . . . 0.0 110.718 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -51.91 -1.32 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.955 2.436 . . . . 0.0 112.027 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 730' ' ' ASP . 1.4 pt20 -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.866 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.91 -45.84 84.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.085 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.0 tp -57.98 -48.0 81.3 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.42 -41.86 93.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 64.6 m -59.83 -40.51 88.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.621 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 41.7 m -61.08 -45.77 93.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.9 -41.73 86.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.091 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.43 ' C ' ' H ' ' A' ' 741' ' ' LEU . 72.4 tp60 -64.53 -35.92 82.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.317 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.76 -11.35 1.98 Allowed Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 739' ' ' GLN . 24.3 tp . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 120.88 0.372 . . . . 0.0 110.32 179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.658 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -92.94 134.31 35.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.707 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.665 ' HB ' HG12 ' A' ' 654' ' ' VAL . 2.4 mp -115.42 139.8 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.297 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 1.015 ' C ' HD13 ' A' ' 632' ' ' LEU . 8.4 tt -112.51 129.59 56.29 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.621 -0.431 . . . . 0.0 110.596 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 1.03 HD22 ' H ' ' A' ' 632' ' ' LEU . 0.0 OUTLIER -130.99 122.29 26.58 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.732 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.768 HD22 ' SG ' ' A' ' 686' ' ' CYS . 7.0 tt -108.32 125.28 51.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.963 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.698 ' OE2' HD12 ' A' ' 708' ' ' LEU . 94.0 mt-10 -158.4 170.24 22.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.069 0.461 . . . . 0.0 110.909 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.561 ' OE2' ' O ' ' A' ' 682' ' ' PRO . 95.8 mt-10 -114.76 162.11 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.987 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 69.59 123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.34 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.489 ' O ' ' OG1' ' A' ' 641' ' ' THR . 90.9 m-20 -58.83 -34.4 71.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.185 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.484 ' O ' HG23 ' A' ' 642' ' ' VAL . 44.1 tp10 -63.64 -42.05 98.17 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.064 -179.199 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.46 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.812 0.339 . . . . 0.0 110.888 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.434 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -65.87 -39.68 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.049 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 54.3 m -62.84 -45.07 94.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.064 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 638' ' ' GLU . 52.8 t -56.7 -52.56 52.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.896 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 57.4 t -60.22 -46.28 94.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.541 ' O ' ' OG1' ' A' ' 648' ' ' THR . 96.1 m -66.99 -36.8 82.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -61.67 -38.28 87.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.477 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.3 mtt -68.36 -50.61 51.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.29 -43.63 77.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.625 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.541 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 41.1 m -56.17 -41.55 75.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.34 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.1 73.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.74 -1.81 17.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.542 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 82.4 10.63 83.26 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -91.43 140.39 29.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -93.52 120.32 33.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.665 HG12 ' HB ' ' A' ' 630' ' ' ILE . 5.7 m -129.0 150.42 34.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.941 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 655' ' ' ILE . . . . . 0.674 ' O ' HD22 ' A' ' 632' ' ' LEU . 24.1 mm -111.8 127.12 69.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.888 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.618 ' C ' HD22 ' A' ' 657' ' ' LEU . 32.6 t90 -93.76 118.54 31.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.997 0.427 . . . . 0.0 111.285 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 656' ' ' TRP . 4.0 mm? -115.59 144.51 43.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.456 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.542 ' O ' HG22 ' A' ' 658' ' ' VAL . 9.7 p -113.8 12.08 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -147.49 123.6 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.414 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -61.11 -43.89 98.85 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 17.6 t -59.69 -48.68 80.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 110.931 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.9 m -64.27 -38.02 89.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 663' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.38 98.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.946 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 87.1 mt -58.57 -43.4 89.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.712 0.292 . . . . 0.0 111.09 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.8 -40.89 96.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.056 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -86.29 -41.99 14.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.928 HD12 HD13 ' A' ' 631' ' ' LEU . 9.3 tt -47.68 -38.14 14.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -56.54 -37.09 70.02 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 60.8 mt -77.71 -30.31 51.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.605 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.985 HD12 HD12 ' A' ' 631' ' ' LEU . 16.2 mt -72.04 -36.16 69.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.558 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.464 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 15.6 mm100 46.68 62.4 11.66 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -178.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 66.3 Cg_endo -81.67 156.03 18.42 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 123.37 2.713 . . . . 0.0 112.957 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.616 ' CG2' HD12 ' A' ' 741' ' ' LEU . 81.0 mt -96.54 -23.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.681 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 48.7 t -138.65 139.11 41.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.903 0.383 . . . . 0.0 110.75 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.549 ' C ' HD12 ' A' ' 676' ' ' LEU . 72.0 mt -128.6 123.44 59.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.588 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 676' ' ' LEU . 7.9 mp -105.67 131.98 52.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.2 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.535 ' SD ' HD22 ' A' ' 689' ' ' LEU . 69.2 mtm -138.06 138.68 39.02 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.527 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.538 ' C ' ' OD2' ' A' ' 683' ' ' ASP . . . -65.91 151.1 47.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.64 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.736 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 74.5 t-105 -113.43 -21.99 0.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.265 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 92.1 Cg_exo -44.48 159.93 0.11 Allowed 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.698 1.599 . . . . 0.0 111.388 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.585 ' C ' ' H ' ' A' ' 683' ' ' ASP . 13.9 Cg_exo -52.24 -45.61 38.17 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.099 1.866 . . . . 0.0 112.677 -178.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.561 ' O ' ' OE2' ' A' ' 635' ' ' GLU . 31.3 Cg_exo -49.3 -8.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 121.734 1.622 . . . . 0.0 110.626 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.585 ' H ' ' C ' ' A' ' 681' ' ' PRO . 74.7 m-20 -83.42 24.67 0.81 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.831 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.35 -40.84 65.24 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.359 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 93.0 p -69.14 -35.41 76.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.458 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.768 ' SG ' HD22 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -62.35 -19.11 63.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.008 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.14 -32.99 74.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.772 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.701 ' C ' HD12 ' A' ' 688' ' ' LEU . 1.6 pp -70.09 -44.1 69.73 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.725 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.584 ' N ' HD12 ' A' ' 688' ' ' LEU . 8.0 tt -60.68 -41.4 95.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 61.1 tp -60.39 -36.1 77.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.156 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -59.98 -45.03 94.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.834 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -57.66 -50.6 72.63 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.448 -0.501 . . . . 0.0 109.949 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.8 mt -56.17 -34.92 66.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.379 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -60.57 -40.79 92.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.5 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.28 -31.86 70.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.985 0.421 . . . . 0.0 110.172 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.519 179.782 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_exo . . . . . 0 N--CA 1.49 1.275 0 CA-C-O 121.023 0.343 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.92 158.77 36.72 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 123.069 2.512 . . . . 0.0 112.466 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.503 ' H ' HD12 ' A' ' 704' ' ' LEU . 3.6 mp -77.12 149.67 35.66 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.493 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 35.7 t -114.86 129.22 71.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.352 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.834 ' HG ' ' HB3' ' A' ' 723' ' ' ALA . 5.7 mp -121.7 136.49 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.124 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -111.61 127.88 55.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.398 . . . . 0.0 111.186 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.698 HD12 ' OE2' ' A' ' 634' ' ' GLU . 72.7 mt -97.16 148.38 23.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.496 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 106.88 -132.36 11.1 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -89.88 175.18 4.03 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.382 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -82.53 135.71 8.23 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.742 2.295 . . . . 0.0 112.414 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.75 ' HB3' HD23 ' A' ' 717' ' ' LEU . 37.6 Cg_exo -51.31 150.81 14.17 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.114 1.876 . . . . 0.0 111.59 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.82 -39.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.687 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 132.14 81.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.497 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -72.19 -28.39 15.62 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.267 1.978 . . . . 0.0 111.818 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 72.1 mt -72.05 -28.84 63.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.573 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.75 HD23 ' HB3' ' A' ' 712' ' ' PRO . 40.4 tp -75.19 -42.82 54.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.858 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 718' ' ' THR . . . . . 0.601 HG23 HD12 ' A' ' 724' ' ' ILE . 57.3 m -64.6 -45.32 87.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.047 178.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.66 84.2 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.515 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -77.73 -17.46 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.455 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.97 147.71 48.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.425 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 62.9 p -83.19 -25.08 32.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.135 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.834 ' HB3' ' HG ' ' A' ' 706' ' ' LEU . . . -171.8 157.98 4.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.563 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.601 HD12 HG23 ' A' ' 718' ' ' THR . 70.1 mt -148.65 123.33 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.395 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.45 HD11 HD13 ' A' ' 734' ' ' LEU . 46.7 mt -102.59 147.85 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.44 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.4 p -167.59 -16.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.724 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -132.07 78.26 69.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.613 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -54.03 147.81 41.72 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.636 2.224 . . . . 0.0 111.74 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 6.2 tp -178.11 -38.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.159 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.65 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 -142.98 82.29 12.16 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.15 0.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.856 2.371 . . . . 0.0 111.669 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.65 ' H ' ' C ' ' A' ' 730' ' ' ASP . 90.5 mt-30 -69.56 -29.98 67.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.666 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.48 78.07 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.45 HD13 HD11 ' A' ' 725' ' ' LEU . 13.5 tp -57.85 -46.41 84.85 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 88.4 mt -63.98 -40.48 96.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.002 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 736' ' ' THR . . . . . 0.501 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 28.6 m -59.6 -39.2 83.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 27.4 m -62.31 -47.63 83.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.016 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.462 ' C ' HD23 ' A' ' 738' ' ' LEU . 8.8 tt -66.18 -41.01 90.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.859 0.362 . . . . 0.0 110.573 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -64.0 -28.08 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.101 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.59 -44.84 12.09 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.616 HD12 ' CG2' ' A' ' 673' ' ' ILE . 58.9 mt . . . . . 0 C--N 1.329 -0.296 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.222 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.648 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -93.57 134.39 35.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.875 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.411 ' CG2' ' CD1' ' A' ' 676' ' ' LEU . 67.1 mt -118.38 138.82 47.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.12 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.871 HD13 ' C ' ' A' ' 631' ' ' LEU . 3.2 tm? -110.06 124.05 50.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.64 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.713 ' N ' HD13 ' A' ' 631' ' ' LEU . 20.3 tp -113.26 122.1 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.726 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.458 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 17.6 tp -108.67 117.97 35.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.458 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 94.4 mt-10 -158.76 172.2 18.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.531 -178.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 636' ' ' GLU . 48.8 tp10 -106.82 152.44 23.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.127 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 635' ' ' GLU . 83.5 tt0 69.29 127.11 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.018 0.437 . . . . 0.0 110.543 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.689 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.4 p30 -66.25 -33.66 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.489 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.852 ' O ' HG23 ' A' ' 642' ' ' VAL . 96.7 mt-10 -66.18 -42.24 89.17 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.82 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.63 -45.42 62.1 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.864 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.437 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -64.96 -40.91 95.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.917 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.557 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 32.3 m -62.58 -43.72 98.12 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.631 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 638' ' ' GLU . 84.0 t -53.78 -49.23 59.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.872 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.8 t -58.82 -42.85 86.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.009 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.497 ' O ' ' OG1' ' A' ' 648' ' ' THR . 99.2 m -64.9 -36.61 84.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.369 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -62.06 -38.42 88.73 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.957 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 646' ' ' MET . . . . . 0.402 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 64.7 mtt -68.58 -47.89 65.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.32 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.591 ' CD2' ' N ' ' A' ' 647' ' ' LEU . 1.6 mm? -69.48 -43.99 72.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.119 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.8 m -56.09 -40.51 73.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.867 179.314 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.8 72.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.555 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.95 -4.76 37.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.14 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.76 -0.36 60.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 652' ' ' PHE . . . . . 0.41 ' HB3' HD12 ' A' ' 630' ' ' ILE . 88.5 m-85 -93.57 141.7 28.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 0.0 110.648 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -91.83 122.06 34.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.96 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.545 HG21 ' HB2' ' A' ' 647' ' ' LEU . 23.1 t -120.11 135.48 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.183 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 655' ' ' ILE . . . . . 0.582 HD12 HD22 ' A' ' 670' ' ' LEU . 63.4 mt -110.67 131.69 61.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.138 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.59 ' O ' HD22 ' A' ' 657' ' ' LEU . 13.8 t90 -95.15 120.17 34.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.381 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 656' ' ' TRP . 3.3 mm? -116.16 135.13 54.2 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.483 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.58 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 0.2 OUTLIER -100.41 2.54 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.295 179.629 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.58 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 80.1 m-20 -146.69 162.12 39.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.107 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.401 ' H ' ' HB3' ' A' ' 685' ' ' SER . . . -87.28 -48.75 4.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.768 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 t -57.57 -41.25 80.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.741 0.305 . . . . 0.0 111.054 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 50.6 m -62.84 -37.13 85.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.192 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.49 -40.09 96.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.818 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 39.0 mt -60.01 -43.14 95.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.016 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -63.08 -39.26 94.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -88.43 -49.92 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.391 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.4 tt -46.28 -42.67 14.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.332 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.55 -33.38 73.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.758 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 66.6 mt -74.23 -45.06 50.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.731 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.582 HD22 HD12 ' A' ' 655' ' ' ILE . 1.0 OUTLIER -83.19 -18.01 40.81 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 670' ' ' LEU . 76.9 mm-40 40.87 78.49 0.37 Allowed Pre-proline 0 C--N 1.33 -0.278 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.105 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.44 153.36 39.67 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 122.858 2.372 . . . . 0.0 112.774 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 78.4 mt -93.14 -19.11 6.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 121.049 0.452 . . . . 0.0 110.001 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 45.1 t -139.46 135.16 40.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.787 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.465 HG22 ' HG3' ' A' ' 677' ' ' MET . 77.8 mt -123.85 121.26 61.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.968 0.413 . . . . 0.0 111.492 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.411 ' CD1' ' CG2' ' A' ' 630' ' ' ILE . 4.1 mp -105.39 127.52 53.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.633 ' SD ' HD22 ' A' ' 689' ' ' LEU . 69.0 mtm -140.42 133.95 30.09 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.904 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.416 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -67.99 152.62 45.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.286 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.738 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 24.6 t-105 -110.59 -28.27 0.14 Allowed Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.282 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.738 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.4 Cg_endo -98.16 26.1 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 123.241 2.627 . . . . 0.0 115.42 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 71.3 Cg_endo -79.97 154.49 22.74 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.439 1.426 . . . . 0.0 112.116 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -64.26 -35.08 53.45 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.826 2.351 . . . . 0.0 112.243 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.585 ' C ' ' H ' ' A' ' 685' ' ' SER . 65.8 t0 -87.13 112.25 21.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.039 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -64.15 12.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.862 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 685' ' ' SER . . . . . 0.585 ' H ' ' C ' ' A' ' 683' ' ' ASP . 55.9 m -60.05 -29.82 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.801 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.506 ' SG ' ' HG3' ' A' ' 681' ' ' PRO . 19.4 m -59.5 -38.28 80.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.64 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 687' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 687' ' ' LEU . 62.3 mt -67.47 -34.97 78.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.857 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.72 -42.12 82.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.886 0.374 . . . . 0.0 110.351 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.771 ' O ' HD23 ' A' ' 689' ' ' LEU . 7.2 tt -60.57 -39.53 88.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.155 0.502 . . . . 0.0 109.875 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.631 HD11 HD22 ' A' ' 717' ' ' LEU . 9.0 tt -59.84 -41.54 91.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.648 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.58 -40.49 91.9 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.501 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -57.18 -46.03 83.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.311 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.55 -49.78 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.765 ' NH1' HD21 ' A' ' 716' ' ' LEU . 54.0 ttt85 -69.05 -27.34 65.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.582 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 695' ' ' GLU . . . . . 0.661 ' O ' ' CD2' ' A' ' 696' ' ' HIS . 31.1 tp10 -62.93 -34.56 77.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.814 -178.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.661 ' CD2' ' O ' ' A' ' 695' ' ' GLU . 6.8 p80 . . . . . 0 N--CA 1.472 0.661 0 O-C-N 123.246 0.341 . . . . 0.0 111.876 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.491 1.369 0 CA-C-O 120.982 0.326 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -41.31 168.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 123.263 2.642 . . . . 0.0 112.633 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.727 ' N ' HD12 ' A' ' 704' ' ' LEU . 5.6 mp -76.93 142.76 39.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.064 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.3 t -126.61 135.25 64.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.207 0.527 . . . . 0.0 111.656 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.769 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 50.8 mt -110.33 132.94 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.304 178.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.12 126.68 55.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.924 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.744 ' CD2' HD12 ' A' ' 725' ' ' LEU . 49.2 mt -95.7 150.68 20.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.536 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 94.58 -134.88 12.19 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.71 156.77 44.69 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.951 0.405 . . . . 0.0 111.053 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.57 148.47 26.13 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 123.045 2.497 . . . . 0.0 112.326 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.592 ' HD2' HD13 ' A' ' 724' ' ' ILE . 28.9 Cg_endo -65.35 151.12 86.15 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 122.604 2.203 . . . . 0.0 111.458 179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 43.0 t -77.94 -42.88 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.942 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -72.99 140.65 80.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -75.96 -12.21 19.69 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.622 2.214 . . . . 0.0 112.61 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.765 HD21 ' NH1' ' A' ' 694' ' ' ARG . 38.6 tp -69.5 -35.87 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.926 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.631 HD22 HD11 ' A' ' 690' ' ' LEU . 66.8 mt -75.21 -34.49 61.49 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 27.1 m -63.66 -42.05 98.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.093 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.16 -39.22 93.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.094 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.509 ' OE1' ' NH1' ' A' ' 694' ' ' ARG . 25.1 mt-30 -77.58 -19.96 54.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.175 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -74.46 132.94 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.868 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.4 p -85.73 -27.04 25.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.834 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.769 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -172.72 112.62 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.917 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.592 HD13 ' HD2' ' A' ' 712' ' ' PRO . 64.6 mt -91.1 133.51 32.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.346 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.744 HD12 ' CD2' ' A' ' 708' ' ' LEU . 35.5 mt -106.93 147.04 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.974 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 726' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 725' ' ' LEU . 2.9 m -168.78 5.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.379 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -134.56 78.87 55.25 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.474 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.28 137.7 76.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.917 1.744 . . . . 0.0 112.198 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' A' ' 730' ' ' ASP . 30.6 tp -179.23 112.87 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.541 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 732' ' ' GLN . 5.5 m-20 51.32 100.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.2 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 731' ' ' PRO . . . . . 0.402 ' HB3' ' SD ' ' A' ' 646' ' ' MET . 76.8 Cg_exo -46.51 -7.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.53 0 C-N-CA 122.692 2.261 . . . . 0.0 112.257 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 730' ' ' ASP . 92.1 mt-30 -71.75 -28.28 63.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.002 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 35.6 tp -66.7 -44.58 81.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.781 ' C ' HD23 ' A' ' 734' ' ' LEU . 7.0 tt -57.78 -47.06 83.61 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.256 0.551 . . . . 0.0 109.591 178.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.94 -37.84 88.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.569 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.2 m -58.06 -39.34 78.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.487 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.0 m -59.97 -41.94 93.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.587 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.42 -35.22 80.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.232 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.462 ' C ' ' N ' ' A' ' 741' ' ' LEU . 47.8 tt0 -62.1 -34.43 76.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.52 -13.01 0.22 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.462 ' N ' ' C ' ' A' ' 739' ' ' GLN . 14.1 tp . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.58 0.229 . . . . 0.0 110.487 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.639 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -89.74 133.51 34.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.595 ' C ' HD22 ' A' ' 631' ' ' LEU . 67.5 mt -113.99 135.78 52.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.627 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.595 HD22 ' C ' ' A' ' 630' ' ' ILE . 2.4 mm? -110.53 137.25 48.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.629 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 17.6 tp -126.58 125.81 42.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.582 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.752 HD23 ' SG ' ' A' ' 686' ' ' CYS . 24.8 tp -110.81 115.53 29.69 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.617 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 85.7 tt0 -159.59 161.2 35.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.804 -179.355 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 92.5 mt-10 -112.99 158.84 19.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 74.23 119.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.208 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.555 ' O ' ' OG1' ' A' ' 641' ' ' THR . 93.3 m-20 -57.5 -36.72 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.422 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.781 ' O ' HG23 ' A' ' 642' ' ' VAL . 84.0 tt0 -63.69 -43.62 96.08 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.677 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.589 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -77.46 -45.42 25.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.517 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.5 -43.18 90.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.959 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.555 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 61.3 m -63.85 -42.91 97.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.215 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 638' ' ' GLU . 51.2 t -55.59 -53.27 38.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.034 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.94 -42.57 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.431 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.545 ' SG ' HG13 ' A' ' 654' ' ' VAL . 3.3 t -60.93 -41.77 96.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.579 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.02 -38.44 88.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.621 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 646' ' ' MET . . . . . 0.483 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 61.2 ttp -70.09 -52.1 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 83.6 mt -64.73 -44.9 88.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.039 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.1 m -56.66 -40.99 76.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.075 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.06 -29.41 70.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.935 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -65.27 -5.22 6.59 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.892 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.61 -8.12 71.29 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -95.41 147.93 23.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.666 0.269 . . . . 0.0 110.424 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -91.71 129.63 37.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.991 0.424 . . . . 0.0 110.604 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.545 HG13 ' SG ' ' A' ' 644' ' ' CYS . 11.3 p -127.91 140.19 49.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.404 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 66.5 mt -108.65 133.4 53.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.129 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.618 ' C ' HD22 ' A' ' 657' ' ' LEU . 18.2 t90 -91.82 126.01 36.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.947 0.403 . . . . 0.0 110.835 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.1 mm? -112.24 145.62 39.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.463 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.553 HG12 ' CZ2' ' A' ' 656' ' ' TRP . 19.2 m -106.74 -3.97 10.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.753 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -151.59 132.36 14.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.693 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.25 -40.74 97.76 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 661' ' ' SER . . . . . 0.421 ' N ' ' OG ' ' A' ' 685' ' ' SER . 81.5 p -62.08 -39.96 94.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 54.8 m -64.44 -37.65 88.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.089 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.605 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -61.96 -41.09 97.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.327 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.678 HD21 ' HG ' ' A' ' 689' ' ' LEU . 86.0 mt -59.43 -41.62 89.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -63.25 -43.04 99.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.324 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -89.89 -52.15 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.175 0.512 . . . . 0.0 111.197 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.605 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.9 tt -48.24 -33.83 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.056 -178.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 668' ' ' ASP . . . . . 0.62 ' OD1' ' N ' ' A' ' 669' ' ' LEU . 46.4 p-10 -57.88 -38.77 76.37 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.34 -0.544 . . . . 0.0 110.46 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.62 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 63.3 mt -79.75 -24.46 41.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.967 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 631' ' ' LEU . 23.4 mt -71.9 -38.66 69.92 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.858 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.429 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 74.6 mm-40 48.9 62.67 11.78 Favored Pre-proline 0 C--N 1.329 -0.326 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.429 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 60.6 Cg_endo -79.52 159.62 25.52 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 123.36 2.707 . . . . 0.0 112.485 -179.22 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 73.5 mt -94.9 -23.27 5.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.52 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 51.7 t -138.8 133.52 41.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.162 0.506 . . . . 0.0 110.7 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 77.3 mt -128.2 121.22 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.958 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.446 HD12 ' N ' ' A' ' 676' ' ' LEU . 4.9 mp -105.29 128.92 53.7 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.832 ' SD ' HD13 ' A' ' 689' ' ' LEU . 70.5 mtm -142.02 142.8 32.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.552 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.621 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -65.78 152.57 44.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.883 178.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.752 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 72.5 t-105 -106.07 -23.79 0.19 Allowed Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.357 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.752 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.3 Cg_endo -100.32 29.29 0.12 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 123.219 2.613 . . . . 0.0 114.6 178.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.546 ' CD ' ' C ' ' A' ' 679' ' ' TRP . 63.4 Cg_endo -77.22 143.88 22.83 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.513 1.475 . . . . 0.0 111.903 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -66.97 -20.69 50.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.486 2.124 . . . . 0.0 112.12 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.404 ' C ' ' H ' ' A' ' 685' ' ' SER . 84.9 m-20 -87.27 117.38 25.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.109 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -65.65 -1.42 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.299 179.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 685' ' ' SER . . . . . 0.421 ' OG ' ' N ' ' A' ' 661' ' ' SER . 23.7 t -59.85 -34.44 73.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.437 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.752 ' SG ' HD23 ' A' ' 633' ' ' LEU . 0.6 OUTLIER -59.96 -41.89 92.9 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.168 0.509 . . . . 0.0 109.782 179.511 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.37 -32.72 74.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.675 179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 84.0 mt -67.82 -37.39 81.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.015 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.832 HD13 ' SD ' ' A' ' 677' ' ' MET . 8.0 tt -57.92 -45.33 86.72 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -62.04 -39.72 93.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.878 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -62.98 -46.07 89.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.252 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -55.84 -55.03 37.32 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.33 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.532 HD23 ' HE1' ' A' ' 696' ' ' HIS . 51.1 mt -55.8 -38.81 70.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.776 179.121 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 694' ' ' ARG . 39.9 ttm180 -62.62 -35.75 80.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.275 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -65.68 -35.76 81.71 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.123 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.532 ' HE1' HD23 ' A' ' 693' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.037 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo . . . . . 0 N--CA 1.489 1.259 0 CA-C-O 120.697 0.207 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.47 162.63 17.03 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.953 2.436 . . . . 0.0 112.087 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 61.4 mt -77.41 133.9 38.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.324 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.469 ' O ' ' N ' ' A' ' 722' ' ' SER . 52.8 t -125.47 132.51 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.956 0.408 . . . . 0.0 111.428 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.519 HD22 HD11 ' A' ' 734' ' ' LEU . 5.2 mp -116.92 134.28 54.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.188 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -110.99 127.47 55.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.93 0.395 . . . . 0.0 110.984 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 708' ' ' LEU . . . . . 0.82 ' N ' HD12 ' A' ' 708' ' ' LEU . 4.5 mp -96.74 145.54 25.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.522 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 105.3 -129.37 9.78 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.62 164.09 27.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.831 0.348 . . . . 0.0 110.507 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -72.93 160.83 45.1 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.865 2.377 . . . . 0.0 112.444 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.505 ' CD ' HD13 ' A' ' 724' ' ' ILE . 18.4 Cg_endo -62.7 156.11 55.09 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 123.019 2.48 . . . . 0.0 112.28 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.603 HG12 ' O ' ' A' ' 713' ' ' VAL . 22.0 t -83.42 10.3 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -161.76 140.43 7.19 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.324 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.07 -9.53 23.74 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.766 2.311 . . . . 0.0 112.753 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.7 tp -68.5 -35.2 77.17 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.351 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.582 ' O ' ' N ' ' A' ' 721' ' ' ALA . 81.7 mt -76.06 -31.85 59.0 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 97.4 m -61.82 -43.21 99.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.853 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.99 -40.86 95.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -74.74 -31.66 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.604 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 721' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -72.62 142.45 48.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 705' ' ' VAL . 65.2 p -85.36 -23.73 27.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.278 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.05 163.3 4.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.436 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.505 HD13 ' CD ' ' A' ' 712' ' ' PRO . 72.4 mt -143.09 124.35 11.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.691 ' N ' HD12 ' A' ' 725' ' ' LEU . 5.7 mp -104.51 153.6 20.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.615 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.43 18.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.433 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -139.3 88.47 12.9 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.447 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.658 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.3 Cg_exo -48.49 144.73 13.26 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.52 2.146 . . . . 0.0 111.894 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.658 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 13.5 tp 103.46 156.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.685 0.616 . . . . 0.0 110.246 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.474 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 1.4 t70 61.74 63.48 2.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.952 0.406 . . . . 0.0 111.062 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 731' ' ' PRO . . . . . 0.494 ' O ' HD23 ' A' ' 735' ' ' LEU . 33.4 Cg_endo -67.11 -4.59 11.86 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.961 2.441 . . . . 0.0 111.817 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -69.24 -29.29 67.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.908 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.1 -44.68 88.04 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.681 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.519 HD11 HD22 ' A' ' 706' ' ' LEU . 42.1 tp -59.43 -42.16 91.21 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.94 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 735' ' ' LEU . . . . . 0.494 HD23 ' O ' ' A' ' 731' ' ' PRO . 2.7 mm? -62.34 -41.05 98.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.192 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 36.1 m -59.23 -38.84 80.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.084 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.1 m -61.8 -43.03 99.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.796 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.94 -40.96 97.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.983 0.421 . . . . 0.0 110.129 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -64.99 -24.93 67.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.171 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.8 -20.36 0.42 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.55 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.402 ' N ' HD12 ' A' ' 741' ' ' LEU . 5.8 mp . . . . . 0 C--N 1.329 -0.296 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.418 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.649 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 629' ' ' HIS . . . . . 0.52 ' CE1' ' HB3' ' A' ' 670' ' ' LEU . 13.9 p80 -84.53 164.43 18.76 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.723 ' HB ' HG22 ' A' ' 654' ' ' VAL . 64.1 mt -113.79 141.01 31.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.976 0.417 . . . . 0.0 111.522 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.666 HD23 HG23 ' A' ' 675' ' ' ILE . 9.9 tp -107.32 135.31 49.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.086 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 33.2 tp -133.93 118.98 18.52 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.227 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.461 HD23 ' C ' ' A' ' 633' ' ' LEU . 8.2 tt -112.07 117.44 32.66 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.511 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.1 tt0 -159.78 162.97 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.045 -179.009 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.511 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 95.3 mt-10 -97.35 167.9 10.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.897 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 61.55 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 110.038 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.433 ' O ' ' OG1' ' A' ' 641' ' ' THR . 52.5 t0 -57.93 -36.95 73.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.919 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.503 ' O ' HG23 ' A' ' 642' ' ' VAL . 54.7 mp0 -65.16 -43.78 90.64 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.737 -178.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.65 -44.17 62.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.618 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.09 93.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.078 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 50.9 m -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.711 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 638' ' ' GLU . 55.8 t -55.58 -51.91 53.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.142 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.6 t -60.68 -46.67 95.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.514 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.55 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.5 OUTLIER -66.42 -33.93 76.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.672 -179.905 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 645' ' ' GLU . . . . . 0.462 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 85.2 tt0 -60.37 -39.53 87.58 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.319 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 7.3 tpp -65.0 -50.59 65.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.103 0.478 . . . . 0.0 109.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.693 ' HB2' HG21 ' A' ' 654' ' ' VAL . 85.0 mt -67.36 -45.25 76.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.204 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 28.5 m -56.13 -43.52 78.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.622 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 649' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 651' ' ' GLY . . . -69.66 -23.91 63.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -63.92 2.93 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.979 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 651' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 649' ' ' ALA . . . 97.12 -15.63 62.14 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 652' ' ' PHE . . . . . 0.406 ' O ' ' HA ' ' A' ' 648' ' ' THR . 96.7 m-85 -93.79 152.01 19.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -93.3 125.42 37.89 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.319 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.723 HG22 ' HB ' ' A' ' 630' ' ' ILE . 22.9 t -117.83 134.79 60.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.697 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 655' ' ' ILE . . . . . 0.547 HD12 HD13 ' A' ' 670' ' ' LEU . 44.7 mt -109.06 131.4 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.065 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.467 ' C ' HD12 ' A' ' 657' ' ' LEU . 22.5 t90 -95.53 121.66 37.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.176 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.517 HD12 ' N ' ' A' ' 657' ' ' LEU . 7.1 mp -116.2 146.59 42.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.685 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.581 ' O ' HG22 ' A' ' 658' ' ' VAL . 8.8 p -123.26 21.45 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.625 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 660' ' ' GLY . 48.6 t0 -152.28 163.61 39.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.563 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.415 ' N ' ' OD1' ' A' ' 659' ' ' ASP . . . -100.4 -54.51 1.01 Allowed Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.98 -0.628 . . . . 0.0 111.824 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 33.7 m -57.21 -41.87 80.24 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.602 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 26.5 m -64.4 -35.15 79.96 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.584 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.44 -42.48 99.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.622 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.56 HD22 ' ND1' ' A' ' 692' ' ' HIS . 80.6 mt -59.49 -43.79 93.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.852 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -62.71 -41.94 99.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.484 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.409 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 94.2 mt-30 -89.28 -51.31 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 111.298 -179.548 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.661 HD12 HD22 ' A' ' 631' ' ' LEU . 3.9 tt -45.81 -37.68 6.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.265 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -56.14 -38.63 71.1 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.923 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.48 -31.46 53.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.101 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.547 HD13 HD12 ' A' ' 655' ' ' ILE . 11.1 mt -72.48 -38.48 68.19 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.247 -178.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 46.82 65.55 6.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 110.192 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.492 ' HB3' ' CE1' ' A' ' 629' ' ' HIS . 30.5 Cg_endo -68.99 152.81 73.23 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 123.159 2.572 . . . . 0.0 112.952 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.811 HG23 HG23 ' A' ' 674' ' ' VAL . 19.3 tt -95.5 -22.21 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.696 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.811 HG23 HG23 ' A' ' 673' ' ' ILE . 76.1 t -140.1 133.69 35.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.468 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.666 HG23 HD23 ' A' ' 631' ' ' LEU . 78.4 mt -123.31 122.31 64.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.574 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.675 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -106.53 138.97 41.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.538 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.944 ' SD ' HD21 ' A' ' 690' ' ' LEU . 83.8 mtp -139.1 128.15 23.78 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.51 144.04 53.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.567 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.798 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 0.5 OUTLIER -113.68 -29.96 0.11 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.151 179.474 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.798 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 41.0 Cg_exo -50.87 -40.09 57.92 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.293 1.996 . . . . 0.0 113.288 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 23.4 Cg_exo -60.58 166.19 10.22 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.97 1.78 . . . . 0.0 111.961 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.512 ' O ' ' O ' ' A' ' 683' ' ' ASP . 32.1 Cg_exo -52.0 -17.97 6.35 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.532 2.154 . . . . 0.0 112.009 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 682' ' ' PRO . 1.0 OUTLIER 58.24 132.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.988 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -176.8 -78.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.736 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 77.3 p -64.08 -30.65 71.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.969 0.414 . . . . 0.0 109.941 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 2.4 m -62.42 -32.69 73.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.019 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.0 mt -64.58 -31.56 72.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.486 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.7 mt -63.27 -42.67 99.14 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.036 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.437 HD12 HD21 ' A' ' 664' ' ' LEU . 25.4 tp -60.36 -42.83 96.56 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.944 HD21 ' SD ' ' A' ' 677' ' ' MET . 82.1 mt -61.58 -40.64 95.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.778 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.88 -40.29 97.09 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.062 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.56 ' ND1' HD22 ' A' ' 664' ' ' LEU . 12.1 t-80 -57.5 -51.54 69.02 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.456 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 62.5 mt -55.13 -43.15 73.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.345 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -64.44 -35.66 81.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -65.91 -32.25 73.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.121 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 . . . . . 0 C--N 1.33 -0.25 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.454 -179.75 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo . . . . . 0 N--CA 1.489 1.228 0 CA-C-O 120.831 0.263 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -53.38 144.15 51.19 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.583 2.189 . . . . 0.0 111.789 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.552 ' H ' HD12 ' A' ' 704' ' ' LEU . 5.6 mp -79.39 138.42 37.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.359 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.535 ' C ' HD12 ' A' ' 706' ' ' LEU . 36.1 t -118.28 127.0 75.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.875 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.796 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.8 mp -115.63 129.85 56.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.942 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -109.15 128.23 54.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.014 0.435 . . . . 0.0 110.801 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 43.7 mt -95.44 149.97 20.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.561 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 101.34 -137.65 13.41 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -91.45 167.2 16.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.463 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.4 155.35 25.73 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.548 2.166 . . . . 0.0 112.483 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.47 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 22.5 Cg_endo -63.34 161.12 32.14 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 123.26 2.64 . . . . 0.0 112.07 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.1 -71.62 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 714' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.5 OUTLIER -70.97 148.07 94.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.663 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.91 -14.19 32.27 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.732 2.288 . . . . 0.0 112.222 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 74.2 mt -70.88 -31.52 68.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.411 ' O ' ' HB2' ' A' ' 721' ' ' ALA . 53.3 mt -77.03 -32.46 57.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 47.7 m -64.9 -43.54 92.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.039 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -66.18 -39.92 90.08 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.02 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -82.52 -11.55 58.38 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.454 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 721' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 717' ' ' LEU . . . -75.13 129.36 37.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.46 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.6 m -85.88 -23.0 27.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.057 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -168.44 139.37 2.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.351 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.551 ' C ' HD12 ' A' ' 725' ' ' LEU . 78.9 mt -123.73 126.11 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.656 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.794 ' N ' HD12 ' A' ' 725' ' ' LEU . 5.3 mp -106.82 151.9 24.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.679 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 60.7 p -167.1 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.062 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 74.99 79.38 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.018 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -48.95 125.29 12.82 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.397 2.065 . . . . 0.0 111.858 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.948 ' O ' HD23 ' A' ' 729' ' ' LEU . 0.5 OUTLIER -179.78 134.27 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.488 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.54 ' C ' ' H ' ' A' ' 732' ' ' GLN . 4.1 m-20 56.03 75.1 0.62 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.723 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.59 -7.56 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.625 2.217 . . . . 0.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 732' ' ' GLN . . . . . 0.54 ' H ' ' C ' ' A' ' 730' ' ' ASP . 14.4 mm100 -70.7 -26.41 63.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.299 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.43 -47.56 75.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.927 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 47.0 tp -58.13 -47.26 83.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.17 0.51 . . . . 0.0 109.662 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.6 tp -63.28 -38.65 91.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.133 179.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 736' ' ' THR . . . . . 0.499 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 59.5 m -58.29 -41.56 84.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.51 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 737' ' ' THR . . . . . 0.41 HG21 HD21 ' A' ' 706' ' ' LEU . 56.2 m -61.32 -41.21 96.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.922 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 13.6 tp -63.64 -39.04 93.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.364 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.486 ' O ' ' N ' ' A' ' 741' ' ' LEU . 55.0 tp60 -65.29 -32.5 74.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.985 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -46.72 -11.15 0.05 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.983 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.537 HD13 HD13 ' A' ' 673' ' ' ILE . 84.1 mt . . . . . 0 C--N 1.328 -0.327 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.647 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.662 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -87.55 144.18 26.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.716 0.293 . . . . 0.0 110.738 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 67.8 mt -119.21 132.37 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.621 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 51.2 tp -115.3 134.51 55.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.982 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.834 ' C ' HD12 ' A' ' 632' ' ' LEU . 0.2 OUTLIER -136.41 134.39 37.71 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.628 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.809 ' N ' HD12 ' A' ' 632' ' ' LEU . 25.9 tp -108.41 123.2 48.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.543 ' OE2' ' HB1' ' A' ' 639' ' ' ALA . 86.2 tt0 -159.45 155.32 26.35 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.509 -179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.461 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 75.8 mm-40 -95.76 167.01 11.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.492 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 62.48 112.41 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.654 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.9 p30 -64.94 -25.87 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.32 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.654 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.7 mt-10 -63.74 -40.62 97.18 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.37 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 639' ' ' ALA . . . . . 0.543 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -71.8 -41.65 68.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.292 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.477 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -67.44 -39.87 85.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.09 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 40.8 m -62.35 -44.09 97.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.796 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 638' ' ' GLU . 81.1 t -57.71 -50.47 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.66 -39.86 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.508 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.8 OUTLIER -59.04 -39.56 82.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -63.48 -36.79 84.93 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.782 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 59.8 mtt -68.75 -54.37 16.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.124 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 647' ' ' LEU . . . . . 0.552 ' N ' HD12 ' A' ' 647' ' ' LEU . 10.5 mp -67.08 -42.74 84.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.284 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 43.8 m -55.42 -42.53 74.27 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.456 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.07 -25.88 62.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.691 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.68 -5.01 40.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.992 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -9.57 70.48 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -98.2 134.13 41.68 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -92.62 127.45 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.121 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.418 HG13 ' SG ' ' A' ' 644' ' ' CYS . 14.4 p -122.84 139.78 48.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.041 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 67.7 mt -107.33 131.0 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.72 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.545 ' CZ2' ' CG1' ' A' ' 658' ' ' VAL . 10.3 t90 -94.78 117.36 30.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.473 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 663' ' ' ALA . 27.8 tp -116.44 149.73 38.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.546 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.545 ' CG1' ' CZ2' ' A' ' 656' ' ' TRP . 23.4 m -110.52 27.46 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.743 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.76 ' O ' HD13 ' A' ' 633' ' ' LEU . 67.9 m-20 -148.82 164.68 33.74 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.976 0.417 . . . . 0.0 111.143 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 660' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' A' ' 663' ' ' ALA . . . -109.47 -63.53 0.53 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 46.8 t -58.6 -40.78 84.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.0 110.725 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.6 m -62.64 -35.59 80.09 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 109.561 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.789 ' HB2' HD23 ' A' ' 657' ' ' LEU . . . -60.13 -45.55 92.62 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.418 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.827 ' O ' HD12 ' A' ' 664' ' ' LEU . 0.1 OUTLIER -57.97 -42.72 85.61 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.377 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 665' ' ' ASP . . . . . 0.508 ' N ' ' HG ' ' A' ' 664' ' ' LEU . 14.5 t70 -57.29 -39.6 76.05 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.158 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -94.56 -25.81 16.66 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.196 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.769 ' O ' HD23 ' A' ' 667' ' ' LEU . 7.5 tt -53.24 -35.22 59.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.022 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 668' ' ' ASP . . . . . 0.682 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 66.2 m-20 -54.92 -37.66 66.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.386 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 71.2 mt -76.76 -35.8 57.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.089 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.412 ' O ' ' C ' ' A' ' 671' ' ' GLN . 12.8 mt -70.44 -41.31 73.03 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.089 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.682 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 13.3 mt-30 41.35 64.64 5.15 Favored Pre-proline 0 C--N 1.331 -0.201 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -78.4 158.3 29.29 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 123.092 2.528 . . . . 0.0 113.47 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.868 HG23 HG23 ' A' ' 674' ' ' VAL . 5.9 tp -93.77 -21.28 6.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.554 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.868 HG23 HG23 ' A' ' 673' ' ' ILE . 62.1 t -142.19 137.75 29.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.539 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.508 ' C ' HD23 ' A' ' 676' ' ' LEU . 64.7 mt -127.07 120.24 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.645 HD23 ' N ' ' A' ' 676' ' ' LEU . 0.0 OUTLIER -107.37 134.1 50.93 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.156 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.9 mtm -139.13 136.2 34.89 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.404 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -66.59 144.88 56.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.382 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.742 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 4.7 t-105 -113.13 -33.56 0.11 Allowed Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.715 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.742 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 20.1 Cg_exo -56.1 -43.0 60.65 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.013 1.809 . . . . 0.0 112.696 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 84.7 Cg_endo -83.59 165.37 14.05 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.739 2.293 . . . . 0.0 111.684 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.94 -82.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.381 2.054 . . . . 0.0 111.655 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 56.07 43.67 26.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.876 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -57.71 -30.35 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.428 -179.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 94.2 p -64.61 -26.28 68.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.667 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -28.29 67.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.544 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 71.0 mt -62.7 -36.26 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.969 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 90.0 mt -68.42 -37.84 80.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.768 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.488 HD23 ' C ' ' A' ' 689' ' ' LEU . 8.6 tt -56.58 -46.37 80.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.608 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.44 -39.0 91.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.734 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -61.66 -41.04 96.97 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.394 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.612 ' CD2' HD13 ' A' ' 664' ' ' LEU . 32.2 t-80 -59.91 -48.39 81.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.911 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.95 -42.03 68.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.612 -0.435 . . . . 0.0 109.939 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.408 HH22 ' HB3' ' A' ' 716' ' ' LEU . 57.0 ttm-85 -65.73 -28.02 68.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.5 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.32 -39.32 89.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.901 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 2.2 p80 . . . . . 0 N--CA 1.464 0.267 0 C-N-CA 119.844 -0.742 . . . . 0.0 112.342 -179.678 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.489 1.208 0 N-CA-C 112.426 0.125 . . . . 0.0 112.426 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -73.81 163.31 37.44 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 C-N-CA 122.653 2.235 . . . . 0.0 112.015 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.76 ' H ' HD22 ' A' ' 704' ' ' LEU . 1.6 mm? -78.01 140.41 39.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.104 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 31.8 t -121.88 134.5 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.879 0.371 . . . . 0.0 111.127 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.797 HD22 ' HB3' ' A' ' 723' ' ' ALA . 47.4 mt -115.52 132.35 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.012 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -111.96 126.25 54.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.145 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.64 148.32 22.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.387 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 90.38 -128.89 9.48 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.27 163.13 37.94 Favored Pre-proline 0 CA--C 1.532 0.274 0 C-N-CA 121.264 -0.174 . . . . 0.0 110.763 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -68.45 138.9 43.59 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.157 1.904 . . . . 0.0 112.036 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.431 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -47.64 151.96 3.05 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.388 2.059 . . . . 0.0 112.496 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.543 HG13 ' N ' ' A' ' 714' ' ' ASP . 8.1 p -83.78 -46.61 18.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.115 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 714' ' ' ASP . . . . . 0.543 ' N ' HG13 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.24 147.56 90.58 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.423 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.22 -24.99 16.25 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.913 2.408 . . . . 0.0 113.175 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.408 ' HB3' HH22 ' A' ' 694' ' ' ARG . 77.0 mt -70.22 -29.61 66.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.923 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.707 HD12 ' N ' ' A' ' 717' ' ' LEU . 7.4 mp -77.76 -41.5 37.34 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.892 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 41.6 m -63.91 -42.81 97.31 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.03 90.4 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.969 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 720' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 720' ' ' GLN . 60.8 tt0 -83.82 -13.96 52.45 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.979 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 721' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -71.43 128.56 36.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.031 0.443 . . . . 0.0 110.809 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 31.9 t -85.5 -24.65 27.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.466 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.797 ' HB3' HD22 ' A' ' 706' ' ' LEU . . . -171.27 159.52 5.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.182 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 70.6 mt -136.39 125.93 38.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.779 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 50.7 mt -107.68 126.89 53.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.937 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 36.5 t -69.6 -87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.912 0.387 . . . . 0.0 110.358 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 727' ' ' LYS . . . . . 0.917 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 9.8 tttp -134.83 -34.49 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.833 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.917 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 36.9 Cg_exo -57.48 149.62 65.16 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.31 2.007 . . . . 0.0 112.659 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.48 -80.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.83 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 54.07 58.58 12.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.101 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -63.9 -15.77 50.99 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 C-N-CA 122.745 2.297 . . . . 0.0 112.165 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -70.78 -34.69 72.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.319 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.2 tp -68.85 -44.06 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.227 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.466 ' CD2' HD11 ' A' ' 647' ' ' LEU . 62.1 tp -53.19 -45.16 68.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.738 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.65 -40.22 96.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.218 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 58.3 m -58.6 -38.95 79.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.933 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 737' ' ' THR . . . . . 0.474 HG21 HD21 ' A' ' 706' ' ' LEU . 88.1 m -60.6 -39.69 89.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.994 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.511 ' CD2' HG21 ' A' ' 674' ' ' VAL . 23.5 mt -63.57 -42.38 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.659 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 741' ' ' LEU . 81.3 mt-30 -65.88 -28.71 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.244 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 740' ' ' GLY . . . . . 0.553 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -22.7 -45.76 0.01 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.56 ' N ' ' O ' ' A' ' 739' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.242 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.534 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 629' ' ' HIS . . . . . 0.443 ' HD1' ' HB3' ' A' ' 672' ' ' PRO . 21.7 t-80 -85.76 120.65 27.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.582 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.429 ' CG2' HD13 ' A' ' 676' ' ' LEU . 52.9 mt -117.68 135.48 57.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.755 0.312 . . . . 0.0 111.467 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.455 HD13 HD12 ' A' ' 667' ' ' LEU . 7.6 tt -108.17 127.62 53.99 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.047 0.451 . . . . 0.0 110.316 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.427 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 50.9 tp -110.15 125.05 52.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 9.0 tt -112.2 110.49 20.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.785 ' OE1' ' HB2' ' A' ' 678' ' ' ALA . 75.9 mm-40 -155.72 166.46 33.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.944 -179.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -111.98 165.36 12.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.23 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.3 tp10 65.76 121.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 111.078 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.526 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 81.6 m-20 -58.51 -37.18 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.023 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.55 ' O ' HG23 ' A' ' 642' ' ' VAL . 97.5 mt-10 -66.27 -45.26 81.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.061 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.7 -39.49 70.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.421 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 640' ' ' ALA . . . . . 0.636 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -68.35 -43.09 78.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.5 ' O ' ' N ' ' A' ' 645' ' ' GLU . 72.3 m -60.91 -43.55 98.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 638' ' ' GLU . 49.4 t -56.13 -54.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.771 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.65 -45.27 94.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.074 0.464 . . . . 0.0 110.112 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.598 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.4 OUTLIER -67.35 -41.0 85.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.893 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 645' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 641' ' ' THR . 86.0 tt0 -57.94 -40.6 80.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 80.8 mtp -67.04 -52.05 47.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.926 0.393 . . . . 0.0 110.428 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 80.4 mt -68.9 -43.28 75.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.826 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.598 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 34.5 m -56.24 -40.78 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.245 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.26 -25.85 62.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.684 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.71 -3.51 22.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.56 2.41 65.39 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.096 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -96.45 141.87 29.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 117.386 0.593 . . . . 0.0 110.651 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -87.85 110.89 20.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.215 0.531 . . . . 0.0 109.691 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.427 ' CG1' ' HB2' ' A' ' 632' ' ' LEU . 81.5 t -116.52 136.85 52.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.97 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 63.3 mt -108.9 133.42 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.851 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.636 ' CD1' ' HB1' ' A' ' 640' ' ' ALA . 23.8 t90 -92.96 111.59 23.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.756 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.794 ' CD2' ' HB2' ' A' ' 663' ' ' ALA . 22.7 tp -123.81 135.56 53.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.766 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 634' ' ' GLU . 21.1 m -105.72 -9.34 10.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.278 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.472 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 89.6 m-20 -100.95 152.04 21.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -102.78 -56.7 0.8 Allowed Glycine 0 CA--C 1.531 1.047 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.5 t -58.66 -40.78 84.47 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.888 0.375 . . . . 0.0 110.675 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 28.3 m -61.03 -38.85 87.61 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.794 ' HB2' ' CD2' ' A' ' 657' ' ' LEU . . . -61.55 -40.7 95.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.617 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.833 HD21 HD12 ' A' ' 689' ' ' LEU . 44.5 mt -57.8 -46.42 84.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.808 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.61 -43.49 93.59 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.817 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.401 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 94.0 mt-30 -84.67 -44.87 13.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.952 0.406 . . . . 0.0 111.391 -178.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.713 HD23 ' C ' ' A' ' 667' ' ' LEU . 9.6 tt -50.32 -35.06 25.97 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.5 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 668' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 664' ' ' LEU . 89.0 m-20 -55.36 -40.51 71.36 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.179 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 58.0 mt -74.5 -28.99 61.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 179.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 31.4 mt -72.39 -35.17 68.37 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.268 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.537 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 8.5 mm100 43.4 62.23 9.19 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.537 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 3.6 Cg_exo -72.35 156.59 54.59 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.397 2.732 . . . . 0.0 113.335 -178.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 70.9 mt -98.54 -27.52 3.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.609 HG22 ' HB2' ' A' ' 704' ' ' LEU . 38.8 t -137.04 132.97 47.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.511 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.547 ' C ' HD12 ' A' ' 676' ' ' LEU . 63.7 mt -128.67 125.21 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.227 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.1 mp -103.82 129.69 51.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.898 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.81 ' SD ' HD21 ' A' ' 690' ' ' LEU . 10.6 ptp -143.52 140.1 30.12 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.253 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.785 ' HB2' ' OE1' ' A' ' 634' ' ' GLU . . . -67.04 152.58 45.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.374 178.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.732 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 63.3 t-105 -106.4 -26.69 0.19 Allowed Pre-proline 0 C--O 1.233 0.217 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.362 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.8 Cg_endo -101.55 29.22 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 123.428 2.752 . . . . 0.0 114.6 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 66.1 Cg_endo -77.13 151.18 30.12 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.645 1.564 . . . . 0.0 111.966 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -71.82 -14.16 29.64 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.319 2.013 . . . . 0.0 112.376 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -87.63 112.47 22.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.777 0.323 . . . . 0.0 111.484 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -65.51 -8.98 22.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 87.9 p -64.53 -23.16 67.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -178.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.551 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -62.57 -38.61 90.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.052 0.453 . . . . 0.0 109.839 179.088 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 687' ' ' LEU . . . . . 0.551 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 76.0 mt -66.16 -35.83 81.51 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.992 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 688' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 688' ' ' LEU . 63.3 mt -66.52 -36.39 82.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.685 179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 689' ' ' LEU . . . . . 0.833 HD12 HD21 ' A' ' 664' ' ' LEU . 14.9 tp -59.56 -40.75 88.34 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 690' ' ' LEU . . . . . 0.81 HD21 ' SD ' ' A' ' 677' ' ' MET . 46.7 mt -59.61 -39.01 82.82 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.901 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.14 -42.21 94.39 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.62 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.7 ' HE2' ' CE1' ' A' ' 696' ' ' HIS . 4.1 t60 -62.63 -61.09 2.67 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 693' ' ' LEU . . . . . 0.714 HD21 ' HA ' ' A' ' 690' ' ' LEU . 1.6 pp -54.55 -33.13 59.61 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.868 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 694' ' ' ARG . . . . . 0.526 ' N ' HD12 ' A' ' 693' ' ' LEU . 23.5 ttt85 -60.82 -42.46 97.73 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.027 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -69.2 -39.79 78.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 696' ' ' HIS . . . . . 0.7 ' CE1' ' HE2' ' A' ' 692' ' ' HIS . 64.5 m170 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.632 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo . . . . . 0 N--CA 1.49 1.317 0 CA-C-O 120.469 0.112 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.58 140.44 23.92 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 122.303 2.002 . . . . 0.0 112.183 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.708 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER -81.0 142.68 33.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.716 -179.771 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.739 ' C ' HD12 ' A' ' 706' ' ' LEU . 40.5 t -126.05 125.98 68.89 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.041 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.793 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.9 mp -122.4 135.6 54.72 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.067 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -111.23 130.3 55.69 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.132 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 72.4 mt -96.85 146.46 24.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.541 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 88.2 -136.38 13.72 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 710' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 710' ' ' GLU . 0.3 OUTLIER -87.31 151.04 50.54 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.082 0.468 . . . . 0.0 110.85 -179.231 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.17 156.14 65.78 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 123.112 2.541 . . . . 0.0 112.945 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.684 ' O ' ' N ' ' A' ' 714' ' ' ASP . 29.4 Cg_endo -67.53 3.68 1.68 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.871 2.38 . . . . 0.0 112.292 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 55.2 t 60.42 -38.84 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.684 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 714' ' ' ASP . . . . . 0.684 ' N ' ' O ' ' A' ' 712' ' ' PRO . 52.1 m-20 -70.08 133.15 87.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.38 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -73.91 -19.53 20.61 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 122.312 2.008 . . . . 0.0 113.088 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 716' ' ' LEU . . . . . 0.448 ' H ' HD12 ' A' ' 716' ' ' LEU . 5.3 mp -71.36 -40.82 70.38 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.295 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.56 -37.09 57.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.652 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 31.8 m -63.37 -39.68 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.64 91.96 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.784 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -78.97 -20.23 49.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.548 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 721' ' ' ALA . . . . . 0.477 ' CB ' HD11 ' A' ' 724' ' ' ILE . . . -71.38 142.79 50.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.53 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.408 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 91.9 p -85.95 -29.02 23.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.33 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -167.2 129.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.477 HD11 ' CB ' ' A' ' 721' ' ' ALA . 18.2 mm -98.19 128.3 49.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.542 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 725' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.1 mp -107.68 145.02 33.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.674 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 726' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 727' ' ' LYS . 12.3 t -164.86 -16.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.062 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 727' ' ' LYS . . . . . 0.424 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.1 OUTLIER -129.96 74.81 80.25 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.136 179.711 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -50.36 142.93 28.23 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.845 2.364 . . . . 0.0 112.748 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 729' ' ' LEU . . . . . 0.422 ' O ' ' O ' ' A' ' 730' ' ' ASP . 39.6 tp -174.43 93.17 0.08 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.402 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 729' ' ' LEU . 25.2 m-20 57.76 147.06 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.47 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -68.98 3.22 2.52 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 123.142 2.561 . . . . 0.0 112.319 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -67.42 -31.61 71.92 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.731 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 24.9 tp -67.69 -53.72 25.35 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.094 -0.642 . . . . 0.0 110.667 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 734' ' ' LEU . . . . . 0.643 HD11 HD21 ' A' ' 676' ' ' LEU . 9.1 tt -57.15 -41.37 79.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.038 0.447 . . . . 0.0 110.76 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 24.2 tp -60.03 -39.52 86.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 35.4 m -58.33 -39.42 79.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.388 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 52.2 m -60.8 -43.33 98.28 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.901 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 738' ' ' LEU . . . . . 0.425 ' CD2' HG21 ' A' ' 674' ' ' VAL . 57.6 mt -63.22 -37.01 85.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.108 0.48 . . . . 0.0 110.388 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -64.67 -29.18 70.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.082 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.69 -20.3 3.92 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 741' ' ' LEU . 67.4 mt . . . . . 0 C--N 1.326 -0.422 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.436 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.651 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -89.09 131.27 35.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 110.376 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 630' ' ' ILE . . . . . 0.681 ' HB ' HG12 ' A' ' 654' ' ' VAL . 54.6 mt -114.67 141.54 30.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 631' ' ' LEU . . . . . 0.743 HD21 HD12 ' A' ' 670' ' ' LEU . 83.2 mt -103.9 131.5 51.06 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.209 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 632' ' ' LEU . . . . . 0.474 HD11 HG11 ' A' ' 643' ' ' VAL . 10.6 tp -124.18 117.36 24.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.011 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.469 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 9.4 tt -117.21 120.1 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.386 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 634' ' ' GLU . . . . . 0.469 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 92.4 mt-10 -158.56 170.29 22.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.194 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 635' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 636' ' ' GLU . 96.4 mt-10 -110.06 158.52 18.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.352 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 636' ' ' GLU . . . . . 0.529 ' HG2' ' H ' ' A' ' 638' ' ' GLU . 83.3 tt0 62.16 127.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.925 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 637' ' ' ASP . . . . . 0.706 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 51.6 p30 -61.94 -29.97 70.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 638' ' ' GLU . . . . . 0.859 ' O ' HG23 ' A' ' 642' ' ' VAL . 50.8 tp10 -63.29 -41.11 98.95 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.058 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.62 59.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 110.278 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.97 76.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.064 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 641' ' ' THR . . . . . 0.574 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 67.1 m -62.47 -46.18 89.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.085 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 642' ' ' VAL . . . . . 0.859 HG23 ' O ' ' A' ' 638' ' ' GLU . 89.4 t -56.77 -52.66 51.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.285 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 643' ' ' VAL . . . . . 0.474 HG11 HD11 ' A' ' 632' ' ' LEU . 98.4 t -60.31 -41.9 88.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.803 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 644' ' ' CYS . . . . . 0.505 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.7 OUTLIER -58.58 -42.39 87.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.779 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.1 -39.28 91.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.171 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.0 mtt -66.97 -50.14 63.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.061 0.457 . . . . 0.0 110.109 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 73.1 mt -69.08 -46.03 68.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.293 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 648' ' ' THR . . . . . 0.505 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 61.7 m -56.3 -41.98 76.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.105 0.479 . . . . 0.0 109.858 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.95 -24.97 64.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.649 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.72 -6.24 39.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.905 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.41 -12.76 66.29 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.758 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -96.03 142.35 28.35 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.742 179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -92.77 134.34 35.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.184 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 654' ' ' VAL . . . . . 0.681 HG12 ' HB ' ' A' ' 630' ' ' ILE . 4.0 m -122.99 153.66 28.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.025 0.441 . . . . 0.0 111.099 -179.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 655' ' ' ILE . . . . . 0.446 ' CD1' HD13 ' A' ' 670' ' ' LEU . 69.6 mt -108.96 135.44 47.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.708 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 656' ' ' TRP . . . . . 0.682 ' C ' HD22 ' A' ' 657' ' ' LEU . 18.9 t90 -92.7 126.1 37.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 111.241 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 657' ' ' LEU . . . . . 0.682 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.9 mm? -115.12 143.2 45.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.677 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 658' ' ' VAL . . . . . 0.612 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 82.2 t -98.28 -18.95 6.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.17 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 659' ' ' ASP . . . . . 0.612 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 98.6 m-20 -147.85 150.13 33.58 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.473 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -65.49 -39.68 95.79 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 18.9 t -58.16 -40.34 81.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.759 0.314 . . . . 0.0 110.796 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.6 m -64.64 -38.94 92.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 663' ' ' ALA . . . . . 0.448 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.63 -46.41 85.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.495 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 664' ' ' LEU . . . . . 0.568 HD22 ' ND1' ' A' ' 692' ' ' HIS . 67.5 mt -59.39 -42.19 91.12 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.811 -0.355 . . . . 0.0 111.134 -179.543 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -62.74 -40.13 96.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.804 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 666' ' ' GLN . . . . . 0.403 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 84.0 mt-30 -84.63 -42.93 14.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.097 0.475 . . . . 0.0 110.66 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 667' ' ' LEU . . . . . 0.776 HD23 ' C ' ' A' ' 667' ' ' LEU . 8.7 tt -45.29 -44.6 11.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.215 -179.013 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -58.56 -35.02 71.7 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.25 -38.52 56.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.928 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.743 HD12 HD21 ' A' ' 631' ' ' LEU . 0.1 OUTLIER -77.41 -41.7 38.98 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.709 -178.832 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 671' ' ' GLN . . . . . 0.463 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 8.0 mm-40 58.88 62.71 4.18 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 0.0 109.899 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 672' ' ' PRO . . . . . 0.521 ' HG3' HD11 ' A' ' 631' ' ' LEU . 50.5 Cg_endo -80.35 165.76 20.76 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.365 2.71 . . . . 0.0 112.554 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 673' ' ' ILE . . . . . 0.408 ' CG2' HD22 ' A' ' 741' ' ' LEU . 97.2 mt -94.92 -19.63 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.139 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 674' ' ' VAL . . . . . 0.672 HG13 HG23 ' A' ' 630' ' ' ILE . 14.9 p -141.05 141.92 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.309 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.711 HD12 HD12 ' A' ' 631' ' ' LEU . 12.9 mm -119.93 124.51 72.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.134 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 676' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' A' ' 706' ' ' LEU . 51.1 mt -107.07 126.8 52.82 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 677' ' ' MET . . . . . 0.453 ' SD ' HG13 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -141.9 135.16 29.19 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.931 -0.707 . . . . 0.0 112.383 -178.699 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 678' ' ' ALA . . . . . 0.586 ' O ' ' SG ' ' A' ' 686' ' ' CYS . . . -68.09 152.55 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.67 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 679' ' ' TRP . . . . . 0.599 ' CG ' ' O ' ' A' ' 679' ' ' TRP . 74.6 t-105 -125.23 49.73 3.63 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.286 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 680' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' A' ' 679' ' ' TRP . 95.0 Cg_endo -84.2 135.07 6.18 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.547 2.165 . . . . 0.0 111.319 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 681' ' ' PRO . . . . . 0.608 ' C ' ' H ' ' A' ' 683' ' ' ASP . 16.3 Cg_exo -51.27 -47.42 25.99 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 121.93 1.754 . . . . 0.0 113.305 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 682' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 32.7 Cg_endo -65.91 29.58 0.1 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.69 1.594 . . . . 0.0 111.163 -179.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 683' ' ' ASP . . . . . 0.608 ' H ' ' C ' ' A' ' 681' ' ' PRO . 21.9 t70 -151.27 71.93 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.043 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.53 0.35 0.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.532 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 685' ' ' SER . . . . . 0.45 ' H ' ' C ' ' A' ' 683' ' ' ASP . 20.4 m -61.45 -33.41 73.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.299 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 686' ' ' CYS . . . . . 0.586 ' SG ' ' O ' ' A' ' 678' ' ' ALA . 91.0 m -59.05 -27.34 65.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.919 0.39 . . . . 0.0 110.342 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.68 -33.3 75.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.31 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.56 -39.1 84.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.301 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.53 -42.26 96.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.416 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.5 -44.1 96.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.868 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -61.99 -38.78 89.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.904 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 692' ' ' HIS . . . . . 0.568 ' ND1' HD22 ' A' ' 664' ' ' LEU . 9.9 t-160 -56.86 -50.12 73.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.0 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.07 -42.85 73.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.999 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -67.68 -33.1 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.172 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -65.81 -32.15 73.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.488 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 . . . . . 0 C--N 1.329 -0.324 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.613 -179.359 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo . . . . . 0 N--CA 1.49 1.287 0 N-CA-C 112.549 0.173 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.97 166.35 29.41 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.687 2.258 . . . . 0.0 111.791 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.65 HD11 HG22 ' A' ' 737' ' ' THR . 6.4 tt -77.26 125.58 29.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.453 HG13 ' SD ' ' A' ' 677' ' ' MET . 61.2 t -122.81 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.121 0.486 . . . . 0.0 111.706 -179.154 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 706' ' ' LEU . . . . . 0.716 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 19.7 mt -118.35 135.92 54.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.692 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -107.88 121.57 45.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.599 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 40.3 mt -98.94 134.55 41.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.164 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 134.1 -138.01 9.74 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.411 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 710' ' ' GLU . . . . . 0.603 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.9 OUTLIER -93.59 -176.93 0.62 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.674 0.273 . . . . 0.0 111.017 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' A' ' 710' ' ' GLU . 19.4 Cg_exo -61.74 157.49 42.36 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.719 2.28 . . . . 0.0 112.323 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 712' ' ' PRO . . . . . 0.678 ' HB3' HD11 ' A' ' 717' ' ' LEU . 29.1 Cg_endo -65.45 146.07 84.36 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.174 2.583 . . . . 0.0 112.778 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 713' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 713' ' ' VAL . 54.4 t -84.22 -15.65 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.715 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -162.12 150.08 12.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.905 0.383 . . . . 0.0 110.398 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.4 -9.75 21.36 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.913 2.408 . . . . 0.0 112.939 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.4 mt -70.15 -39.88 75.1 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.767 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.759 ' C ' HD12 ' A' ' 717' ' ' LEU . 1.9 pp -80.56 -37.34 31.57 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 718' ' ' THR . . . . . 0.548 ' N ' HD12 ' A' ' 717' ' ' LEU . 30.9 m -63.83 -40.85 97.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.608 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.04 91.43 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-O 121.029 0.442 . . . . 0.0 109.998 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -74.25 -37.72 63.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.378 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.57 48.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.594 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 722' ' ' SER . . . . . 0.413 ' CB ' ' HG ' ' A' ' 704' ' ' LEU . 4.7 m -85.65 -23.15 27.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 723' ' ' ALA . . . . . 0.716 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -170.47 163.99 8.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.371 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 724' ' ' ILE . . . . . 0.408 HD13 HG21 ' A' ' 724' ' ' ILE . 31.6 mt -139.88 128.77 27.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.927 -179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 37.0 mt -106.9 125.41 50.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.131 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 59.0 m -72.1 -90.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.404 -179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 727' ' ' LYS . . . . . 0.891 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 26.9 tttt -130.71 -32.44 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 728' ' ' PRO . . . . . 0.891 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 48.0 Cg_exo -53.78 151.15 26.79 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.26 1.973 . . . . 0.0 112.08 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.54 -51.11 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.673 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 730' ' ' ASP . . . . . 0.477 ' N ' ' HD3' ' A' ' 731' ' ' PRO . 82.2 m-20 40.74 57.22 8.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.966 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 731' ' ' PRO . . . . . 0.477 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 68.1 Cg_endo -82.55 -28.11 1.91 Allowed 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.567 2.178 . . . . 0.0 112.045 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -73.5 -37.39 65.7 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 49.5 tp -67.31 -40.51 86.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.862 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 27.5 tp -55.55 -47.22 76.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.932 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 735' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 735' ' ' LEU . 9.4 tt -64.21 -44.42 91.99 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.271 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 91.3 m -61.2 -38.2 85.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.598 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 737' ' ' THR . . . . . 0.65 HG22 HD11 ' A' ' 704' ' ' LEU . 39.9 m -60.93 -42.54 98.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.202 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.6 -38.78 92.42 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.389 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 739' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 741' ' ' LEU . 97.0 mt-30 -64.49 -34.5 78.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.937 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -60.64 1.68 0.69 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 741' ' ' LEU . . . . . 0.501 ' H ' ' C ' ' A' ' 739' ' ' GLN . 63.1 tp . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 120.797 0.332 . . . . 0.0 110.602 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 179.54 135.26 2.37 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -96.09 135.18 38.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.789 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' A' ' 654' ' ' VAL . 57.5 mt -118.87 134.11 63.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.193 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.791 HD21 ' HB1' ' A' ' 663' ' ' ALA . 27.1 tp -107.21 131.67 53.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.097 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.456 HD12 ' HB2' ' A' ' 676' ' ' LEU . 4.6 tp -133.06 127.36 33.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.889 0.376 . . . . 0.0 111.877 -178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 633' ' ' LEU . 7.9 mp -109.68 119.12 38.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.57 ' OE2' ' HB1' ' A' ' 639' ' ' ALA . 83.9 tt0 -159.06 156.97 30.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.012 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.65 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 85.3 tt0 -115.59 138.17 51.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.65 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 69.1 tt0 103.56 113.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.47 ' O ' ' OG1' ' A' ' 641' ' ' THR . 62.1 t0 -57.54 -36.04 71.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.333 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.4 -44.47 82.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.664 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.57 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -70.58 -43.2 69.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.832 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.35 87.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 86.9 m -62.22 -44.28 96.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.686 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 56.6 t -57.75 -53.73 40.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.46 -46.26 92.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.149 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.566 ' O ' ' OG1' ' A' ' 648' ' ' THR . 73.2 m -61.46 -35.74 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.031 -179.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -62.48 -40.32 96.3 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.913 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 89.5 mtp -67.36 -51.61 50.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.944 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.678 HD22 HG21 ' A' ' 654' ' ' VAL . 6.6 mp -67.89 -42.68 80.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.675 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.566 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 87.1 m -55.64 -42.08 74.5 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.759 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.06 -29.57 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.029 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.31 -6.65 47.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.735 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.25 2.4 73.98 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 652' ' ' PHE . . . . . 0.621 ' CE2' HD22 ' A' ' 735' ' ' LEU . 84.2 m-85 -96.88 145.15 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.122 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -93.43 128.92 39.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.689 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.678 HG21 HD22 ' A' ' 647' ' ' LEU . 71.8 t -124.61 138.01 55.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.552 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 53.3 mt -105.66 130.74 56.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 0.0 110.495 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.535 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 24.4 t90 -96.66 111.51 23.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.429 ' CD1' ' HA ' ' A' ' 663' ' ' ALA . 64.6 mt -116.4 141.86 47.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.708 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.532 ' O ' HG12 ' A' ' 658' ' ' VAL . 18.4 t -101.35 2.28 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -148.42 136.33 20.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 0.0 110.879 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.484 ' H ' ' HB2' ' A' ' 685' ' ' SER . . . -61.48 -37.9 94.9 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 90.0 p -60.02 -34.98 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.832 0.349 . . . . 0.0 110.229 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 19.2 m -64.75 -39.6 93.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.642 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.791 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -63.87 -43.61 95.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.043 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.72 -39.31 84.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.37 . . . . 0.0 110.834 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 665' ' ' ASP . . . . . 0.576 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 23.4 t70 -62.43 -41.52 98.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.949 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.574 ' O ' HD23 ' A' ' 670' ' ' LEU . 42.5 mt-30 -90.08 -45.23 9.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.126 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 663' ' ' ALA . 0.9 OUTLIER -44.56 -44.64 8.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.2 -179.132 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 668' ' ' ASP . . . . . 0.576 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 30.1 p-10 -61.81 -35.74 79.08 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.45 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.482 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 65.3 mt -78.23 -48.16 16.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.933 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.574 HD23 ' O ' ' A' ' 666' ' ' GLN . 0.7 OUTLIER -82.62 -29.32 30.2 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.527 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 667' ' ' LEU . 6.6 mt-30 45.56 81.17 0.26 Allowed Pre-proline 0 C--N 1.329 -0.321 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.115 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.69 157.19 18.69 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 123.028 2.485 . . . . 0.0 112.427 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.745 HG13 HG23 ' A' ' 674' ' ' VAL . 26.3 pt -94.02 -10.7 9.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.69 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.745 HG23 HG13 ' A' ' 673' ' ' ILE . 83.4 t -139.7 134.05 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.49 HD11 HD11 ' A' ' 667' ' ' LEU . 62.2 mt -128.93 119.54 49.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.05 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.456 ' HB2' HD12 ' A' ' 632' ' ' LEU . 3.5 mp -107.68 137.68 45.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.071 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.572 ' CE ' ' HG ' ' A' ' 686' ' ' CYS . 74.8 mtm -138.17 133.44 33.31 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.197 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.587 ' O ' ' OD2' ' A' ' 683' ' ' ASP . . . -67.51 145.05 55.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.248 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.767 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 32.9 t-105 -113.21 -15.1 0.11 Allowed Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.767 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 75.4 Cg_exo -46.6 162.79 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.711 1.607 . . . . 0.0 112.296 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.537 ' N ' ' HD2' ' A' ' 682' ' ' PRO . 23.8 Cg_exo -50.47 -49.99 14.91 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.678 2.252 . . . . 0.0 114.112 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 10.7 Cg_endo -55.79 -6.12 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 121.51 1.474 . . . . 0.0 111.234 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.587 ' OD2' ' O ' ' A' ' 678' ' ' ALA . 27.3 t0 -83.53 155.23 23.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.96 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -179.09 -31.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.508 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 685' ' ' SER . . . . . 0.484 ' HB2' ' H ' ' A' ' 660' ' ' GLY . 83.7 p -66.3 -28.31 68.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.592 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.572 ' HG ' ' CE ' ' A' ' 677' ' ' MET . 1.6 t -61.25 -22.25 64.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 687' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 687' ' ' LEU . 88.1 mt -64.79 -34.61 78.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.913 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.2 -39.86 86.4 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.968 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.616 ' O ' HD23 ' A' ' 689' ' ' LEU . 7.3 tt -61.85 -40.88 96.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.022 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.46 HD13 HD22 ' A' ' 717' ' ' LEU . 95.4 mt -60.26 -38.56 83.89 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.335 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 691' ' ' GLN . . . . . 0.476 ' HA ' ' NH1' ' A' ' 694' ' ' ARG . 60.8 tt0 -61.01 -42.14 97.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.978 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -58.36 -49.35 77.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.105 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.62 ' O ' ' N ' ' A' ' 697' ' ' GLN . 64.0 mt -55.53 -38.77 69.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.523 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.476 ' NH1' ' HA ' ' A' ' 691' ' ' GLN . 34.0 ttm105 -65.24 -37.57 87.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -68.41 -37.79 80.66 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.738 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -127.75 41.22 3.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.428 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.62 ' N ' ' O ' ' A' ' 693' ' ' LEU . 63.3 tp60 -57.26 -37.05 71.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.239 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -87.07 113.23 22.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.115 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -168.38 128.96 1.09 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.744 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -44.06 155.09 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 122.355 2.037 . . . . 0.0 111.734 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 56.98 60.36 7.29 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 703' ' ' PRO . 11.8 Cg_endo -57.49 113.5 1.53 Allowed 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.082 2.522 . . . . 0.0 112.4 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 703' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 702' ' ' PRO . 46.5 Cg_exo -51.35 -149.61 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 94.8 mt -154.25 123.25 6.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.328 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.524 ' O ' ' OG ' ' A' ' 722' ' ' SER . 21.1 t -107.36 127.17 63.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.17 0.509 . . . . 0.0 111.499 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.622 ' N ' HD12 ' A' ' 706' ' ' LEU . 5.2 mp -121.35 139.37 53.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.363 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -106.78 128.79 54.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.105 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.6 mt -93.71 146.79 23.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.598 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 86.66 -126.04 7.7 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -90.26 159.44 41.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 110.779 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.513 ' HB3' HD13 ' A' ' 724' ' ' ILE . 72.6 Cg_endo -79.04 149.05 22.23 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.787 2.324 . . . . 0.0 112.338 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -64.92 145.61 86.09 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.71 2.274 . . . . 0.0 112.052 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 79.7 t -80.13 -37.68 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 714' ' ' ASP . . . . . 0.636 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.3 OUTLIER -71.98 139.57 82.7 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.494 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.28 -17.01 21.88 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.599 2.199 . . . . 0.0 112.925 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 21.3 tp -70.05 -38.93 75.95 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.829 -0.349 . . . . 0.0 111.015 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.513 ' CD1' ' CH2' ' A' ' 679' ' ' TRP . 48.5 mt -77.06 -34.86 57.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 61.0 m -64.98 -41.14 95.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.922 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.89 96.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.429 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -82.76 -8.22 59.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.56 131.66 41.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 705' ' ' VAL . 83.4 p -86.42 -29.18 23.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.667 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.08 131.77 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.513 HD13 ' HB3' ' A' ' 711' ' ' PRO . 60.9 mt -93.16 128.48 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.119 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 33.8 mt -107.79 148.48 29.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.387 . . . . 0.0 111.252 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.5 t -167.42 -66.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.517 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 727' ' ' LYS . . . . . 0.441 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 0.7 OUTLIER -135.06 59.74 35.72 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.207 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 63.5 Cg_endo -79.72 141.14 15.19 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.915 2.41 . . . . 0.0 112.295 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.517 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.2 OUTLIER -67.01 109.3 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.771 179.698 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.517 ' O ' ' O ' ' A' ' 729' ' ' LEU . 31.1 m-20 54.85 147.84 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.39 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -63.32 0.25 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 123.083 2.522 . . . . 0.0 111.898 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 730' ' ' ASP . 95.0 mt-30 -68.13 -29.95 68.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.581 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.8 tp -63.71 -42.86 97.89 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.55 -43.65 89.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.193 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 735' ' ' LEU . . . . . 0.621 HD22 ' CE2' ' A' ' 652' ' ' PHE . 31.4 mt -61.53 -36.9 81.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.168 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.7 m -58.9 -42.26 89.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.331 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.8 m -62.0 -42.78 99.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.609 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.5 tt -64.78 -43.95 91.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.668 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 741' ' ' LEU . 96.9 mm-40 -66.53 -32.33 73.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.889 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.39 -5.93 0.37 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.145 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 739' ' ' GLN . 38.7 tp -77.54 -39.0 47.46 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.783 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 742' ' ' CYS . 39.5 t 52.93 63.18 8.93 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.484 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.88 116.75 2.86 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.537 2.158 . . . . 0.0 111.751 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -90.39 131.58 1.72 Allowed 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.77 2.313 . . . . 0.0 112.408 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 745' ' ' ASN . . . . . 0.539 ' OXT' ' CG ' ' A' ' 745' ' ' ASN . 35.8 p-10 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.745 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 153.99 157.01 7.91 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -93.98 135.64 35.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.62 HG23 HG13 ' A' ' 674' ' ' VAL . 59.1 mt -115.82 135.93 54.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.366 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 1.096 HD22 HD12 ' A' ' 667' ' ' LEU . 16.3 tp -111.0 130.41 55.6 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.868 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.458 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 19.0 tp -116.09 125.65 52.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.771 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 14.7 tp -118.37 112.93 20.65 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.575 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 84.2 tt0 -160.35 164.96 32.06 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.719 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 77.5 mm-40 -106.07 168.2 9.29 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.409 ' HB3' ' O ' ' A' ' 635' ' ' GLU . 43.3 tp10 67.7 110.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.42 . . . . 0.0 110.48 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.563 ' OD1' ' OG1' ' A' ' 641' ' ' THR . 63.0 t0 -56.99 -36.02 69.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.292 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -62.67 -42.13 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.353 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.32 -45.99 57.53 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.563 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.474 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -65.1 -36.39 84.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.576 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.563 ' OG1' ' OD1' ' A' ' 637' ' ' ASP . 77.2 m -63.34 -46.55 86.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.646 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 41.7 t -54.69 -50.25 61.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.515 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 98.8 t -58.92 -43.52 88.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.87 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.588 ' O ' ' OG1' ' A' ' 648' ' ' THR . 71.1 m -67.34 -37.51 83.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.796 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -62.25 -39.48 93.01 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.352 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.6 mtm -65.8 -49.75 67.14 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.942 -0.703 . . . . 0.0 109.855 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.719 ' CD1' HG21 ' A' ' 654' ' ' VAL . 42.0 mt -70.52 -43.58 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.663 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 85.0 m -55.83 -42.36 75.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.938 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.91 -33.79 76.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -76.14 -5.46 46.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.43 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.74 14.8 66.91 Favored Glycine 0 CA--C 1.53 1.023 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 652' ' ' PHE . . . . . 0.568 ' CZ ' HD11 ' A' ' 735' ' ' LEU . 9.2 m-85 -91.33 143.68 26.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -91.37 114.54 27.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.719 HG21 ' CD1' ' A' ' 647' ' ' LEU . 61.1 t -128.82 134.25 64.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.095 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 655' ' ' ILE . . . . . 0.459 ' HB ' HD12 ' A' ' 631' ' ' LEU . 53.0 mt -112.49 125.02 69.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.403 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.575 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 22.6 t90 -94.53 119.92 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.502 HD12 ' HB2' ' A' ' 663' ' ' ALA . 52.8 mt -119.58 149.31 42.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.992 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.574 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 30.6 m -113.38 10.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.635 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 85.5 m-20 -149.86 121.06 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.271 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.92 -42.29 99.62 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 79.9 p -58.93 -37.67 77.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.074 0.464 . . . . 0.0 110.22 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 29.0 m -65.27 -39.69 92.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.103 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -64.62 -41.78 95.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.184 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.19 -46.12 89.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 111.446 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -61.78 -40.38 94.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.022 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -88.61 -54.79 4.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.476 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 1.096 HD12 HD22 ' A' ' 631' ' ' LEU . 10.3 tt -48.32 -35.19 11.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.484 -178.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -53.55 -40.61 65.68 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.193 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 57.0 mt -79.51 -24.98 41.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.724 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 32.3 mt -71.57 -35.61 70.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.801 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.499 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.2 mm-40 47.23 63.87 9.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 5.9 Cg_exo -73.11 160.02 46.38 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 123.178 2.586 . . . . 0.0 112.857 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 81.1 mt -94.53 -23.1 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.992 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.62 HG13 HG23 ' A' ' 630' ' ' ILE . 10.5 p -145.82 141.07 21.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.067 0.461 . . . . 0.0 111.13 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 79.0 mt -124.32 119.35 56.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.192 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.439 HD23 ' HB2' ' A' ' 706' ' ' LEU . 70.2 mt -105.5 131.44 52.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.36 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 7.2 ptm -145.83 138.29 25.58 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.99 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.38 149.31 48.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.743 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 28.3 t-105 -110.63 -34.33 0.13 Allowed Pre-proline 0 C--N 1.328 -0.334 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.993 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.743 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 39.0 Cg_exo -52.56 -41.48 67.99 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.23 1.954 . . . . 0.0 112.762 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 24.0 Cg_exo -59.63 134.52 58.32 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.133 1.889 . . . . 0.0 112.094 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.35 33.33 0.52 Allowed 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.883 2.389 . . . . 0.0 112.437 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -81.45 111.76 18.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.153 0.502 . . . . 0.0 110.873 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -61.04 -24.94 66.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.68 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 38.6 m -59.95 -36.54 77.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.511 ' O ' ' CD1' ' A' ' 690' ' ' LEU . 73.6 m -59.97 -34.55 73.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.58 -34.91 79.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.416 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.773 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -70.48 -35.65 73.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.24 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.489 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 4.9 tp -60.47 -43.71 96.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.71 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.511 ' CD1' ' O ' ' A' ' 686' ' ' CYS . 7.0 mp -61.94 -38.89 90.18 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.857 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -60.13 -41.98 93.84 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.206 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -61.6 -54.63 40.46 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.575 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.609 HD13 ' NE2' ' A' ' 696' ' ' HIS . 1.7 mm? -55.17 -37.66 67.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.124 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -60.37 -37.16 79.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.263 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -68.44 -40.89 80.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.164 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.628 ' C ' ' HD1' ' A' ' 696' ' ' HIS . 0.1 OUTLIER -104.71 13.5 31.32 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.236 -179.697 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.464 ' N ' ' O ' ' A' ' 693' ' ' LEU . 54.8 tt0 -61.86 -29.49 70.22 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -78.1 1.46 21.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.77 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.45 146.39 88.89 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.89 148.24 58.02 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.577 2.185 . . . . 0.0 111.725 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.455 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 2.7 m-70 51.4 55.64 16.05 Favored Pre-proline 0 C--N 1.33 -0.278 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 17.8 Cg_endo -63.26 141.63 82.94 Favored 'Trans proline' 0 C--N 1.306 -1.661 0 C-N-CA 122.87 2.38 . . . . 0.0 112.342 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -69.59 149.16 67.65 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.721 2.281 . . . . 0.0 111.914 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 37.1 mt -78.71 141.35 37.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.661 ' C ' HD12 ' A' ' 706' ' ' LEU . 59.8 t -121.84 125.96 73.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.309 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.661 HD12 ' C ' ' A' ' 705' ' ' VAL . 5.4 mp -131.2 138.17 49.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.072 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 707' ' ' PHE . . . . . 0.852 ' CE2' ' HB2' ' A' ' 721' ' ' ALA . 13.0 m-85 -113.37 130.31 56.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.505 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.711 ' N ' HD12 ' A' ' 708' ' ' LEU . 5.4 mp -94.88 148.72 22.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.408 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 709' ' ' GLY . . . . . 0.581 ' O ' ' O ' ' A' ' 725' ' ' LEU . . . 101.83 -134.93 11.94 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.36 154.09 48.73 Favored Pre-proline 0 CA--C 1.529 0.173 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -81.87 131.83 7.24 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 C-N-CA 122.655 2.236 . . . . 0.0 112.586 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.474 ' HB3' HD23 ' A' ' 717' ' ' LEU . 24.2 Cg_exo -52.17 152.01 15.75 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.106 1.871 . . . . 0.0 111.636 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 76.9 t -80.99 -21.9 10.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.868 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -72.53 132.27 83.81 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.678 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -74.45 -30.22 8.41 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.281 1.987 . . . . 0.0 111.886 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.507 ' HG ' ' N ' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -75.69 -32.18 60.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.957 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.507 ' N ' ' HG ' ' A' ' 716' ' ' LEU . 42.3 tp -76.78 -42.91 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 718' ' ' THR . . . . . 0.409 HG23 ' CD1' ' A' ' 724' ' ' ILE . 30.4 m -64.4 -39.41 93.79 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.72 -32.1 73.46 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -71.06 -31.43 67.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.853 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 721' ' ' ALA . . . . . 0.852 ' HB2' ' CE2' ' A' ' 707' ' ' PHE . . . -70.87 150.46 45.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.683 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.498 ' N ' ' O ' ' A' ' 705' ' ' VAL . 74.2 m -84.18 -26.95 28.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.148 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 159.45 5.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.359 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.409 ' CD1' HG23 ' A' ' 718' ' ' THR . 73.9 mt -142.45 131.99 22.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.157 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.581 ' O ' ' O ' ' A' ' 709' ' ' GLY . 5.3 mp -102.93 148.43 25.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.242 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 20.6 p -165.71 6.63 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.128 0.49 . . . . 0.0 110.06 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -139.22 64.12 31.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.953 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -55.91 126.4 22.3 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.269 1.979 . . . . 0.0 112.477 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.938 ' O ' HD12 ' A' ' 729' ' ' LEU . 0.3 OUTLIER 178.49 -14.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.907 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -143.87 75.23 16.08 Favored Pre-proline 0 CA--C 1.528 0.12 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.378 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -56.52 -9.89 4.34 Favored 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.621 2.214 . . . . 0.0 111.408 179.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.521 ' O ' ' OE1' ' A' ' 732' ' ' GLN . 0.0 OUTLIER -72.64 -22.48 60.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.438 -179.462 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.71 -47.63 68.81 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 66.9 tp -59.97 -43.96 94.75 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.676 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 735' ' ' LEU . . . . . 0.568 HD11 ' CZ ' ' A' ' 652' ' ' PHE . 24.4 tp -59.06 -38.46 79.47 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 94.1 m -60.45 -37.1 79.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.505 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 57.7 m -59.85 -47.72 84.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.418 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.503 ' O ' HD23 ' A' ' 738' ' ' LEU . 8.2 tt -66.73 -38.77 87.34 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.504 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.612 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.4 mm-40 -64.61 -28.92 69.95 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.916 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -55.11 3.21 0.02 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.612 ' H ' ' C ' ' A' ' 739' ' ' GLN . 39.6 tp -79.14 -35.25 42.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.805 0.336 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 57.98 62.49 5.04 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.114 0.483 . . . . 0.0 110.524 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -82.47 116.92 2.68 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 122.334 2.023 . . . . 0.0 110.836 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -84.48 151.41 11.83 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.741 2.294 . . . . 0.0 112.343 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 65.3 t30 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.035 -0.984 . . . . 0.0 110.584 -179.789 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.487 ' C ' ' H ' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -71.25 14.53 1.66 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 629' ' ' HIS . . . . . 0.487 ' H ' ' C ' ' A' ' 627' ' ' ALA . 3.0 m-70 -88.0 136.21 33.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.968 0.414 . . . . 0.0 110.925 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.836 ' HB ' HG12 ' A' ' 654' ' ' VAL . 78.6 mt -115.69 140.17 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.459 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.734 HD23 HD12 ' A' ' 667' ' ' LEU . 63.2 tp -108.76 132.08 54.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.964 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.649 HD23 ' C ' ' A' ' 632' ' ' LEU . 8.4 tt -135.19 123.32 22.88 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.189 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.719 HD22 HD22 ' A' ' 689' ' ' LEU . 9.6 mp -107.59 115.48 30.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.094 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.481 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.9 tt0 -159.92 157.59 29.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.886 0.374 . . . . 0.0 111.177 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.654 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.1 tt0 -115.37 144.52 43.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.394 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.654 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 42.6 tp10 110.96 109.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.724 0.64 . . . . 0.0 110.338 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.702 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.0 p30 -66.62 -34.42 77.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.745 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.702 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.8 mt-10 -67.43 -50.7 58.25 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.679 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -68.23 -36.14 79.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.171 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 656' ' ' TRP . . . -68.85 -40.15 79.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.23 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 62.4 m -60.89 -47.63 85.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.023 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 92.0 t -58.11 -53.37 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.467 . . . . 0.0 110.439 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.96 -46.43 94.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.252 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.527 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.7 t -56.09 -39.96 72.9 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.574 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -61.38 -37.32 82.97 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.95 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.1 mtt -66.12 -54.18 28.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.324 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.05 -43.68 78.13 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.539 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.527 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 29.3 m -55.86 -42.38 75.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.251 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.92 64.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.758 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -68.99 -4.93 18.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.611 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.35 -0.85 78.62 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -98.19 137.3 37.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.164 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -93.6 126.91 39.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.866 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.836 HG12 ' HB ' ' A' ' 630' ' ' ILE . 10.5 m -126.04 151.59 32.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 110.986 -179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 19.1 mm -108.91 127.48 65.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.62 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.533 ' CE2' ' HB1' ' A' ' 640' ' ' ALA . 3.6 t-105 -96.16 119.3 34.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.05 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.906 HD23 ' HB2' ' A' ' 663' ' ' ALA . 16.7 tp -132.62 139.08 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.969 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 17.6 m -99.13 -7.81 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.143 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.573 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 93.0 m-20 -98.39 155.15 17.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -97.24 -64.14 0.9 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.95 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.8 t -57.78 -39.9 78.56 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 121.128 -0.229 . . . . 0.0 111.441 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 60.2 m -62.78 -37.95 88.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.936 0.398 . . . . 0.0 110.406 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.906 ' HB2' HD23 ' A' ' 657' ' ' LEU . . . -62.6 -41.3 98.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.528 HD13 ' ND1' ' A' ' 692' ' ' HIS . 61.1 mt -58.82 -47.45 84.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.065 0.459 . . . . 0.0 110.719 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -61.4 -38.82 88.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.688 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -83.87 -34.1 24.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.72 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.781 ' O ' HD23 ' A' ' 667' ' ' LEU . 8.1 tt -50.93 -39.25 54.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.659 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -56.06 -35.95 67.52 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 669' ' ' LEU . 74.5 mt -75.81 -30.54 59.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.459 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.58 ' CD1' HD13 ' A' ' 631' ' ' LEU . 28.4 mt -71.79 -37.41 70.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.187 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.483 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 42.2 mm-40 45.36 60.78 13.04 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.647 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 95.6 Cg_endo -89.67 157.93 5.21 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 123.43 2.754 . . . . 0.0 112.552 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.542 HG13 HG23 ' A' ' 674' ' ' VAL . 24.0 pt -97.33 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.783 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.646 HG21 ' HG ' ' A' ' 738' ' ' LEU . 41.7 t -142.66 139.52 28.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.928 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 73.4 mt -124.73 126.05 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.431 HD21 HD11 ' A' ' 734' ' ' LEU . 5.1 mp -104.63 137.8 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.737 ' SD ' ' N ' ' A' ' 678' ' ' ALA . 0.2 OUTLIER -137.22 121.97 18.67 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.03 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.737 ' N ' ' SD ' ' A' ' 677' ' ' MET . . . -66.63 153.91 41.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.79 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 56.9 t-105 -110.19 66.19 0.44 Allowed Pre-proline 0 C--N 1.328 -0.336 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.564 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.418 ' HD3' ' C ' ' A' ' 678' ' ' ALA . 40.2 Cg_endo -69.54 169.17 19.26 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.962 2.442 . . . . 0.0 111.454 178.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 682' ' ' PRO . 2.7 Cg_endo -50.02 172.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.243 1.962 . . . . 0.0 111.225 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.703 ' O ' ' N ' ' A' ' 684' ' ' GLN . 60.3 Cg_exo -25.73 -65.52 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.267 2.645 . . . . 0.0 112.989 -179.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.66 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 91.9 m-20 54.11 -70.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.482 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 684' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 682' ' ' PRO . 7.1 tp60 103.37 -29.2 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.592 0.558 . . . . 0.0 111.113 179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 86.5 p -66.04 -42.05 90.06 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 90.6 m -65.98 -36.65 83.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 110.578 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.4 mt -64.59 -32.79 74.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.869 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.819 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.95 -36.01 74.94 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.038 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.719 HD22 HD22 ' A' ' 633' ' ' LEU . 6.3 tp -59.51 -47.38 85.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.378 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.458 HD13 HD12 ' A' ' 693' ' ' LEU . 4.6 mm? -61.76 -41.58 97.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.388 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.36 -42.78 96.5 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.623 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.528 ' ND1' HD13 ' A' ' 664' ' ' LEU . 5.7 t60 -58.07 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.569 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.458 HD12 HD13 ' A' ' 690' ' ' LEU . 88.2 mt -54.56 -42.75 71.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.115 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -65.11 -34.37 78.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.358 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.79 -36.54 78.4 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.487 ' CD2' ' HE2' ' A' ' 692' ' ' HIS . 2.0 m-70 -79.78 -51.25 9.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.423 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 699' ' ' ASP . 88.3 mt-30 -63.06 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.128 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . 59.04 -46.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.349 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.7 ' N ' ' O ' ' A' ' 697' ' ' GLN . 0.7 OUTLIER -70.62 143.8 90.4 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.089 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.471 ' O ' ' CB ' ' A' ' 701' ' ' HIS . 28.8 Cg_endo -65.13 154.16 74.81 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.983 2.455 . . . . 0.0 112.374 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.75 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 7.5 t-80 79.09 31.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.109 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 19.5 Cg_endo -60.95 162.58 18.64 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.605 2.204 . . . . 0.0 111.849 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 703' ' ' PRO . . . . . 0.439 ' HG2' ' NE2' ' A' ' 697' ' ' GLN . 2.6 Cg_endo -49.26 155.67 2.97 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.716 2.277 . . . . 0.0 111.596 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 27.0 mt -77.03 138.62 39.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.691 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 24.8 t -121.69 132.59 70.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.651 HD21 HG21 ' A' ' 737' ' ' THR . 67.9 mt -111.19 137.51 48.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.634 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -113.77 121.83 45.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.259 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.713 ' N ' HD12 ' A' ' 708' ' ' LEU . 4.1 mp -98.72 142.24 30.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.892 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 104.63 -134.3 11.93 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -92.14 157.29 41.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.946 0.403 . . . . 0.0 110.784 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -70.94 145.16 49.64 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.747 2.298 . . . . 0.0 111.719 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.72 145.81 70.67 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.636 2.224 . . . . 0.0 112.282 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.51 -40.09 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.7 144.53 86.03 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.373 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.38 -14.87 14.42 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 112.292 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.61 -32.21 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.652 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -76.67 -34.95 58.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.513 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 25.6 m -62.83 -41.88 99.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.782 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.82 92.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.032 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tp60 -75.95 -28.96 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.579 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.5 126.53 30.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.949 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 84.8 p -86.61 -24.18 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.85 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.602 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -170.78 126.75 0.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.386 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.5 mt -90.19 131.06 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.624 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.4 HD11 HD13 ' A' ' 706' ' ' LEU . 18.6 mt -107.52 155.78 19.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.902 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 2.2 p -166.48 60.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.921 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 727' ' ' LYS . . . . . 0.472 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 15.1 tttt 57.65 61.77 5.78 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.308 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.472 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 62.7 Cg_endo -86.42 145.41 8.2 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.535 ' C ' ' CG ' ' A' ' 730' ' ' ASP . 1.6 mp -67.11 151.66 47.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.51 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.679 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.0 OUTLIER 50.88 93.43 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.13 8.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.847 2.364 . . . . 0.0 111.794 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.679 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -68.02 -25.66 65.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.671 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.03 -46.78 79.89 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.618 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.451 ' C ' HD23 ' A' ' 734' ' ' LEU . 10.1 tt -58.57 -44.78 89.87 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 735' ' ' LEU . . . . . 0.462 HD23 ' C ' ' A' ' 735' ' ' LEU . 9.7 tt -61.73 -39.56 91.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.577 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 31.8 m -60.09 -36.85 78.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.101 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 737' ' ' THR . . . . . 0.651 HG21 HD21 ' A' ' 706' ' ' LEU . 44.6 m -60.56 -46.41 90.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.604 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.646 ' HG ' HG21 ' A' ' 674' ' ' VAL . 6.5 mp -65.45 -39.52 92.13 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.677 ' C ' ' H ' ' A' ' 741' ' ' LEU . 6.2 tp-100 -63.86 -28.02 69.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.367 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.68 2.86 0.01 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.677 ' H ' ' C ' ' A' ' 739' ' ' GLN . 20.0 tp -75.09 -36.67 61.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.1 m 54.32 68.8 2.47 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.159 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.27 116.24 3.59 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 122.198 1.932 . . . . 0.0 111.121 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -88.47 153.64 6.5 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.733 2.289 . . . . 0.0 112.282 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 28.4 t30 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 117.915 -1.04 . . . . 0.0 110.572 179.92 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 79.03 40.28 17.21 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -88.37 135.35 33.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.944 0.402 . . . . 0.0 110.64 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.592 HG23 HG13 ' A' ' 674' ' ' VAL . 90.9 mt -112.67 138.51 41.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.286 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 17.3 tp -107.49 127.59 53.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.402 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.55 HD23 ' C ' ' A' ' 632' ' ' LEU . 9.6 tt -131.63 123.41 27.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.664 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.468 ' CD1' HD13 ' A' ' 689' ' ' LEU . 47.9 mt -106.76 124.21 49.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.902 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.521 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.2 tt0 -159.47 163.53 35.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.672 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 78.5 tt0 -105.4 159.83 15.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.576 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.483 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 84.6 tt0 68.42 117.51 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.57 ' O ' ' OG1' ' A' ' 641' ' ' THR . 4.2 p30 -63.21 -34.58 77.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.669 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.93 -45.29 82.37 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.214 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.83 77.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.04 0.447 . . . . 0.0 110.127 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.548 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -66.44 -35.64 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.595 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.57 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.0 m -62.32 -46.63 87.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.694 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 55.2 t -56.91 -51.94 61.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.552 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.97 -48.1 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.667 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 656' ' ' TRP . 71.7 m -67.04 -30.53 70.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 645' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 641' ' ' THR . 51.2 tp10 -61.34 -43.39 98.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.024 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 9.1 mmt -67.28 -43.88 80.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.182 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.69 -45.98 77.07 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.92 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 26.8 m -56.34 -42.83 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.465 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.66 65.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.449 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.23 -4.99 28.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.365 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.55 -4.98 73.59 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.56 139.48 32.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -94.07 126.94 39.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.43 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.2 p -130.54 142.96 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.571 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 18.7 mm -108.19 122.89 63.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.329 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.548 ' CG ' ' HB1' ' A' ' 640' ' ' ALA . 19.5 t90 -95.75 117.07 29.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.766 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 66.0 mt -118.57 147.49 43.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 658' ' ' VAL . 3.6 p -110.12 20.64 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.265 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -149.44 123.67 9.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.677 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.35 -40.03 96.95 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.544 -0.623 . . . . 0.0 111.544 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 55.5 p -60.26 -38.72 84.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.081 0.467 . . . . 0.0 110.17 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.3 m -65.23 -35.46 81.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.902 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.78 -45.1 91.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.228 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 44.6 mt -59.75 -41.06 90.14 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.558 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -63.0 -42.72 99.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.425 ' O ' HD23 ' A' ' 670' ' ' LEU . 96.5 mm-40 -86.25 -42.6 13.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.973 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 663' ' ' ALA . 1.1 tt -45.24 -44.67 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.889 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.97 -34.54 76.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.513 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 50.8 mt -78.4 -45.94 21.11 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.4 OUTLIER -83.49 -13.55 54.38 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.183 -0.607 . . . . 0.0 112.07 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.456 ' C ' ' O ' ' A' ' 670' ' ' LEU . 1.5 mt-30 38.24 74.82 0.61 Allowed Pre-proline 0 C--N 1.327 -0.393 0 C-N-CA 120.375 -0.53 . . . . 0.0 109.997 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -76.89 146.39 26.08 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.84 2.36 . . . . 0.0 112.289 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 21.8 pt -92.55 -13.13 8.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.592 HG13 HG23 ' A' ' 630' ' ' ILE . 14.5 p -145.02 139.06 22.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.215 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.432 HD11 HE22 ' A' ' 697' ' ' GLN . 63.3 mt -124.16 125.09 70.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.934 0.397 . . . . 0.0 111.204 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.4 mp -105.26 136.9 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.431 ' CE ' HD12 ' A' ' 633' ' ' LEU . 92.5 mtp -140.36 117.58 11.29 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.731 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.405 ' C ' ' HD3' ' A' ' 680' ' ' PRO . . . -67.59 153.02 44.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.981 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.425 ' NE1' ' HA ' ' A' ' 712' ' ' PRO . 6.2 t-105 -120.98 57.97 6.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.209 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.444 ' O ' ' CB ' ' A' ' 683' ' ' ASP . 72.5 Cg_endo -77.0 152.78 31.97 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.891 2.394 . . . . 0.0 111.591 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.655 ' C ' ' H ' ' A' ' 683' ' ' ASP . 1.7 Cg_endo -51.11 -57.45 2.23 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.292 1.994 . . . . 0.0 112.523 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.487 ' HD2' ' CD ' ' A' ' 681' ' ' PRO . 10.0 Cg_endo -53.55 6.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.333 2.022 . . . . 0.0 111.987 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.655 ' H ' ' C ' ' A' ' 681' ' ' PRO . 56.8 t0 -76.45 148.93 36.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 684' ' ' GLN . . . . . 0.555 ' N ' ' OD1' ' A' ' 683' ' ' ASP . 10.3 pt20 -175.18 -43.85 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 34.1 t -64.09 -30.14 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.024 0.44 . . . . 0.0 110.382 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 87.6 m -58.84 -23.58 60.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.953 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.68 -37.97 89.36 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.508 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.697 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.8 OUTLIER -71.23 -39.55 71.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.941 -179.652 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.494 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 10.0 tt -60.84 -42.07 97.07 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.621 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 83.5 mt -60.48 -45.9 92.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.184 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -63.15 -40.99 99.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.199 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -60.27 -60.94 3.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.798 ' C ' HD12 ' A' ' 693' ' ' LEU . 0.4 OUTLIER -55.46 -39.87 70.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.5 ' N ' ' HG ' ' A' ' 693' ' ' LEU . 79.3 ttt180 -65.02 -33.86 77.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.026 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 695' ' ' GLU . . . . . 0.544 ' HG2' ' CD2' ' A' ' 696' ' ' HIS . 78.2 tt0 -65.64 -36.66 84.33 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.276 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.544 ' CD2' ' HG2' ' A' ' 695' ' ' GLU . 0.3 OUTLIER 165.81 72.95 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.117 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.432 HE22 HD11 ' A' ' 675' ' ' ILE . 64.0 tt0 -61.56 -52.07 65.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.923 0.392 . . . . 0.0 110.634 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.536 ' C ' ' OD1' ' A' ' 699' ' ' ASP . . . -158.34 -13.84 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.985 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.536 ' OD1' ' C ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER -174.74 160.55 2.5 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -179.672 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.1 -10.07 5.43 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.863 2.376 . . . . 0.0 112.276 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.474 ' ND1' ' N ' ' A' ' 701' ' ' HIS . 3.0 m80 -123.96 75.57 57.96 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.087 0.47 . . . . 0.0 110.818 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -54.25 149.71 35.79 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 123.055 2.503 . . . . 0.0 112.403 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.2 173.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.579 2.186 . . . . 0.0 111.784 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.706 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.3 OUTLIER -77.15 137.36 38.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.461 HG12 ' CE1' ' A' ' 707' ' ' PHE . 44.1 t -122.05 131.18 73.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.067 0.46 . . . . 0.0 111.896 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.749 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.8 mp -112.35 134.63 53.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.731 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 707' ' ' PHE . . . . . 0.461 ' CE1' HG12 ' A' ' 705' ' ' VAL . 90.2 m-85 -115.64 129.92 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.465 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.411 ' O ' ' N ' ' A' ' 679' ' ' TRP . 62.0 mt -106.11 140.49 39.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.884 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 117.32 -142.86 17.65 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -92.52 165.83 18.42 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.027 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.37 154.96 10.35 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.418 2.079 . . . . 0.0 112.022 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.425 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 17.0 Cg_endo -60.06 169.22 5.04 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 123.076 2.518 . . . . 0.0 112.129 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.561 HG12 ' O ' ' A' ' 713' ' ' VAL . 42.7 t -80.53 0.36 3.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.297 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 714' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -161.8 143.05 8.33 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.02 -10.98 25.11 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.694 2.263 . . . . 0.0 112.431 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.584 HD22 ' N ' ' A' ' 716' ' ' LEU . 3.5 mm? -69.52 -35.3 75.35 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.313 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.85 -31.43 59.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.8 m -60.98 -44.23 97.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.665 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.68 -37.12 85.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.871 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -77.37 -19.97 55.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.669 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.76 137.79 49.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.14 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.433 ' CB ' ' H ' ' A' ' 705' ' ' VAL . 67.3 m -86.26 -29.77 22.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.584 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.88 105.65 0.2 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 60.1 mt -93.13 129.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.658 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.476 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.4 mp -111.36 97.94 7.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 110.32 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 50.2 p -75.42 0.22 17.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.664 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 727' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -126.63 89.4 52.25 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.927 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.634 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 49.0 Cg_exo -51.99 154.65 9.86 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 123.016 2.477 . . . . 0.0 112.533 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.634 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 1.5 tp 98.15 -157.41 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.272 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 50.18 62.76 11.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.86 -19.43 62.02 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.445 2.097 . . . . 0.0 111.714 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.62 -36.31 65.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -70.13 -50.03 44.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.327 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 10.5 tp -58.02 -42.16 84.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.885 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 26.3 tp -62.84 -39.04 93.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.145 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.6 m -58.48 -47.62 83.47 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.412 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.9 m -65.15 -40.87 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.578 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.539 HD11 HG11 ' A' ' 674' ' ' VAL . 5.7 tt -64.09 -45.72 87.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.657 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.672 ' O ' ' N ' ' A' ' 741' ' ' LEU . 98.1 mt-30 -66.08 -27.7 68.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.103 0.478 . . . . 0.0 109.955 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 740' ' ' GLY . . . . . 0.505 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -27.75 -33.01 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.432 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.676 ' N ' HD12 ' A' ' 741' ' ' LEU . 6.3 mp -84.89 -73.05 0.45 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.852 0.358 . . . . 0.0 110.163 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.417 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 51.4 t 56.94 62.1 6.21 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.588 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 70.9 Cg_endo -82.92 117.01 2.54 Favored 'Trans proline' 0 C--N 1.303 -1.858 0 C-N-CA 122.569 2.179 . . . . 0.0 111.404 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -88.55 -8.79 5.15 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 122.639 2.226 . . . . 0.0 112.63 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 31.5 m120 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.527 179.984 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 72.13 124.84 0.07 OUTLIER Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -95.72 134.02 39.14 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 64.7 mt -116.92 136.71 53.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 120.966 0.413 . . . . 0.0 110.461 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.927 HD22 ' CD1' ' A' ' 667' ' ' LEU . 21.1 tp -104.66 129.96 52.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.659 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 8.0 tt -127.47 121.96 32.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.183 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.869 HD12 ' O ' ' A' ' 657' ' ' LEU . 12.2 tp -110.17 121.51 45.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.429 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.541 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 85.9 tt0 -159.47 165.97 31.93 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.195 -0.602 . . . . 0.0 111.345 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.541 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 94.4 mt-10 -107.62 160.65 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.97 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 71.31 108.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 27.1 p-10 -57.19 -37.74 72.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.073 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.596 ' O ' HG23 ' A' ' 642' ' ' VAL . 85.7 tt0 -63.76 -43.15 97.26 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.857 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.6 -36.92 70.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.483 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.04 -42.64 80.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.023 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 645' ' ' GLU . 31.6 m -63.26 -45.84 89.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.801 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 638' ' ' GLU . 86.5 t -56.62 -53.55 39.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.825 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.05 -47.59 92.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.403 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.525 ' O ' ' OG1' ' A' ' 648' ' ' THR . 70.2 m -65.35 -29.91 70.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.111 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 645' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 641' ' ' THR . 73.8 tt0 -61.55 -45.81 92.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.671 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 92.0 mmm -70.27 -42.86 71.54 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.784 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.616 ' CB ' HG21 ' A' ' 654' ' ' VAL . 73.5 mt -66.73 -43.01 85.36 Favored 'General case' 0 CA--C 1.522 -0.121 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.525 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 83.5 m -55.71 -40.15 72.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.28 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.81 -21.2 61.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.531 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 650' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 647' ' ' LEU . . . -65.19 -5.1 6.03 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.809 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 102.45 -19.23 48.81 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -98.46 152.32 19.65 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.98 129.65 37.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.988 0.423 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.616 HG21 ' CB ' ' A' ' 647' ' ' LEU . 16.2 t -119.85 133.21 67.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 27.1 mm -108.95 135.87 46.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.61 ' C ' HD22 ' A' ' 657' ' ' LEU . 23.3 t90 -89.85 114.02 25.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.514 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.869 ' O ' HD12 ' A' ' 633' ' ' LEU . 4.6 mm? -112.27 136.24 51.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.047 0.451 . . . . 0.0 110.288 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.61 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 4.4 p -117.42 19.95 6.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.994 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.61 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 89.4 m-20 -150.62 174.27 13.17 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.457 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -105.14 -63.47 0.65 Allowed Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.421 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 23.0 t -57.69 -36.99 72.69 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 51.1 m -62.86 -39.34 94.1 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.552 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.59 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -63.46 -39.67 95.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.585 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 664' ' ' LEU . 61.9 mt -59.34 -39.42 83.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.003 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.78 -47.5 83.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.379 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -89.71 -42.68 11.19 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.683 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.927 ' CD1' HD22 ' A' ' 631' ' ' LEU . 8.6 tt -50.13 -36.78 31.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.041 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -56.22 -36.66 68.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.844 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 39.4 mt -77.47 -26.41 51.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.304 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 37.6 mt -73.05 -32.93 65.38 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.687 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.446 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 39.3 mm-40 46.3 58.87 16.15 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-O 121.207 0.527 . . . . 0.0 110.167 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.446 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 50.9 Cg_endo -74.06 150.07 42.48 Favored 'Trans proline' 0 C--N 1.302 -1.921 0 C-N-CA 123.459 2.773 . . . . 0.0 112.83 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.747 HG13 HG23 ' A' ' 674' ' ' VAL . 24.6 pt -100.54 -19.49 5.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.747 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.747 HG23 HG13 ' A' ' 673' ' ' ILE . 76.8 t -137.12 137.51 46.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.416 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 631' ' ' LEU . 65.9 mt -127.25 118.65 50.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 8.8 tt -105.1 130.81 53.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.838 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.449 ' HE3' HD22 ' A' ' 689' ' ' LEU . 61.4 mtt -138.53 133.1 32.18 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.481 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -71.0 150.84 45.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.695 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.783 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -116.88 -24.79 0.1 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 C-N-CA 120.274 -0.571 . . . . 0.0 112.302 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.783 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -48.61 -39.71 37.6 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 121.887 1.724 . . . . 0.0 113.14 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 15.0 Cg_exo -65.43 155.29 69.57 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.653 1.568 . . . . 0.0 111.799 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -53.55 -19.41 13.7 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.284 1.989 . . . . 0.0 112.093 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 61.55 161.2 0.07 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.507 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 179.77 -80.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.148 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 31.3 m -63.11 -32.87 74.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.573 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 5.9 p -60.94 -24.12 65.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.748 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.44 -35.3 80.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.559 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 1.0 OUTLIER -73.47 -37.77 65.65 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.308 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.559 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 8.4 tt -61.7 -46.94 87.54 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.79 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.402 HD21 ' SD ' ' A' ' 677' ' ' MET . 82.6 mt -63.04 -42.42 99.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.515 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.12 -39.59 93.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.828 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -57.9 -53.55 56.92 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.801 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 697' ' ' GLN . 57.0 mt -55.82 -37.68 69.0 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.531 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.674 ' NE ' ' OE1' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.78 -40.28 94.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.52 -39.2 77.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.754 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.413 ' O ' ' HG3' ' A' ' 700' ' ' PRO . 0.3 OUTLIER -100.16 8.07 44.11 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.721 -179.578 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.428 ' OE1' ' CZ ' ' A' ' 694' ' ' ARG . 24.5 pt20 -52.69 -19.39 2.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.643 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -87.25 118.77 26.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.817 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.643 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 44.6 t0 107.17 -39.99 0.0 OUTLIER Pre-proline 0 N--CA 1.47 0.548 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.482 ' CD ' ' C ' ' A' ' 698' ' ' ALA . 72.4 Cg_endo -84.13 -158.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.936 1.757 . . . . 0.0 112.072 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -116.23 90.55 29.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.642 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -43.95 108.87 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.617 0 C-N-CA 122.966 2.444 . . . . 0.0 112.589 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -74.81 151.14 40.13 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.164 1.91 . . . . 0.0 112.069 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 48.0 mt -74.95 139.97 43.38 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' A' ' 722' ' ' SER . 46.1 t -123.73 129.04 74.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.918 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.552 ' C ' HD23 ' A' ' 706' ' ' LEU . 9.2 tt -116.22 133.58 55.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.935 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 707' ' ' PHE . . . . . 0.515 ' N ' HD23 ' A' ' 706' ' ' LEU . 97.2 m-85 -116.22 137.51 52.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.01 0.434 . . . . 0.0 111.614 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 708' ' ' LEU . 80.6 mt -99.77 154.76 18.06 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.037 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 84.89 -132.9 11.38 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -87.21 151.83 51.96 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 0.0 111.076 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.21 165.38 19.73 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 123.059 2.506 . . . . 0.0 112.325 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -62.51 160.47 31.75 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.868 2.378 . . . . 0.0 112.138 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.538 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.1 t -91.06 23.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.472 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 714' ' ' ASP . . . . . 0.538 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 12.7 m-20 -161.3 141.71 8.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.038 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.27 -15.62 35.22 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.801 2.334 . . . . 0.0 112.972 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.535 ' H ' HD12 ' A' ' 716' ' ' LEU . 5.9 mp -69.77 -35.28 74.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.024 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 89.1 mt -75.46 -31.53 60.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 45.4 m -64.22 -43.91 93.52 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.14 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.12 -40.11 95.49 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.088 0.47 . . . . 0.0 109.956 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.674 ' OE1' ' NE ' ' A' ' 694' ' ' ARG . 31.8 tt0 -73.62 -29.28 62.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.813 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -68.59 140.45 55.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.94 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 705' ' ' VAL . 34.5 t -87.28 -28.13 22.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.292 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.68 168.54 6.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.186 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 53.2 mt -151.17 113.01 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.624 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.6 mp -105.89 136.53 45.37 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.132 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.0 t -69.17 -81.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -103.39 128.36 27.68 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.64 142.29 52.75 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 121.997 1.798 . . . . 0.0 112.006 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 20.2 tp -176.38 138.8 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.404 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.4 OUTLIER 57.72 74.13 0.68 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.763 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.92 -5.19 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.492 2.128 . . . . 0.0 111.691 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.568 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -69.84 -30.26 67.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.219 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.7 -45.31 79.21 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 25.5 tp -57.26 -41.66 80.09 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.3 -40.37 96.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.208 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 87.9 m -59.28 -40.64 86.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.292 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 26.1 m -61.08 -41.76 97.25 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.154 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.37 -44.29 95.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.012 0.434 . . . . 0.0 110.374 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.519 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.7 mm-40 -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.568 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -59.0 4.77 0.09 OUTLIER Glycine 0 CA--C 1.529 0.914 0 C-N-CA 121.211 -0.519 . . . . 0.0 111.92 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.519 ' H ' ' C ' ' A' ' 739' ' ' GLN . 27.0 tp -81.76 -29.57 32.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.0 0.4 . . . . 0.0 110.284 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.48 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 23.5 t 63.55 61.71 1.72 Allowed Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.345 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.48 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 58.7 Cg_endo -86.65 117.52 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.714 2.276 . . . . 0.0 110.929 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -85.83 150.02 9.79 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.514 2.142 . . . . 0.0 112.677 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.92 -1.038 . . . . 0.0 110.416 179.338 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -76.59 148.24 35.1 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -94.84 139.04 31.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.863 0.363 . . . . 0.0 111.296 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.498 ' CG2' HD13 ' A' ' 676' ' ' LEU . 89.9 mt -114.3 145.56 19.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.289 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.898 HD22 HD12 ' A' ' 667' ' ' LEU . 10.1 tp -107.69 134.5 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.765 0.317 . . . . 0.0 110.69 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' ' 633' ' ' LEU . 0.2 OUTLIER -129.13 116.9 19.93 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 632' ' ' LEU . 6.6 tt -109.41 120.38 42.32 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.505 ' N ' HD23 ' A' ' 633' ' ' LEU . 85.6 tt0 -159.41 153.96 24.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.479 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.658 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 82.6 tt0 -112.68 138.81 48.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.174 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.658 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 81.8 tt0 106.02 115.62 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.69 0.619 . . . . 0.0 110.381 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -60.65 -37.08 80.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.044 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -67.46 -50.1 60.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.301 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.37 87.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.973 0.416 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.641 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.54 -38.78 81.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.808 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 53.1 m -62.67 -44.39 96.37 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.782 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.85 -54.05 34.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.458 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.81 -41.26 87.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.452 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.772 ' SG ' ' CZ3' ' A' ' 656' ' ' TRP . 91.3 m -55.78 -43.47 76.8 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.454 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.17 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 90.1 mtp -68.08 -50.73 53.22 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.594 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 650' ' ' ALA . 74.8 mt -68.25 -43.54 77.65 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.143 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 90.5 m -56.43 -42.27 77.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.98 -28.7 69.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.372 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 650' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 647' ' ' LEU . . . -63.51 -17.03 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 86.5 2.68 84.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -95.04 149.17 21.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.052 0.453 . . . . 0.0 111.002 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -92.22 123.47 35.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.848 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.434 HG12 ' HB ' ' A' ' 630' ' ' ILE . 5.4 m -126.34 150.05 31.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.815 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 26.9 mm -108.49 125.45 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.772 ' CZ3' ' SG ' ' A' ' 644' ' ' CYS . 0.5 OUTLIER -95.24 125.71 40.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 111.383 -179.073 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 663' ' ' ALA . 86.7 mt -124.45 143.52 50.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.457 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 7.6 m -101.15 2.91 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.048 0.452 . . . . 0.0 109.989 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.406 ' OD1' ' C ' ' A' ' 659' ' ' ASP . 57.1 p30 -153.21 173.62 15.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.909 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.415 ' O ' ' HG ' ' A' ' 664' ' ' LEU . . . -102.23 -35.25 3.96 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.144 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 13.3 m -55.8 -44.29 77.68 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.863 0.363 . . . . 0.0 110.959 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 70.2 m -62.69 -36.78 84.03 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.66 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.25 -38.7 92.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.597 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 660' ' ' GLY . 18.3 mt -57.75 -47.68 81.8 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.881 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -63.83 -40.86 97.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.532 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -89.78 -54.56 4.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.947 0.403 . . . . 0.0 111.757 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.898 HD12 HD22 ' A' ' 631' ' ' LEU . 8.1 tt -45.05 -39.17 5.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.73 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -55.33 -37.28 67.21 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.535 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.17 -30.94 49.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.627 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 13.9 mt -71.91 -38.45 69.91 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.636 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 48.01 66.34 5.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -78.36 160.64 29.04 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 123.133 2.556 . . . . 0.0 113.156 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 74.7 mt -96.25 -23.03 4.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.098 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 40.6 t -143.73 140.12 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 120.872 0.368 . . . . 0.0 111.114 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.864 HG22 ' SD ' ' A' ' 677' ' ' MET . 76.0 mt -126.46 121.89 59.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.032 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 676' ' ' LEU . 2.8 mp -114.75 133.91 55.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.864 ' SD ' HG22 ' A' ' 675' ' ' ILE . 3.5 mpp? -138.87 139.17 38.02 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.54 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.24 146.16 53.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.603 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.776 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -132.1 14.25 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.776 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 6.6 Cg_exo -50.89 -44.17 43.13 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 121.423 1.415 . . . . 0.0 112.353 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 40.7 Cg_endo -86.88 164.31 8.91 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 123.098 2.532 . . . . 0.0 112.827 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -71.04 -65.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.969 2.446 . . . . 0.0 111.937 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.462 ' OD1' ' O ' ' A' ' 683' ' ' ASP . 50.2 p30 -82.5 156.91 23.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 684' ' ' GLN . . . . . 0.515 ' O ' HD12 ' A' ' 687' ' ' LEU . 49.5 tt0 -177.48 135.96 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.381 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 685' ' ' SER . . . . . 0.428 ' C ' ' N ' ' A' ' 687' ' ' LEU . 37.0 m -61.18 -27.99 68.81 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.856 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.718 ' SG ' ' CZ3' ' A' ' 679' ' ' TRP . 25.8 p -52.84 -14.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.01 0.434 . . . . 0.0 109.867 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 687' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 684' ' ' GLN . 32.3 mt -64.22 -38.92 92.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.777 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.495 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 2.3 pp -70.46 -35.59 73.4 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.495 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 22.4 tp -57.84 -42.95 85.46 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.308 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.426 HD23 HD12 ' A' ' 693' ' ' LEU . 47.1 mt -62.18 -36.46 81.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.021 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 691' ' ' GLN . . . . . 0.412 ' HG3' HH21 ' A' ' 694' ' ' ARG . 49.8 tt0 -56.79 -41.75 78.27 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.434 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 29.3 t-80 -59.96 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.292 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 697' ' ' GLN . 40.8 mt -54.81 -40.36 69.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.718 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.412 HH21 ' HG3' ' A' ' 691' ' ' GLN . 66.2 mtm180 -63.97 -35.45 80.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -69.38 -35.94 76.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.012 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.616 ' CG ' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER -104.33 5.28 34.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.216 -179.122 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 693' ' ' LEU . 48.6 tt0 -58.45 -7.37 0.89 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.031 0.443 . . . . 0.0 110.144 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.416 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . -81.86 1.03 36.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.563 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.22 144.79 95.49 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.037 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.74 -8.29 17.23 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.621 2.214 . . . . 0.0 112.836 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -126.8 68.99 71.27 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.825 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -44.99 107.87 0.12 Allowed 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.598 2.199 . . . . 0.0 111.898 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.62 135.86 63.28 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.312 2.008 . . . . 0.0 112.45 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.711 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.5 mp -80.87 141.91 34.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.998 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.795 HG23 ' O ' ' A' ' 675' ' ' ILE . 14.6 p -130.57 136.3 58.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.336 0.588 . . . . 0.0 110.998 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.819 HD12 ' O ' ' A' ' 723' ' ' ALA . 12.4 tp -118.45 133.1 56.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.948 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -110.02 130.33 55.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.014 0.435 . . . . 0.0 111.487 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.67 147.0 25.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.414 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 99.05 -131.58 10.62 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.639 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.2 162.92 35.98 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.21 151.93 20.85 Favored 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.631 2.22 . . . . 0.0 112.616 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.404 ' CB ' ' HB2' ' A' ' 717' ' ' LEU . 58.5 Cg_exo -45.06 171.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.891 2.394 . . . . 0.0 112.868 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 713' ' ' VAL . 96.9 t -83.63 3.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 714' ' ' ASP . . . . . 0.533 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -161.68 152.77 15.3 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.029 0.443 . . . . 0.0 110.817 -179.588 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -69.63 -8.8 24.53 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.941 2.427 . . . . 0.0 112.41 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.45 -34.35 74.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.665 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 1.6 mm? -77.22 -36.04 55.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.7 m -62.56 -41.78 99.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.864 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.95 92.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.209 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -75.59 -28.9 59.1 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 721' ' ' ALA . . . . . 0.419 ' HA ' ' CG1' ' A' ' 705' ' ' VAL . . . -69.67 153.78 42.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.849 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 57.6 p -85.18 -31.61 23.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.819 ' O ' HD12 ' A' ' 706' ' ' LEU . . . -174.35 151.1 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.403 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.463 ' C ' HD12 ' A' ' 725' ' ' LEU . 65.6 mt -133.15 127.91 55.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.93 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.797 ' CD1' HD11 ' A' ' 706' ' ' LEU . 8.9 mp -105.09 158.8 16.32 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.86 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.43 9.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.518 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 727' ' ' LYS . . . . . 0.46 ' CB ' ' HZ3' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -132.85 92.58 25.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.498 179.633 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.52 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 53.2 Cg_exo -47.48 149.18 4.69 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.611 2.208 . . . . 0.0 112.415 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 59.3 mt 98.85 172.99 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.132 0.895 . . . . 0.0 110.148 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 61.77 62.81 2.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.054 179.82 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -64.36 -8.46 16.92 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.918 2.412 . . . . 0.0 112.272 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -69.4 -29.71 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.209 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 11.4 tp -66.63 -43.01 85.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.461 ' CD1' HD22 ' A' ' 706' ' ' LEU . 53.0 tp -57.97 -43.72 86.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.301 179.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.08 -38.6 86.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 75.5 m -57.66 -41.46 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.3 m -62.23 -46.46 88.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.497 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 63.1 mt -66.06 -40.12 90.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 741' ' ' LEU . 41.9 tt0 -66.21 -21.04 66.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.593 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.1 -2.73 0.01 OUTLIER Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.664 ' N ' ' O ' ' A' ' 739' ' ' GLN . 69.7 mt -84.11 -75.93 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 6.3 t 56.91 60.73 7.17 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.25 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -79.46 116.8 3.62 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.122 1.881 . . . . 0.0 110.934 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.66 144.44 11.21 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.59 2.193 . . . . 0.0 112.705 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 2.3 m120 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.491 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 141.35 153.43 5.95 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 629' ' ' HIS . . . . . 0.433 ' HB2' HD11 ' A' ' 670' ' ' LEU . 72.9 m80 -94.64 136.75 34.58 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.499 ' CD1' HD22 ' A' ' 647' ' ' LEU . 75.6 mt -117.19 135.74 56.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.874 0.369 . . . . 0.0 111.054 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.555 HD13 HD12 ' A' ' 667' ' ' LEU . 8.4 tt -109.03 128.65 55.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.784 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.711 HD23 ' C ' ' A' ' 632' ' ' LEU . 8.6 tt -127.16 127.38 44.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.952 0.406 . . . . 0.0 111.913 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.497 ' N ' HD23 ' A' ' 632' ' ' LEU . 44.6 tp -108.74 111.76 23.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.768 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.842 ' OE1' ' HB2' ' A' ' 678' ' ' ALA . 45.9 tp10 -160.28 156.9 27.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.933 0.397 . . . . 0.0 111.229 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 634' ' ' GLU . 85.4 tt0 -96.53 156.25 16.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.942 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.475 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 77.6 tt0 71.72 119.57 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.262 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 40.9 p-10 -62.99 -31.91 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.534 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.3 mt-10 -65.0 -40.83 95.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.336 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.84 62.3 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.918 0.389 . . . . 0.0 110.644 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -62.06 -35.28 78.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.946 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.41 ' O ' ' N ' ' A' ' 645' ' ' GLU . 86.6 m -62.79 -44.82 95.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.935 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 43.5 t -55.19 -53.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.448 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 58.4 t -60.77 -43.26 94.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.207 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.0 OUTLIER -67.39 -30.67 70.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.921 -179.676 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 645' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 641' ' ' THR . 41.6 tp10 -61.4 -45.49 94.11 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.163 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 93.6 mmm -65.3 -44.29 88.39 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.912 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.936 HD21 HD21 ' A' ' 734' ' ' LEU . 34.6 mt -67.71 -43.45 80.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.252 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.5 m -55.9 -42.04 75.42 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -62.83 -32.34 73.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.329 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.43 -6.34 45.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.827 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 92.46 -0.21 70.82 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.293 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -91.61 148.25 22.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 117.073 0.436 . . . . 0.0 110.829 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -91.05 130.73 36.92 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.68 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.437 HG21 ' HB2' ' A' ' 647' ' ' LEU . 24.6 t -116.86 137.06 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.257 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.42 127.13 66.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.703 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -95.49 114.51 26.28 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 111.355 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 53.1 mt -116.46 145.23 43.44 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 2.4 p -116.17 10.86 7.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.183 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -149.64 128.25 12.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.459 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.472 ' HA2' HD23 ' A' ' 689' ' ' LEU . . . -61.49 -38.09 95.22 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 m -59.2 -38.59 80.24 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.843 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 86.4 m -63.91 -40.31 96.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.859 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.7 -41.88 98.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.848 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.511 HD22 ' CE1' ' A' ' 692' ' ' HIS . 54.3 mt -59.2 -43.5 92.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -63.94 -38.75 92.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.376 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 670' ' ' LEU . 83.7 mt-30 -89.68 -49.86 6.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.083 0.468 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.1 tt -46.08 -46.2 16.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.427 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 668' ' ' ASP . . . . . 0.597 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 52.3 t0 -62.6 -41.08 98.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 72.7 mt -77.2 -36.88 54.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.361 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 1.052 HD12 ' O ' ' A' ' 670' ' ' LEU . 0.1 OUTLIER -82.25 -39.99 22.23 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.137 -179.327 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 3.4 mt-30 54.08 75.38 0.63 Allowed Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 121.262 0.553 . . . . 0.0 110.236 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.33 165.3 32.13 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 123.684 2.923 . . . . 0.0 112.463 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 75.3 mt -93.25 -26.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.163 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.426 HG13 HG23 ' A' ' 630' ' ' ILE . 10.9 p -142.68 138.62 28.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.069 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 71.9 mt -116.6 129.42 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.179 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 706' ' ' LEU . 0.0 OUTLIER -106.5 130.43 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 38.9 ttm -141.08 137.59 32.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.317 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.842 ' HB2' ' OE1' ' A' ' 634' ' ' GLU . . . -67.66 153.06 44.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.495 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.76 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 37.9 t-105 -103.53 -19.82 0.19 Allowed Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.788 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.76 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 85.9 Cg_endo -85.51 121.45 2.24 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.966 1.778 . . . . 0.0 110.937 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -74.94 111.97 3.45 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.422 2.081 . . . . 0.0 112.748 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.8 -18.49 2.96 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.833 2.355 . . . . 0.0 111.061 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.531 ' O ' ' HB2' ' A' ' 684' ' ' GLN . 22.3 t70 -160.31 -11.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.43 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 684' ' ' GLN . . . . . 0.531 ' HB2' ' O ' ' A' ' 683' ' ' ASP . 90.3 mt-30 100.89 2.03 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 O-C-N 124.092 0.87 . . . . 0.0 110.873 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 21.9 m -65.13 -37.67 88.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.77 0.319 . . . . 0.0 111.158 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 78.8 m -62.13 -34.22 75.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.95 -32.83 74.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.186 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.2 -37.13 77.95 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.237 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.623 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.2 OUTLIER -62.16 -41.55 98.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.245 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.799 HD13 ' C ' ' A' ' 690' ' ' LEU . 3.0 tm? -59.82 -40.63 89.1 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.47 -42.63 96.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.781 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.511 ' CE1' HD22 ' A' ' 664' ' ' LEU . 24.0 t-80 -57.73 -50.18 74.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.505 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.447 HD13 HG21 ' A' ' 705' ' ' VAL . 79.4 mt -54.95 -39.74 69.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.558 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -62.74 -33.55 75.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.646 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -67.5 -35.99 80.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.084 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 24.2 m80 -91.13 -3.36 57.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.212 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 697' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -58.92 -11.89 3.87 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.925 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -84.75 0.73 49.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 110.681 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.36 166.36 35.54 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.324 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -56.62 -54.99 3.09 Favored 'Trans proline' 0 C--N 1.308 -1.576 0 C-N-CA 122.214 1.943 . . . . 0.0 111.959 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -135.87 72.9 61.17 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.827 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -48.4 158.23 1.1 Allowed 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.637 2.225 . . . . 0.0 111.874 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.19 151.56 43.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.816 2.344 . . . . 0.0 112.021 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.8 mp -77.51 140.13 39.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.138 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 722' ' ' SER . 44.4 t -120.29 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.113 0.482 . . . . 0.0 111.097 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.624 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 5.5 mp -118.84 134.63 55.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -110.05 130.93 55.46 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.947 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.668 HD12 ' C ' ' A' ' 708' ' ' LEU . 0.9 OUTLIER -101.05 140.48 35.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 709' ' ' GLY . . . . . 0.429 ' N ' HD12 ' A' ' 708' ' ' LEU . . . 119.12 -131.77 9.25 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 158.24 48.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.768 0.318 . . . . 0.0 110.352 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -75.14 116.31 4.52 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.786 2.324 . . . . 0.0 112.127 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.45 ' HD2' HD13 ' A' ' 724' ' ' ILE . 51.5 Cg_exo -49.88 142.59 25.8 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.048 . . . . 0.0 111.997 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 93.3 t -82.75 -20.09 9.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.811 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.4 128.22 89.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.673 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -73.14 -30.14 10.95 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.213 1.942 . . . . 0.0 111.635 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.86 -35.12 69.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.208 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.613 ' CD2' ' CZ3' ' A' ' 679' ' ' TRP . 66.1 tp -73.3 -37.7 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.55 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 718' ' ' THR . . . . . 0.493 HG23 HD11 ' A' ' 724' ' ' ILE . 33.2 m -63.48 -40.07 96.14 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.857 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.09 89.82 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.352 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -74.69 -29.62 61.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.441 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -69.13 139.59 54.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.522 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.616 ' N ' ' O ' ' A' ' 705' ' ' VAL . 80.5 p -85.25 -28.59 25.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.502 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.624 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -173.93 121.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.208 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.493 HD11 HG23 ' A' ' 718' ' ' THR . 54.3 mt -91.65 124.14 44.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.893 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.582 HD11 HD13 ' A' ' 734' ' ' LEU . 59.9 mt -103.14 124.37 48.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.726 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 5.1 m -72.93 -79.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.746 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -142.84 167.4 16.21 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.176 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -60.99 119.65 6.92 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 121.81 1.673 . . . . 0.0 111.477 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.691 ' O ' HD23 ' A' ' 729' ' ' LEU . 7.1 tt -178.65 -40.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.823 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 730' ' ' ASP . 0.0 OUTLIER -129.82 72.17 81.99 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.955 0.407 . . . . 0.0 110.909 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -71.55 7.49 1.52 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.866 2.378 . . . . 0.0 111.9 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.478 ' HG3' ' N ' ' A' ' 733' ' ' LEU . 21.5 pt20 -71.92 -36.22 69.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.455 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 733' ' ' LEU . . . . . 0.478 ' N ' ' HG3' ' A' ' 732' ' ' GLN . 14.4 tp -66.93 -42.91 84.54 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.078 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.936 HD21 HD21 ' A' ' 647' ' ' LEU . 14.2 tp -56.63 -50.14 72.91 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.42 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 85.6 mt -62.27 -37.12 84.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.147 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 66.1 m -59.0 -40.33 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.349 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 86.5 m -61.26 -47.5 85.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.622 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.529 HD12 ' N ' ' A' ' 738' ' ' LEU . 7.0 mp -66.28 -45.08 81.69 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.511 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -66.35 -28.21 68.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.276 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.25 -36.9 16.94 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 78.8 mt -79.78 -37.93 34.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 49.05 63.99 9.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.573 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -81.24 116.49 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 C-N-CA 122.154 1.903 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -88.42 -3.41 6.74 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.51 2.14 . . . . 0.0 112.188 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.518 -179.824 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 103.28 68.77 0.79 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -89.81 136.1 33.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.773 0.321 . . . . 0.0 110.525 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.4 mm -112.11 134.78 53.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.661 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.689 ' CD2' HD12 ' A' ' 667' ' ' LEU . 56.1 tp -114.11 136.01 53.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.746 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.827 HD23 ' C ' ' A' ' 632' ' ' LEU . 6.8 tt -133.96 125.1 27.51 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.038 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.742 ' N ' HD23 ' A' ' 632' ' ' LEU . 9.3 tt -118.9 127.74 53.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.751 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.796 ' CD ' ' HB2' ' A' ' 640' ' ' ALA . 0.0 OUTLIER -159.06 171.57 19.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 0.0 111.028 -179.509 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -107.33 163.2 13.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.28 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 66.75 118.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.402 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -58.21 -37.33 74.61 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.185 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -64.91 -41.82 95.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.083 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -65.45 -39.11 91.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.906 0.384 . . . . 0.0 110.448 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.796 ' HB2' ' CD ' ' A' ' 634' ' ' GLU . . . -66.7 -39.51 88.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.727 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 59.6 m -62.06 -47.05 86.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.006 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.6 t -57.38 -53.67 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 643' ' ' VAL . . . . . 0.665 HG11 HD11 ' A' ' 632' ' ' LEU . 61.1 t -60.53 -42.82 92.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.904 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.656 ' SG ' ' O ' ' A' ' 640' ' ' ALA . 74.9 m -56.89 -36.78 70.52 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -62.35 -40.07 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.293 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 16.3 mmt -65.38 -50.25 66.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.962 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.605 ' N ' HD12 ' A' ' 647' ' ' LEU . 10.0 mp -70.35 -45.55 65.88 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.434 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 48.5 m -55.87 -42.98 76.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.038 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.06 65.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.581 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.42 -11.3 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.18 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.12 -3.88 67.14 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.73 149.24 21.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.647 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -93.36 127.73 39.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.019 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.5 p -126.52 142.0 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.966 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 655' ' ' ILE . . . . . 0.424 HG22 ' CD2' ' A' ' 657' ' ' LEU . 14.9 mm -103.5 133.67 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.726 ' C ' HD22 ' A' ' 657' ' ' LEU . 16.4 t90 -91.42 112.82 24.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.979 0.418 . . . . 0.0 111.509 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.726 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.8 mm? -111.93 138.49 48.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.89 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 35.4 m -110.88 8.51 8.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.465 ' C ' HD11 ' A' ' 633' ' ' LEU . 18.6 t70 -150.48 130.82 13.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.51 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.449 ' CA ' HD23 ' A' ' 689' ' ' LEU . . . -63.63 -45.09 95.42 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.269 -0.491 . . . . 0.0 111.99 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 19.8 m -60.84 -44.71 96.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 111.117 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.9 m -64.55 -35.15 80.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.04 -43.19 99.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.465 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.906 HD22 ' ND1' ' A' ' 692' ' ' HIS . 90.8 mt -59.73 -47.26 86.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.348 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 665' ' ' ASP . . . . . 0.554 ' OD1' ' C ' ' A' ' 665' ' ' ASP . 0.5 OUTLIER -64.48 -37.55 87.92 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.97 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.544 ' N ' ' OD1' ' A' ' 665' ' ' ASP . 75.4 mt-30 -83.36 -43.77 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.702 HD23 ' C ' ' A' ' 667' ' ' LEU . 9.8 tt -48.57 -36.46 15.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.48 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -54.62 -39.83 68.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.022 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 73.6 mt -78.3 -27.65 47.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.357 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 15.7 mt -73.06 -38.82 66.33 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.594 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.437 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.4 mm-40 46.35 63.74 9.3 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 74.4 Cg_endo -83.56 152.95 13.54 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 C-N-CA 123.227 2.618 . . . . 0.0 112.61 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.77 HG23 HG23 ' A' ' 674' ' ' VAL . 19.5 tt -93.46 -18.75 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.272 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.77 HG23 HG23 ' A' ' 673' ' ' ILE . 59.7 t -145.24 137.57 20.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.01 0.434 . . . . 0.0 110.938 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.428 ' O ' HG23 ' A' ' 705' ' ' VAL . 59.3 mt -126.08 122.49 61.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.011 -179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.616 HD12 ' N ' ' A' ' 676' ' ' LEU . 4.5 mp -109.66 133.73 52.78 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 76.1 mtm -144.69 133.79 22.76 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.987 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 680' ' ' PRO . . . -66.14 154.13 40.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.786 178.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -117.05 80.45 11.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.78 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.409 ' C ' ' HD2' ' A' ' 682' ' ' PRO . 90.1 Cg_endo -94.7 114.61 0.19 Allowed 'Trans proline' 0 C--N 1.31 -1.489 0 C-N-CA 123.426 2.751 . . . . 0.0 112.142 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.55 ' N ' ' CD ' ' A' ' 682' ' ' PRO . 20.3 Cg_exo -53.79 -42.59 65.1 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.207 1.938 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.599 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 31.9 Cg_exo -52.73 -5.17 0.17 Allowed 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.02 1.813 . . . . 0.0 111.033 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.599 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 83.2 m-20 -150.44 73.67 1.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.874 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.16 8.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.629 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 685' ' ' SER . . . . . 0.539 ' H ' ' C ' ' A' ' 683' ' ' ASP . 43.8 m -59.75 -27.47 66.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.806 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.421 ' O ' HD23 ' A' ' 690' ' ' LEU . 85.6 m -57.01 -23.19 44.49 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.539 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 82.0 mt -63.76 -32.92 74.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.363 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.655 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.7 OUTLIER -69.68 -36.28 75.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.468 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.634 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.2 OUTLIER -61.63 -43.24 99.23 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.514 HD11 ' CZ ' ' A' ' 707' ' ' PHE . 3.8 mm? -60.83 -36.87 80.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.01 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -60.05 -43.55 95.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.906 ' ND1' HD22 ' A' ' 664' ' ' LEU . 15.5 t-80 -59.15 -49.75 76.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.511 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.14 -40.38 70.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.29 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.413 ' NH2' HD21 ' A' ' 717' ' ' LEU . 37.8 ttm180 -61.99 -33.8 74.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.985 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -67.08 -33.78 76.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.416 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.574 ' O ' ' OD1' ' A' ' 699' ' ' ASP . 96.1 m-70 -100.66 5.98 43.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.626 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 697' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -57.1 -4.47 0.19 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.421 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.484 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . -84.52 4.65 30.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.164 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 696' ' ' HIS . 1.0 OUTLIER -70.4 145.66 93.31 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.264 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -67.52 -15.8 45.85 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.653 2.235 . . . . 0.0 113.028 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.494 ' ND1' ' N ' ' A' ' 701' ' ' HIS . 0.0 OUTLIER -127.06 69.01 73.03 Favored Pre-proline 0 C--N 1.329 -0.319 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.386 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -46.14 113.25 0.57 Allowed 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.687 2.258 . . . . 0.0 111.576 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.81 146.2 23.36 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.798 2.332 . . . . 0.0 113.201 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.712 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.4 mp -81.5 143.89 31.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.659 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.662 ' C ' HD12 ' A' ' 706' ' ' LEU . 12.3 p -133.25 137.89 52.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.53 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.851 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.3 mp -119.37 135.56 54.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.25 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 707' ' ' PHE . . . . . 0.514 ' CZ ' HD11 ' A' ' 690' ' ' LEU . 95.3 m-85 -117.88 131.5 56.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.689 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 54.6 mt -99.89 142.52 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.805 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 709' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 726' ' ' SER . . . 110.71 -140.85 16.16 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -87.09 152.95 53.92 Favored Pre-proline 0 C--N 1.328 -0.326 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.523 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -74.19 153.1 45.85 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.547 2.165 . . . . 0.0 112.482 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -48.38 162.4 0.33 Allowed 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.757 2.305 . . . . 0.0 112.863 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 2.2 t -84.46 16.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.056 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.63 148.21 11.27 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.983 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.83 -10.76 23.46 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.766 2.311 . . . . 0.0 112.958 -178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.672 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 0.9 OUTLIER -70.58 -37.34 73.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.5 -179.63 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.413 HD21 ' NH2' ' A' ' 694' ' ' ARG . 48.1 mt -78.09 -38.8 43.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 86.7 m -63.8 -40.61 97.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.852 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.91 89.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.24 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -76.57 -25.36 53.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.357 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.4 146.69 48.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 19.0 t -85.38 -27.36 25.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.669 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -169.84 154.77 5.45 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.165 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 39.0 mt -148.98 120.03 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.063 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 25.4 mt -104.23 115.12 29.84 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.784 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 726' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 709' ' ' GLY . 8.8 m -70.08 -36.65 75.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.663 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -134.74 96.38 14.9 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -48.11 133.53 23.95 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.282 1.988 . . . . 0.0 111.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 16.6 tp -176.39 138.53 0.31 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.419 ' C ' ' H ' ' A' ' 732' ' ' GLN . 29.6 m-20 62.06 75.69 0.42 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.734 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.54 -9.3 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.715 2.277 . . . . 0.0 111.77 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 730' ' ' ASP . 93.1 mt-30 -69.89 -35.79 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 32.6 tp -67.3 -39.75 85.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 13.0 tp -57.32 -41.04 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.05 -38.95 93.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.752 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 71.9 m -59.2 -46.83 87.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.968 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.8 m -63.43 -41.68 98.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.583 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.688 HD23 ' SG ' ' A' ' 742' ' ' CYS . 9.8 tt -63.32 -37.92 89.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.106 0.479 . . . . 0.0 110.045 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 741' ' ' LEU . 55.3 tt0 -64.84 -30.43 71.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.797 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.42 -5.06 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.16 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.674 ' N ' ' O ' ' A' ' 739' ' ' GLN . 19.1 tp -156.93 -41.5 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.194 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.688 ' SG ' HD23 ' A' ' 738' ' ' LEU . 1.4 m 28.82 -84.45 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.314 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.83 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.61 ' N ' ' O ' ' A' ' 741' ' ' LEU . 17.3 Cg_endo -58.14 121.32 9.8 Favored 'Trans proline' 0 N--CA 1.493 1.451 0 CA-C-N 120.276 1.134 . . . . 0.0 111.325 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 744' ' ' PRO . . . . . 0.405 ' HB3' HD12 ' A' ' 673' ' ' ILE . 98.0 Cg_endo -81.12 -4.19 12.49 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.577 2.185 . . . . 0.0 112.313 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 745' ' ' ASN . . . . . 0.651 ' O ' ' ND2' ' A' ' 745' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.366 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -161.37 -174.76 31.63 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -88.13 163.59 16.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.754 0.311 . . . . 0.0 110.538 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 65.4 mt -111.58 141.74 26.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.959 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.79 HD13 ' C ' ' A' ' 631' ' ' LEU . 2.8 tm? -110.96 123.75 50.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.309 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.778 ' N ' HD13 ' A' ' 631' ' ' LEU . 10.2 tt -123.1 126.66 47.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.993 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 41.8 tp -111.13 117.08 32.29 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.498 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 84.2 tt0 -159.7 159.91 33.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.729 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.599 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 84.7 tt0 -106.91 141.08 38.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.382 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.599 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 28.6 tp10 93.23 115.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.443 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.7 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 57.3 p30 -63.6 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.7 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 49.5 tp10 -63.81 -47.2 81.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.941 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.37 -43.51 66.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.977 0.418 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.45 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -65.14 -40.49 94.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.128 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 645' ' ' GLU . 90.3 m -61.73 -45.35 94.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.924 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 52.1 t -55.89 -52.0 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.237 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.53 -46.7 95.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.726 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 644' ' ' CYS . . . . . . . . . . . . . 72.6 m -69.36 -32.99 72.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.015 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 645' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 641' ' ' THR . 85.0 tt0 -60.23 -43.48 96.01 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.575 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 73.6 mtp -71.25 -40.73 70.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.367 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.44 ' HA ' HD23 ' A' ' 647' ' ' LEU . 83.1 mt -67.84 -45.45 74.6 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.958 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 30.0 m -56.16 -42.59 77.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.72 -31.07 69.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.492 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -75.7 -1.97 27.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.535 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 84.64 10.42 79.42 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -94.92 136.14 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.439 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -95.82 121.52 37.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.933 0.396 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 13.0 p -136.6 140.24 43.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.313 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.47 128.69 65.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.45 ' CG ' ' HB1' ' A' ' 640' ' ' ALA . 26.3 t90 -95.38 117.64 30.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.342 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 657' ' ' LEU . 69.2 mt -118.69 150.79 39.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.542 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.632 ' O ' HG22 ' A' ' 658' ' ' VAL . 14.5 p -103.91 7.36 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.267 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.8 t0 -148.09 119.98 8.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -55.78 -35.85 64.15 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 661' ' ' SER . . . . . 0.52 ' HA ' HD12 ' A' ' 664' ' ' LEU . 37.5 m -58.88 -40.42 84.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.881 0.372 . . . . 0.0 110.467 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 53.2 m -63.76 -38.66 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.872 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.581 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -62.31 -40.27 95.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.973 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.6 HD21 HD12 ' A' ' 689' ' ' LEU . 60.7 mt -59.94 -37.58 79.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.636 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -63.04 -44.59 95.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.319 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -90.38 -41.68 11.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.623 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.5 tt -47.0 -46.02 21.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.27 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -61.85 -35.19 77.54 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.488 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 45.1 mt -76.97 -44.21 32.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.237 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.41 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.9 OUTLIER -83.55 -12.83 55.67 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.629 -178.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.41 ' C ' ' O ' ' A' ' 670' ' ' LEU . 16.4 mm100 40.09 74.36 0.72 Allowed Pre-proline 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.35 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.463 ' CD ' ' HG ' ' A' ' 667' ' ' LEU . 56.2 Cg_endo -73.14 150.79 48.54 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.909 2.406 . . . . 0.0 112.448 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.82 HG13 HG23 ' A' ' 674' ' ' VAL . 27.5 pt -95.3 -12.13 8.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.461 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.82 HG23 HG13 ' A' ' 673' ' ' ILE . 88.4 t -140.13 134.77 36.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.304 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.3 mt -128.7 124.91 62.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.982 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.3 mp -103.38 143.59 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.932 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.46 ' HE1' ' SG ' ' A' ' 686' ' ' CYS . 80.3 mtp -139.12 116.25 11.03 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.002 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.72 146.19 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.003 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.778 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 20.6 t-105 -118.22 -35.67 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.74 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.778 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 26.0 Cg_exo -54.0 -42.54 65.96 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.252 1.968 . . . . 0.0 113.053 -179.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.511 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 74.1 Cg_endo -84.47 157.26 12.48 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.312 2.008 . . . . 0.0 112.07 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -48.54 -81.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.702 2.268 . . . . 0.0 111.528 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 686' ' ' CYS . 85.4 m-20 53.35 57.13 6.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.587 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -53.67 -32.0 49.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.891 0.377 . . . . 0.0 110.26 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 17.3 m -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.212 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.46 ' SG ' ' HE1' ' A' ' 677' ' ' MET . 4.5 t -57.19 -29.55 63.79 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.286 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.88 -38.16 88.06 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.751 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.756 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.4 OUTLIER -70.45 -37.89 74.4 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.468 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.6 HD12 HD21 ' A' ' 664' ' ' LEU . 9.7 tp -60.07 -41.56 92.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.831 HD13 ' C ' ' A' ' 690' ' ' LEU . 3.1 tm? -59.72 -42.73 93.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.515 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -60.29 -43.33 96.37 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.821 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -59.29 -51.65 69.03 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.085 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 74.2 mt -54.24 -43.33 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.275 0.56 . . . . 0.0 109.822 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -65.31 -30.56 71.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.106 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 695' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 696' ' ' HIS . 40.6 tp10 -65.3 -50.96 63.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.441 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER 173.67 66.76 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.72 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.419 ' CD ' ' C ' ' A' ' 697' ' ' GLN . 3.4 tm0? -57.79 -46.73 84.21 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.174 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.607 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . -160.93 78.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.728 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.607 ' O ' ' O ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER 44.18 179.23 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 120.737 -0.385 . . . . 0.0 109.987 -179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 699' ' ' ASP . 50.9 Cg_exo -50.03 148.17 13.81 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.168 1.912 . . . . 0.0 111.895 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.576 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 11.6 m170 62.7 46.84 0.85 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.637 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 12.2 Cg_endo -59.04 169.23 3.74 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 122.9 2.4 . . . . 0.0 111.92 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -47.17 155.01 1.13 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.938 2.426 . . . . 0.0 111.861 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.433 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 34.0 mt -76.69 146.53 38.01 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.737 ' C ' HD12 ' A' ' 706' ' ' LEU . 13.7 p -123.74 135.72 62.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.22 0.533 . . . . 0.0 110.931 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.809 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.3 mp -122.16 138.14 54.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.654 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -107.3 130.08 54.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.908 0.385 . . . . 0.0 110.188 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 1.159 HD12 ' N ' ' A' ' 709' ' ' GLY . 0.1 OUTLIER -94.9 136.88 34.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.392 -179.711 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 709' ' ' GLY . . . . . 1.159 ' N ' HD12 ' A' ' 708' ' ' LEU . . . 99.62 -132.74 11.04 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -90.01 149.39 41.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.886 0.374 . . . . 0.0 110.67 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.518 ' HB3' HG21 ' A' ' 724' ' ' ILE . 57.1 Cg_endo -73.75 151.27 45.98 Favored 'Trans proline' 0 C--N 1.307 -1.626 0 C-N-CA 122.866 2.378 . . . . 0.0 112.158 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.53 157.39 41.81 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 122.675 2.25 . . . . 0.0 111.789 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 80.5 t -77.98 -38.54 24.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.795 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -72.73 136.27 80.5 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.562 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -74.76 -12.88 22.09 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 C-N-CA 122.596 2.197 . . . . 0.0 112.495 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.4 mt -70.86 -31.44 68.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 61.4 mt -76.48 -33.71 58.68 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 62.2 m -63.11 -42.48 99.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.885 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.77 91.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.354 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -78.55 -22.63 46.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.729 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.97 138.09 47.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.453 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.433 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 22.2 t -85.56 -26.79 25.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.147 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.526 ' HB3' ' HG ' ' A' ' 706' ' ' LEU . . . -169.19 152.43 5.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.518 HG21 ' HB3' ' A' ' 711' ' ' PRO . 69.3 mt -130.11 128.83 65.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.012 0.434 . . . . 0.0 110.642 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.529 ' O ' ' O ' ' A' ' 709' ' ' GLY . 58.1 mt -104.59 149.76 25.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.143 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 726' ' ' SER . . . . . 0.428 ' H ' ' H ' ' A' ' 727' ' ' LYS . 55.7 p -165.45 -2.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.81 0.338 . . . . 0.0 110.626 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 727' ' ' LYS . . . . . 0.428 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.3 OUTLIER -127.07 81.9 69.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.828 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.654 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.5 Cg_exo -49.67 147.99 12.65 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.061 2.507 . . . . 0.0 112.57 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.654 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 15.9 tp 105.5 154.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.945 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 732' ' ' GLN . 17.3 t0 63.19 62.65 1.71 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 731' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 28.6 Cg_exo -57.44 -0.06 0.3 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.869 2.379 . . . . 0.0 111.868 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 730' ' ' ASP . 12.1 mm100 -69.91 -29.77 67.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.595 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.66 -45.84 81.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.555 HD11 HD22 ' A' ' 706' ' ' LEU . 37.6 tp -58.37 -40.87 83.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.573 178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.6 -38.72 88.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.265 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 28.3 m -57.76 -40.24 79.27 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 82.9 m -60.96 -40.91 95.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.011 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.711 HD11 HG21 ' A' ' 674' ' ' VAL . 4.1 mm? -64.63 -38.38 90.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -63.49 -35.19 79.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -62.2 -11.25 31.92 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 53.3 tp -81.67 -21.21 38.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.992 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.2 m 59.46 69.6 1.27 Allowed Pre-proline 0 CA--C 1.519 -0.224 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -54.39 116.3 2.97 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.72 1.613 . . . . 0.0 109.93 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -87.0 154.33 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.506 2.137 . . . . 0.0 112.794 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 38.8 t30 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.563 -179.793 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 106.99 118.41 4.36 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -90.89 148.99 22.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.076 0.465 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.6 mm -112.18 134.92 53.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.202 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.817 HD13 ' N ' ' A' ' 632' ' ' LEU . 1.0 OUTLIER -107.44 124.61 50.12 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.237 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.817 ' N ' HD13 ' A' ' 631' ' ' LEU . 9.1 tt -131.33 127.05 36.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.648 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.859 HD22 ' SG ' ' A' ' 686' ' ' CYS . 6.7 tt -109.47 116.3 31.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.127 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.499 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 82.9 tt0 -159.97 158.15 30.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.599 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.519 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 22.2 pt-20 -100.5 162.46 12.92 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.519 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.8 tp10 83.56 112.65 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.458 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.686 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 93.2 m-20 -63.9 -36.0 82.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.625 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.414 ' CG ' ' N ' ' A' ' 639' ' ' ALA . 5.3 pt-20 -67.21 -37.33 83.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.138 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.414 ' N ' ' CG ' ' A' ' 638' ' ' GLU . . . -71.29 -45.3 63.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.388 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.453 ' HB1' ' HB2' ' A' ' 656' ' ' TRP . . . -66.89 -35.68 80.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.749 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 89.5 m -62.29 -48.08 81.49 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.741 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.79 -47.43 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.147 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 643' ' ' VAL . . . . . 0.544 HG11 HD13 ' A' ' 632' ' ' LEU . 57.4 t -61.07 -42.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.581 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.705 ' SG ' HG13 ' A' ' 654' ' ' VAL . 0.8 OUTLIER -62.43 -45.64 92.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -61.78 -38.38 87.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.905 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.96 -52.34 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.796 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.408 ' N ' HD12 ' A' ' 647' ' ' LEU . 8.0 mp -68.46 -46.42 69.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.961 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.577 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.0 m -55.66 -39.86 71.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.773 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.24 -29.36 68.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.776 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -79.33 -3.18 44.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.02 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.71 -10.11 68.61 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 652' ' ' PHE . . . . . 0.592 ' CG ' HD13 ' A' ' 738' ' ' LEU . 81.9 m-85 -94.46 130.02 40.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -94.71 133.33 38.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.402 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.705 HG13 ' SG ' ' A' ' 644' ' ' CYS . 9.0 p -131.0 140.88 47.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.194 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 11.5 mm -103.01 134.02 45.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.686 ' CH2' ' OD1' ' A' ' 637' ' ' ASP . 9.5 t90 -93.21 115.11 27.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.65 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.607 HD11 HD21 ' A' ' 631' ' ' LEU . 54.3 mt -114.84 141.57 47.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.606 ' CG2' ' CZ2' ' A' ' 656' ' ' TRP . 40.2 t -98.39 -0.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.777 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.571 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 74.4 m-20 -150.76 146.91 26.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.789 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -69.32 -40.62 80.46 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.104 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 95.9 p -59.43 -37.93 79.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.718 0.294 . . . . 0.0 111.215 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.5 m -62.17 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 109.787 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.77 -43.21 97.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.005 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.58 -45.51 81.29 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.831 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 665' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 88.9 m-20 -64.08 -43.61 94.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.836 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.404 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 86.6 mt-30 -86.67 -52.6 5.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.091 0.472 . . . . 0.0 111.226 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 667' ' ' LEU . 8.6 tt -45.08 -37.83 4.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.139 -178.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 668' ' ' ASP . . . . . 0.559 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 21.4 p-10 -56.26 -40.02 73.53 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.047 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.518 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 33.7 mt -79.3 -26.94 42.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 10.6 mt -72.23 -41.95 66.27 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.422 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 51.76 67.53 4.04 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.64 159.13 25.18 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.41 2.74 . . . . 0.0 113.369 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 61.1 mt -95.1 -23.37 5.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.988 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 17.3 t -143.54 139.39 26.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.556 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.603 HG23 ' HB3' ' A' ' 631' ' ' LEU . 63.5 mt -124.1 130.89 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.982 0.42 . . . . 0.0 111.539 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.735 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -105.06 146.11 29.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.699 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.36 119.22 14.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.529 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.95 144.96 54.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.597 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.786 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.8 t-105 -118.16 -32.36 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.786 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.1 Cg_exo -49.33 -41.09 43.6 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.001 1.801 . . . . 0.0 112.769 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 11.0 Cg_exo -67.44 159.43 52.44 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.287 1.991 . . . . 0.0 111.513 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.39 -7.38 1.24 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.518 2.145 . . . . 0.0 111.349 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.642 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 13.6 t70 56.27 -129.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.458 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 684' ' ' GLN . . . . . 0.642 ' CB ' ' O ' ' A' ' 683' ' ' ASP . 3.3 tm0? 100.84 -78.31 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.372 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 60.5 p -66.88 -26.75 67.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.965 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.859 ' SG ' HD22 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -61.25 -22.04 64.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.562 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.9 mt -62.72 -34.41 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.422 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 77.1 mt -67.76 -38.03 82.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.677 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.17 -47.64 84.57 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.03 0.443 . . . . 0.0 110.215 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.472 HD12 ' H ' ' A' ' 690' ' ' LEU . 6.5 mp -62.16 -32.88 73.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.62 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -60.29 -41.53 93.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.658 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.643 ' NE2' ' ND1' ' A' ' 696' ' ' HIS . 19.1 t-160 -56.93 -49.53 75.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.45 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.472 HD21 HD12 ' A' ' 675' ' ' ILE . 97.0 mt -56.32 -41.31 75.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.691 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -63.18 -39.82 95.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.948 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -69.78 -32.26 70.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.771 -0.371 . . . . 0.0 110.81 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.643 ' ND1' ' NE2' ' A' ' 692' ' ' HIS . 55.1 m170 -107.38 15.49 24.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.315 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.419 ' N ' ' O ' ' A' ' 693' ' ' LEU . 21.9 pt20 -59.62 -22.84 62.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.363 . . . . 0.0 110.422 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -84.55 2.31 41.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.379 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -69.72 140.2 89.11 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.702 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.01 144.64 94.17 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.22 1.947 . . . . 0.0 112.214 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.621 ' O ' ' CG ' ' A' ' 701' ' ' HIS . 9.5 t-160 51.31 60.44 14.35 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.023 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.444 ' HD3' ' N ' ' A' ' 701' ' ' HIS . 53.0 Cg_exo -46.74 142.39 10.35 Favored 'Trans proline' 0 C--N 1.303 -1.846 0 C-N-CA 122.998 2.465 . . . . 0.0 112.093 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.85 149.08 32.89 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.579 2.186 . . . . 0.0 112.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.617 ' H ' HD12 ' A' ' 704' ' ' LEU . 5.3 mp -78.69 145.98 34.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.963 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 58.6 t -121.61 126.39 74.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.017 0.437 . . . . 0.0 111.087 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.917 HD22 ' HB3' ' A' ' 723' ' ' ALA . 44.6 mt -117.66 140.1 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.396 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -111.92 132.16 54.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.443 HD11 HD11 ' A' ' 632' ' ' LEU . 23.9 mt -94.84 148.29 22.46 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.391 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 709' ' ' GLY . . . . . 0.445 ' O ' ' OG ' ' A' ' 726' ' ' SER . . . 69.63 -119.51 9.21 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.4 148.57 40.79 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.854 0.359 . . . . 0.0 110.851 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.804 ' HB3' HD13 ' A' ' 724' ' ' ILE . 73.9 Cg_endo -76.0 161.05 36.3 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.182 2.588 . . . . 0.0 112.937 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.7 154.21 70.61 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 123.252 2.635 . . . . 0.0 111.91 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 92.7 t -79.44 -34.77 16.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.44 127.61 92.71 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.24 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -69.63 -25.12 29.53 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.676 HD22 ' N ' ' A' ' 716' ' ' LEU . 3.7 mm? -71.49 -33.89 69.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 85.5 mt -78.13 -36.0 48.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 718' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 721' ' ' ALA . 91.9 m -64.33 -44.91 90.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.919 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.05 -36.77 82.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.366 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -77.78 -6.9 55.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.114 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 721' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 718' ' ' THR . . . -73.98 144.27 45.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.245 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.419 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 38.0 m -85.45 -33.47 21.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.443 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.917 ' HB3' HD22 ' A' ' 706' ' ' LEU . . . -171.5 131.83 0.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.804 HD13 ' HB3' ' A' ' 711' ' ' PRO . 78.0 mt -92.8 123.94 45.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.68 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.6 mt -109.52 150.91 27.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.657 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 726' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 709' ' ' GLY . 0.7 OUTLIER -168.27 -57.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -103.58 145.31 30.38 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.295 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.3 149.39 88.46 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.722 2.281 . . . . 0.0 111.707 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.512 ' O ' HD23 ' A' ' 729' ' ' LEU . 7.0 tt -177.87 85.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.696 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.619 ' C ' ' H ' ' A' ' 732' ' ' GLN . 39.0 m-20 53.49 86.71 0.16 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.307 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.17 -0.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.568 2.179 . . . . 0.0 111.753 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.619 ' H ' ' C ' ' A' ' 730' ' ' ASP . 97.1 mt-30 -68.12 -28.87 67.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.482 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.46 -44.16 91.97 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.676 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.37 -43.51 92.87 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.73 -39.58 92.05 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.688 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 736' ' ' THR . . . . . 0.459 ' O ' ' N ' ' A' ' 740' ' ' GLY . 58.4 m -60.16 -39.8 87.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.62 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 30.2 m -59.36 -46.15 89.44 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.949 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.592 HD13 ' CG ' ' A' ' 652' ' ' PHE . 87.9 mt -68.03 -50.71 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.981 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 742' ' ' CYS . 80.9 mt-30 -66.94 -27.25 67.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.344 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 740' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 736' ' ' THR . . . -49.83 -29.89 14.15 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.731 ' N ' HD12 ' A' ' 741' ' ' LEU . 5.5 mp -83.97 -16.8 42.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.456 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.405 ' N ' ' O ' ' A' ' 739' ' ' GLN . 57.1 m 53.43 60.92 11.43 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.404 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 72.5 Cg_endo -82.93 116.22 2.46 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.321 2.014 . . . . 0.0 111.075 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -86.06 145.91 8.77 Favored 'Trans proline' 0 C--N 1.308 -1.554 0 C-N-CA 122.867 2.378 . . . . 0.0 112.945 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 26.8 p30 . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.518 179.591 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 157.06 -133.15 3.47 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -90.72 136.59 32.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.407 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.82 HG23 HG13 ' A' ' 674' ' ' VAL . 74.3 mt -114.93 135.79 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 667' ' ' LEU . 8.1 tt -122.46 125.51 45.96 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.519 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.566 HD12 ' N ' ' A' ' 632' ' ' LEU . 4.5 mp -117.28 135.2 54.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.127 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.461 ' HB3' ' SG ' ' A' ' 686' ' ' CYS . 5.0 mp -107.96 111.41 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.65 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.488 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 87.2 tt0 -160.05 157.08 28.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.646 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.644 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 94.1 mt-10 -111.07 150.63 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.105 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.644 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 72.8 tt0 103.76 102.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.666 0.604 . . . . 0.0 109.705 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.512 ' O ' ' OG1' ' A' ' 641' ' ' THR . 54.4 t0 -56.19 -36.08 67.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.637 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.706 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.65 -45.49 52.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.937 0.398 . . . . 0.0 110.449 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.514 ' HB2' ' NE1' ' A' ' 656' ' ' TRP . . . -65.2 -38.79 91.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.913 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.2 m -62.37 -46.48 88.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.844 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 42.1 t -56.24 -53.51 38.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.777 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 643' ' ' VAL . . . . . 0.406 HG11 ' HH2' ' A' ' 656' ' ' TRP . 76.2 t -59.22 -42.78 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.724 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.502 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.3 m -58.17 -40.86 82.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.16 -38.39 88.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.192 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 12.2 mmm -68.03 -49.14 63.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.279 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.523 HD13 HG11 ' A' ' 654' ' ' VAL . 39.4 mt -68.73 -43.08 76.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.973 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.502 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 65.6 m -56.05 -41.32 74.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.787 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.21 70.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.24 -5.39 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.781 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.73 5.98 83.45 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -95.47 135.41 37.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.879 0.371 . . . . 0.0 110.867 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 653' ' ' LYS . . . . . 0.45 ' HZ2' HD11 ' A' ' 655' ' ' ILE . 20.2 tttm -93.78 122.66 36.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.64 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.786 HG12 ' HB ' ' A' ' 630' ' ' ILE . 6.2 m -128.31 150.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 111.276 -179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 655' ' ' ILE . . . . . 0.56 HG21 ' NE2' ' A' ' 666' ' ' GLN . 27.4 mm -114.16 129.87 69.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.005 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.791 ' C ' HD22 ' A' ' 657' ' ' LEU . 1.4 t-105 -96.77 133.86 40.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.88 0.371 . . . . 0.0 111.475 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.791 HD22 ' C ' ' A' ' 656' ' ' TRP . 4.3 mm? -120.12 140.94 50.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.589 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 19.3 m -107.53 6.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.957 0.408 . . . . 0.0 109.975 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.486 ' C ' ' OD1' ' A' ' 659' ' ' ASP . 48.6 p30 -153.36 -168.76 3.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.337 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -113.12 -37.24 1.38 Allowed Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 24.4 m -58.84 -45.77 89.29 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 662' ' ' THR . . . . . 0.499 HG22 ' OE1' ' A' ' 666' ' ' GLN . 53.7 m -65.01 -36.71 85.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.228 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.13 -45.9 91.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.797 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' A' ' 689' ' ' LEU . 94.4 mt -57.88 -45.08 86.9 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.323 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -63.1 -41.16 99.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.004 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.67 ' OE1' HD11 ' A' ' 657' ' ' LEU . 19.8 pt20 -94.46 -45.75 7.3 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.561 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.9 tt -48.15 -41.54 27.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.833 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -61.58 -35.27 77.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.701 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 90.1 mt -76.5 -44.2 36.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.194 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' A' ' 667' ' ' LEU . 1.4 pp -81.54 -15.69 54.07 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.866 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 670' ' ' LEU . 3.3 mm100 37.97 77.99 0.38 Allowed Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.385 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -69.35 156.98 62.87 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.555 2.17 . . . . 0.0 112.465 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 10.0 mm -93.16 -24.95 5.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.323 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.82 HG13 HG23 ' A' ' 630' ' ' ILE . 13.2 p -143.57 142.11 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.371 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.2 mt -127.82 127.27 68.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.101 0.477 . . . . 0.0 111.755 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.36 131.47 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.416 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 65.7 ttp -139.92 127.61 21.79 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.3 152.22 44.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.864 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.407 ' CZ3' ' CD2' ' A' ' 687' ' ' LEU . 32.2 t-105 -124.93 72.09 62.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -87.51 144.37 6.65 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.118 2.545 . . . . 0.0 112.11 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.73 ' O ' ' N ' ' A' ' 683' ' ' ASP . 5.8 Cg_exo -51.25 -50.39 14.09 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.651 2.234 . . . . 0.0 113.26 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 52.8 Cg_exo -38.35 -11.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 122.538 2.159 . . . . 0.0 112.064 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.73 ' N ' ' O ' ' A' ' 681' ' ' PRO . 13.2 t0 73.72 78.15 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 684' ' ' GLN . . . . . 0.531 ' O ' HD12 ' A' ' 687' ' ' LEU . 8.9 tt0 -60.35 138.8 57.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.465 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 685' ' ' SER . . . . . 0.442 ' C ' ' N ' ' A' ' 687' ' ' LEU . 38.1 m -62.27 -29.34 70.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.623 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.522 ' HB2' ' NE2' ' A' ' 684' ' ' GLN . 83.7 m -53.59 -14.05 0.77 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 687' ' ' LEU . . . . . 0.588 ' CD1' ' OD1' ' A' ' 683' ' ' ASP . 47.2 mt -62.65 -32.38 73.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.146 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 56.5 mt -64.26 -39.73 94.53 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.88 HD13 ' C ' ' A' ' 689' ' ' LEU . 2.4 tm? -60.22 -44.11 95.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.182 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 19.5 tp -59.22 -39.57 83.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.749 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -60.2 -39.21 85.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.91 0.386 . . . . 0.0 110.064 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -57.51 -50.0 74.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.963 179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.493 ' O ' ' N ' ' A' ' 697' ' ' GLN . 80.7 mt -55.92 -35.41 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.576 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.512 HH22 ' HA ' ' A' ' 717' ' ' LEU . 24.4 mmt180 -62.04 -36.76 82.59 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.107 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -68.74 -33.86 74.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.467 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -112.93 23.5 13.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.166 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.546 ' O ' ' N ' ' A' ' 699' ' ' ASP . 7.8 pt20 -56.0 -17.47 6.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.81 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.644 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . 62.29 -71.65 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.208 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.644 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 12.5 t0 107.36 -40.13 0.0 OUTLIER Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.557 ' HD2' ' HB1' ' A' ' 698' ' ' ALA . 23.3 Cg_exo -56.87 -55.9 2.34 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.486 1.458 . . . . 0.0 111.922 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -137.31 68.2 54.52 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.677 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.05 144.1 74.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.553 2.169 . . . . 0.0 112.346 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -63.05 161.16 30.9 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.703 2.269 . . . . 0.0 111.722 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.3 tp -76.63 124.9 28.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.975 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.499 ' C ' HD12 ' A' ' 706' ' ' LEU . 61.0 t -122.56 132.26 71.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 121.157 0.503 . . . . 0.0 111.874 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.641 ' N ' HD12 ' A' ' 706' ' ' LEU . 5.2 mp -125.01 145.68 49.78 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.438 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -106.25 123.37 47.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.979 0.418 . . . . 0.0 110.585 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.2 mt -96.76 150.83 20.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.575 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -123.7 6.46 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.04 156.1 46.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -71.05 156.4 59.98 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 123.099 2.533 . . . . 0.0 112.286 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.521 ' HD2' HD13 ' A' ' 724' ' ' ILE . 36.8 Cg_endo -68.29 -153.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.898 2.399 . . . . 0.0 111.771 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 1.5 t -145.12 -52.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.498 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.09 145.07 90.83 Favored Pre-proline 0 C--N 1.327 -0.374 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.191 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.53 -17.62 33.96 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.592 2.195 . . . . 0.0 112.437 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 60.7 tp -70.27 -34.98 73.45 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.613 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.512 ' HA ' HH22 ' A' ' 694' ' ' ARG . 71.0 mt -76.38 -37.91 56.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.484 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 39.7 m -65.66 -43.0 90.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.261 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.62 -41.12 93.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.465 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.503 ' CD ' ' CZ ' ' A' ' 694' ' ' ARG . 42.7 tt0 -78.37 -22.97 47.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.72 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -72.92 139.47 46.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.56 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.468 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -86.89 -30.27 21.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.63 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.49 124.25 0.69 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.767 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.521 HD13 ' HD2' ' A' ' 712' ' ' PRO . 62.6 mt -91.41 125.56 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.82 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.669 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.9 mp -107.2 147.91 29.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.535 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.1 m -166.89 -3.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.431 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 9.4 tptm -133.24 79.63 61.05 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.328 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.07 141.0 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.794 2.33 . . . . 0.0 112.087 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.3 OUTLIER -179.09 116.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.492 ' O ' ' O ' ' A' ' 729' ' ' LEU . 57.3 t0 56.42 121.2 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.721 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.2 -11.85 30.99 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.327 2.018 . . . . 0.0 112.205 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -71.42 -27.45 63.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.443 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 46.8 tp -66.13 -49.75 66.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.364 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.475 ' H ' HD12 ' A' ' 734' ' ' LEU . 4.7 mp -58.84 -42.9 90.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.955 0.407 . . . . 0.0 110.079 179.134 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.319 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 56.1 m -60.53 -39.66 88.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.637 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 737' ' ' THR . . . . . 0.532 HG21 HD21 ' A' ' 706' ' ' LEU . 48.9 m -61.5 -44.18 97.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.7 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.489 ' CD2' HG21 ' A' ' 674' ' ' VAL . 39.8 mt -65.59 -37.35 86.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.122 0.486 . . . . 0.0 109.944 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.669 ' O ' ' N ' ' A' ' 741' ' ' LEU . 47.2 tt0 -64.55 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.4 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.96 -6.52 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.478 -0.649 . . . . 0.0 111.478 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.669 ' N ' ' O ' ' A' ' 739' ' ' GLN . 66.1 mt -77.61 -42.21 35.81 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.543 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.498 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 45.3 t 47.64 57.61 17.71 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.182 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.498 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 57.6 Cg_endo -82.29 116.75 2.72 Favored 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.139 1.892 . . . . 0.0 111.279 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.06 135.75 5.6 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 122.62 2.213 . . . . 0.0 112.304 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 10.0 m120 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.569 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 81.18 25.53 54.88 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -90.52 128.92 36.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.436 HG23 ' O ' ' A' ' 674' ' ' VAL . 38.7 mt -118.35 142.9 30.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.753 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 1.023 HD21 ' HB1' ' A' ' 663' ' ' ALA . 23.6 tp -106.89 133.06 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.572 ' CD1' HG11 ' A' ' 643' ' ' VAL . 9.3 tt -130.41 120.22 23.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 657' ' ' LEU . 14.3 tp -107.28 119.25 38.87 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.64 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 87.7 tt0 -159.72 158.33 31.12 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.274 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.653 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.8 tt0 -109.02 133.43 53.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.776 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.653 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 75.3 tt0 105.47 113.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.653 0.596 . . . . 0.0 109.677 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.678 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.8 p30 -61.94 -33.49 74.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.38 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.678 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.6 mt-10 -65.77 -41.54 91.94 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.792 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.547 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -76.24 -46.04 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.168 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.4 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -62.39 -41.19 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.539 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 87.1 m -63.87 -43.27 96.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.306 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 638' ' ' GLU . 41.4 t -54.5 -52.76 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.154 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 643' ' ' VAL . . . . . 0.572 HG11 ' CD1' ' A' ' 632' ' ' LEU . 87.6 t -58.15 -41.82 81.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.523 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.459 ' HA ' HG11 ' A' ' 654' ' ' VAL . 73.0 m -59.91 -39.09 84.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.6 -36.92 84.29 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.098 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 67.9 mmm -68.69 -48.88 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.477 ' N ' HD12 ' A' ' 647' ' ' LEU . 9.5 mp -69.08 -43.31 74.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 32.1 m -55.58 -41.42 73.32 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.34 -29.68 69.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.28 -5.23 30.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -8.23 70.39 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -97.41 138.34 35.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 15.9 ttmm -92.1 133.11 36.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.947 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.459 HG11 ' HA ' ' A' ' 644' ' ' CYS . 7.1 p -125.6 141.38 45.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.964 0.411 . . . . 0.0 111.195 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 655' ' ' ILE . . . . . 0.489 HG22 ' CD2' ' A' ' 657' ' ' LEU . 59.6 mt -107.35 129.76 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.921 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.64 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 19.9 t90 -93.85 118.96 32.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.82 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.605 ' O ' HD12 ' A' ' 633' ' ' LEU . 2.7 mm? -109.12 143.22 38.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.665 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.69 ' O ' HG12 ' A' ' 658' ' ' VAL . 88.5 t -103.95 4.45 10.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.591 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 97.3 m-20 -145.77 121.27 10.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.06 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.427 ' CA ' HD12 ' A' ' 689' ' ' LEU . . . -57.06 -43.17 93.31 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.271 -0.731 . . . . 0.0 111.271 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 88.5 p -61.34 -40.25 93.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.718 0.294 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 34.0 m -64.1 -38.28 90.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.122 0.487 . . . . 0.0 110.184 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 1.023 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -63.75 -44.6 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.458 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.08 -44.72 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.9 0.381 . . . . 0.0 111.161 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -59.24 -41.04 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.568 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.571 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 97.9 mt-30 -86.73 -23.99 25.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.028 0.442 . . . . 0.0 109.99 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.566 ' N ' ' O ' ' A' ' 663' ' ' ALA . 2.8 tp -50.44 -45.67 56.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.32 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -62.59 -30.33 71.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.866 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 29.1 mt -73.88 -47.2 39.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.925 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.571 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.82 -17.75 42.88 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.488 -179.467 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 670' ' ' LEU . 12.9 mm-40 41.35 64.16 5.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.931 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -72.38 155.52 55.51 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 123.106 2.537 . . . . 0.0 112.79 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 95.9 mt -93.88 -22.18 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.194 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 630' ' ' ILE . 22.0 t -138.41 136.44 44.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.475 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.69 HG22 ' SD ' ' A' ' 677' ' ' MET . 75.6 mt -120.98 123.31 69.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.579 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.585 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.5 mp -106.9 128.52 54.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.449 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.69 ' SD ' HG22 ' A' ' 675' ' ' ILE . 1.7 mpp? -141.02 141.17 34.36 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.259 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.717 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -65.2 153.91 39.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.749 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.755 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 57.9 t-105 -99.56 -25.59 0.23 Allowed Pre-proline 0 C--N 1.328 -0.341 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.872 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 2.8 Cg_exo -70.29 149.18 63.11 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 121.893 1.729 . . . . 0.0 110.316 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.77 110.66 2.95 Favored 'Trans proline' 0 C--N 1.301 -1.938 0 C-N-CA 122.447 2.098 . . . . 0.0 112.444 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.583 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 62.0 Cg_endo -91.76 -33.14 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.899 2.4 . . . . 0.0 111.487 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.583 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 81.7 m-20 -157.01 -81.05 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 179.72 -25.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.768 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 22.7 t -64.18 -33.74 76.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -59.99 -33.81 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.79 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 687' ' ' LEU . . . . . 0.465 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 80.9 mt -66.76 -39.22 87.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.897 0.379 . . . . 0.0 110.554 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.777 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.96 -34.64 73.67 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.489 HD23 ' C ' ' A' ' 689' ' ' LEU . 9.7 tt -58.83 -41.66 87.4 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 49.9 tp -59.68 -43.06 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.092 179.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.02 -42.96 99.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.796 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -57.91 -48.05 81.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.384 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 697' ' ' GLN . 91.8 mt -55.53 -37.77 68.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.969 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -63.19 -40.52 97.75 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.778 -0.369 . . . . 0.0 110.909 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.72 -33.61 74.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.68 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.467 ' O ' ' OD2' ' A' ' 699' ' ' ASP . 20.5 m-70 -96.79 0.92 50.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.713 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.431 HE22 ' HG2' ' A' ' 720' ' ' GLN . 61.7 tt0 -60.07 -34.79 73.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.919 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -82.34 -0.13 44.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.851 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.467 ' OD2' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER -69.64 146.25 95.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.462 ' O ' ' OD1' ' A' ' 699' ' ' ASP . 10.7 Cg_endo -56.2 144.85 79.61 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.634 2.223 . . . . 0.0 112.54 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.402 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 27.1 m-70 51.63 56.86 16.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.581 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 28.7 Cg_endo -65.07 134.26 38.94 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.633 2.222 . . . . 0.0 111.832 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.07 150.39 42.93 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.457 2.105 . . . . 0.0 111.919 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 737' ' ' THR . 52.5 mt -78.15 138.72 38.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 29.4 t -115.99 129.33 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.095 0.474 . . . . 0.0 111.323 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.46 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.5 mp -117.07 136.63 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.659 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 707' ' ' PHE . . . . . 0.4 ' CE1' ' HE2' ' A' ' 677' ' ' MET . 94.8 m-85 -110.86 137.08 48.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.125 0.488 . . . . 0.0 111.77 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 56.6 mt -96.63 156.4 16.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.452 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -140.03 17.9 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.72 150.07 47.46 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.965 0.412 . . . . 0.0 110.983 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.76 146.08 33.26 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.966 2.444 . . . . 0.0 112.582 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -50.85 154.26 7.26 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.216 1.944 . . . . 0.0 111.178 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 54.2 t -77.7 -42.89 29.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.488 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -72.96 137.76 79.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.21 -13.48 18.94 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.391 2.061 . . . . 0.0 112.322 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.94 -36.53 75.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.802 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 80.1 mt -75.48 -34.23 60.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 91.6 m -63.79 -43.46 96.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.082 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.24 -37.35 86.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.603 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.431 ' HG2' HE22 ' A' ' 697' ' ' GLN . 96.6 mt-30 -73.26 -27.28 61.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.184 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.16 149.29 46.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.396 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 8.1 t -85.65 -31.15 22.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.235 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -172.28 160.52 5.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.476 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.4 HD13 HG21 ' A' ' 724' ' ' ILE . 54.3 mt -147.1 120.99 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.707 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.5 mt -112.94 129.52 56.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.804 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 14.8 m -68.12 -40.48 82.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.058 0.456 . . . . 0.0 109.947 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.81 145.23 27.08 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.011 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 129.57 30.16 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.243 1.962 . . . . 0.0 111.651 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.458 ' HG ' ' N ' ' A' ' 730' ' ' ASP . 34.8 tp -179.5 149.8 0.4 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.458 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 2.4 m-20 57.66 68.02 2.12 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.761 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.31 -15.7 8.73 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.923 2.415 . . . . 0.0 112.052 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -69.86 -33.35 72.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.257 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 25.4 tp -67.05 -42.36 84.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.965 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.447 ' CD1' HD22 ' A' ' 706' ' ' LEU . 43.1 tp -56.45 -43.97 80.03 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.037 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.46 -39.64 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.22 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.8 m -59.05 -40.41 85.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 737' ' ' THR . . . . . 0.494 ' O ' ' CD1' ' A' ' 704' ' ' LEU . 73.4 m -63.35 -39.92 95.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.126 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.684 ' C ' HD23 ' A' ' 738' ' ' LEU . 7.3 tt -63.97 -47.78 79.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.357 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.578 ' C ' ' H ' ' A' ' 741' ' ' LEU . 2.8 pt20 -69.14 -22.34 63.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.91 0.15 0.06 OUTLIER Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 1.074 ' O ' HD12 ' A' ' 741' ' ' LEU . 0.3 OUTLIER -85.37 -4.37 59.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.844 0.354 . . . . 0.0 110.486 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 46.8 t 64.11 65.19 1.17 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.702 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -74.8 117.01 4.78 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.36 2.04 . . . . 0.0 110.718 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -86.17 1.0 8.02 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.531 2.154 . . . . 0.0 112.355 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.475 179.813 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 93.1 7.14 62.63 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -90.25 133.21 35.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.971 0.415 . . . . 0.0 111.029 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 63.8 mt -118.29 141.96 35.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.914 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.574 HD21 ' HB1' ' A' ' 663' ' ' ALA . 1.2 tp -106.06 129.09 54.23 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.44 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.433 HD23 ' C ' ' A' ' 632' ' ' LEU . 9.6 tt -134.33 120.58 20.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.751 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.55 HD23 ' C ' ' A' ' 633' ' ' LEU . 8.3 tt -108.43 120.09 41.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.913 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.524 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 81.7 tt0 -159.78 161.21 34.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.535 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.601 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 93.9 mt-10 -113.55 155.73 24.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.19 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.601 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.4 tp10 91.65 113.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.889 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -58.15 -38.23 76.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.145 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.733 ' O ' HG23 ' A' ' 642' ' ' VAL . 76.3 mm-40 -66.88 -41.44 87.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.118 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 636' ' ' GLU . . . -76.23 -45.15 34.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.811 0.339 . . . . 0.0 110.948 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.9 -46.2 82.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.05 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 58.4 m -63.63 -44.46 93.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 638' ' ' GLU . 41.1 t -55.86 -52.88 44.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.802 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 643' ' ' VAL . . . . . 0.418 HG11 HD11 ' A' ' 632' ' ' LEU . 70.7 t -60.29 -44.42 95.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 645' ' ' GLU . 0.5 OUTLIER -62.55 -37.32 85.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.745 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 645' ' ' GLU . . . . . 0.486 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 84.2 tt0 -62.37 -39.46 93.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.688 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 43.0 tpp -67.92 -50.31 56.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.722 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 647' ' ' LEU . 7.9 mp -68.57 -44.74 73.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.551 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 62.5 m -56.26 -43.46 78.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.021 0.438 . . . . 0.0 109.975 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.36 -23.74 63.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.54 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.25 -3.07 21.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.53 -9.81 69.04 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -95.31 138.55 32.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 110.604 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.27 129.74 38.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.134 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 9.5 p -129.12 138.7 53.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 3.1 mp -106.37 131.36 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.921 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.67 ' C ' HD22 ' A' ' 657' ' ' LEU . 16.0 t90 -90.56 122.22 33.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.11 -178.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.67 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.5 mm? -111.06 140.31 45.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.712 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.57 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 1.5 t -109.35 5.71 9.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.319 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.57 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 62.9 m-20 -147.34 137.72 23.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.357 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.447 ' O ' HD23 ' A' ' 689' ' ' LEU . . . -65.17 -46.7 86.92 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 -179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 21.4 m -60.05 -38.37 82.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 110.956 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 46.4 m -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.502 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.574 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.017 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.585 HD21 HD21 ' A' ' 689' ' ' LEU . 39.1 mt -59.05 -40.33 84.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.901 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 665' ' ' ASP . . . . . 0.582 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 86.3 m-20 -62.37 -42.33 99.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.161 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.569 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 88.4 mt-30 -87.84 -36.23 17.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.931 0.396 . . . . 0.0 110.92 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.494 HD11 HD11 ' A' ' 675' ' ' ILE . 0.8 OUTLIER -48.54 -44.44 36.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.995 -179.614 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 668' ' ' ASP . . . . . 0.582 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 50.7 p-10 -63.71 -32.02 73.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.383 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.546 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 81.4 mt -72.39 -46.71 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.91 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.569 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.87 -15.76 50.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.798 -179.121 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.409 ' C ' ' O ' ' A' ' 670' ' ' LEU . 5.0 mm100 40.72 61.1 7.21 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.1 0.476 . . . . 0.0 110.111 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.06 151.76 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.352 2.701 . . . . 0.0 112.447 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.586 HG13 HG23 ' A' ' 674' ' ' VAL . 7.0 pt -95.94 -11.54 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.586 HG23 HG13 ' A' ' 673' ' ' ILE . 63.6 t -138.68 135.2 43.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.458 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.494 HD11 HD11 ' A' ' 667' ' ' LEU . 67.0 mt -127.85 124.16 62.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.809 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.5 mp -102.74 138.03 40.18 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 74.1 mtp -139.27 134.38 32.56 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.086 -0.646 . . . . 0.0 111.623 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.52 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -67.71 150.84 48.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.594 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.75 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 25.2 t-105 -115.03 -21.03 0.11 Allowed Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 66.2 Cg_exo -47.74 158.67 0.7 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.859 1.706 . . . . 0.0 112.104 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.641 ' C ' ' H ' ' A' ' 683' ' ' ASP . 2.5 Cg_endo -50.2 -54.85 4.77 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.894 2.396 . . . . 0.0 113.402 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 2.1 Cg_endo -49.17 0.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.059 1.839 . . . . 0.0 111.945 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.641 ' H ' ' C ' ' A' ' 681' ' ' PRO . 84.8 m-20 -82.48 45.5 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.822 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -58.65 -38.45 78.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.103 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 685' ' ' SER . . . . . 0.4 ' O ' ' HG ' ' A' ' 688' ' ' LEU . 59.8 p -67.35 -30.09 69.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.104 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.06 -25.13 67.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.149 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 77.2 mt -66.19 -39.66 89.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.752 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.697 ' C ' HD12 ' A' ' 688' ' ' LEU . 1.2 pp -72.75 -43.26 63.13 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.717 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.792 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.5 OUTLIER -61.49 -41.23 96.96 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 690' ' ' LEU . 8.9 tt -59.61 -42.16 92.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.601 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.51 -40.54 94.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.227 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.664 ' NE2' ' NE2' ' A' ' 696' ' ' HIS . 5.8 t60 -57.83 -47.51 82.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.263 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.56 ' O ' ' N ' ' A' ' 697' ' ' GLN . 44.8 mt -54.68 -39.81 68.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -63.34 -34.13 77.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.142 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.2 -31.46 71.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.664 ' NE2' ' NE2' ' A' ' 692' ' ' HIS . 0.1 OUTLIER -169.9 63.6 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.157 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 693' ' ' LEU . 13.0 pt20 -62.21 5.68 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.15 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.576 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . 66.64 115.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.492 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.555 ' N ' ' CD ' ' A' ' 700' ' ' PRO . 0.3 OUTLIER -68.24 -47.31 38.9 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.603 -179.835 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.614 ' O ' ' C ' ' A' ' 701' ' ' HIS . 23.6 Cg_exo -60.63 136.38 66.58 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 122.592 2.195 . . . . 0.0 111.873 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.614 ' C ' ' O ' ' A' ' 700' ' ' PRO . 38.8 m170 -0.56 69.95 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.665 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.592 ' N ' ' O ' ' A' ' 700' ' ' PRO . 11.4 Cg_endo -58.16 147.72 82.1 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.192 1.928 . . . . 0.0 111.869 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.73 152.62 34.01 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.664 2.243 . . . . 0.0 112.197 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.423 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 29.2 mt -76.87 139.09 40.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.286 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 722' ' ' SER . 16.9 t -122.94 130.98 74.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.12 0.486 . . . . 0.0 111.554 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.6 mp -119.23 138.96 52.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.996 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 707' ' ' PHE . . . . . 0.544 ' CE2' HD21 ' A' ' 717' ' ' LEU . 35.8 m-85 -108.93 126.8 53.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.918 0.39 . . . . 0.0 110.89 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.9 mt -97.46 145.91 25.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.308 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 97.77 -127.64 9.29 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.825 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 710' ' ' GLU . . . . . 0.52 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.1 OUTLIER -87.15 153.99 54.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.993 0.425 . . . . 0.0 111.245 -178.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.02 161.99 24.18 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.916 2.411 . . . . 0.0 112.425 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.673 ' HB3' HD23 ' A' ' 717' ' ' LEU . 26.5 Cg_endo -62.85 151.03 86.38 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 123.39 2.727 . . . . 0.0 112.683 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.544 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.7 t -86.91 16.15 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.381 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 714' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.5 OUTLIER -161.81 143.24 8.41 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.0 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.41 -20.43 31.8 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.643 2.228 . . . . 0.0 111.881 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 716' ' ' LEU . 84.8 mt -70.06 -34.08 72.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.673 HD23 ' HB3' ' A' ' 712' ' ' PRO . 59.6 tp -75.5 -35.18 60.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.692 179.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 718' ' ' THR . . . . . 0.409 ' OG1' ' HG2' ' A' ' 712' ' ' PRO . 57.3 m -62.6 -41.55 99.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.9 92.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.094 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -75.11 -28.54 60.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.14 144.58 51.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.598 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.612 ' N ' ' O ' ' A' ' 705' ' ' VAL . 32.7 t -86.16 -27.28 24.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.443 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 122.88 0.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.837 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 28.8 mm -89.55 122.83 41.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.53 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 5.0 mp -109.05 146.21 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.971 0.415 . . . . 0.0 110.796 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.6 p -167.93 -22.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.954 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.67 81.03 64.95 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.665 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -46.22 122.53 5.56 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.751 2.301 . . . . 0.0 112.453 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 24.2 tp 179.2 141.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.57 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 60.94 68.75 1.2 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.915 0.388 . . . . 0.0 110.718 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -51.91 -1.32 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.955 2.436 . . . . 0.0 112.027 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 730' ' ' ASP . 1.4 pt20 -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.866 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.91 -45.84 84.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.085 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.0 tp -57.98 -48.0 81.3 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.42 -41.86 93.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 64.6 m -59.83 -40.51 88.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.621 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 41.7 m -61.08 -45.77 93.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.9 -41.73 86.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.091 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.43 ' C ' ' H ' ' A' ' 741' ' ' LEU . 11.0 tp-100 -64.53 -35.92 82.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.317 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.76 -11.35 1.98 Allowed Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 739' ' ' GLN . 24.3 tp -152.84 91.6 1.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.88 0.372 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.492 ' N ' ' CD ' ' A' ' 743' ' ' PRO . 6.3 p -138.6 51.18 3.42 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.666 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 742' ' ' CYS . 67.6 Cg_endo -77.79 117.44 4.23 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.343 2.029 . . . . 0.0 111.029 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -84.39 127.02 3.76 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 122.406 2.07 . . . . 0.0 112.092 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.642 -179.793 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 87.49 178.9 48.16 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -92.94 134.31 35.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.707 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.665 ' HB ' HG12 ' A' ' 654' ' ' VAL . 2.4 mp -115.42 139.8 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.297 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 1.015 ' C ' HD13 ' A' ' 632' ' ' LEU . 8.4 tt -112.51 129.59 56.29 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.621 -0.431 . . . . 0.0 110.596 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 1.03 HD22 ' H ' ' A' ' 632' ' ' LEU . 0.0 OUTLIER -130.99 122.29 26.58 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.732 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.768 HD22 ' SG ' ' A' ' 686' ' ' CYS . 7.0 tt -108.32 125.28 51.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.963 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.698 ' OE2' HD12 ' A' ' 708' ' ' LEU . 94.0 mt-10 -158.4 170.24 22.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.069 0.461 . . . . 0.0 110.909 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.561 ' OE2' ' O ' ' A' ' 682' ' ' PRO . 95.8 mt-10 -114.76 162.11 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.987 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 69.59 123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.34 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.489 ' O ' ' OG1' ' A' ' 641' ' ' THR . 90.9 m-20 -58.83 -34.4 71.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.185 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.484 ' O ' HG23 ' A' ' 642' ' ' VAL . 44.1 tp10 -63.64 -42.05 98.17 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.064 -179.199 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.46 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.812 0.339 . . . . 0.0 110.888 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.434 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -65.87 -39.68 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.049 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 54.3 m -62.84 -45.07 94.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.064 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 638' ' ' GLU . 52.8 t -56.7 -52.56 52.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.896 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 57.4 t -60.22 -46.28 94.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.541 ' O ' ' OG1' ' A' ' 648' ' ' THR . 96.1 m -66.99 -36.8 82.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -61.67 -38.28 87.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.477 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.3 mtt -68.36 -50.61 51.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.29 -43.63 77.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.625 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.541 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 41.1 m -56.17 -41.55 75.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.34 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.1 73.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.74 -1.81 17.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.542 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 82.4 10.63 83.26 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -91.43 140.39 29.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -93.52 120.32 33.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.665 HG12 ' HB ' ' A' ' 630' ' ' ILE . 5.7 m -129.0 150.42 34.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.941 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 655' ' ' ILE . . . . . 0.674 ' O ' HD22 ' A' ' 632' ' ' LEU . 24.1 mm -111.8 127.12 69.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.888 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.618 ' C ' HD22 ' A' ' 657' ' ' LEU . 32.6 t90 -93.76 118.54 31.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.997 0.427 . . . . 0.0 111.285 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 656' ' ' TRP . 4.0 mm? -115.59 144.51 43.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.456 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.542 ' O ' HG22 ' A' ' 658' ' ' VAL . 9.7 p -113.8 12.08 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -147.49 123.6 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.414 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -61.11 -43.89 98.85 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 17.6 t -59.69 -48.68 80.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 110.931 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.9 m -64.27 -38.02 89.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 663' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.38 98.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.946 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 87.1 mt -58.57 -43.4 89.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.712 0.292 . . . . 0.0 111.09 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.8 -40.89 96.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.056 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -86.29 -41.99 14.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.928 HD12 HD13 ' A' ' 631' ' ' LEU . 9.3 tt -47.68 -38.14 14.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -56.54 -37.09 70.02 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 60.8 mt -77.71 -30.31 51.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.605 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.985 HD12 HD12 ' A' ' 631' ' ' LEU . 16.2 mt -72.04 -36.16 69.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.558 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.464 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 15.6 mm100 46.68 62.4 11.66 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -178.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 66.3 Cg_endo -81.67 156.03 18.42 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 123.37 2.713 . . . . 0.0 112.957 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.616 ' CG2' HD12 ' A' ' 741' ' ' LEU . 81.0 mt -96.54 -23.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.681 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 48.7 t -138.65 139.11 41.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.903 0.383 . . . . 0.0 110.75 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.549 ' C ' HD12 ' A' ' 676' ' ' LEU . 72.0 mt -128.6 123.44 59.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.588 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 676' ' ' LEU . 7.9 mp -105.67 131.98 52.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.2 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.535 ' SD ' HD22 ' A' ' 689' ' ' LEU . 69.2 mtm -138.06 138.68 39.02 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.527 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.538 ' C ' ' OD2' ' A' ' 683' ' ' ASP . . . -65.91 151.1 47.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.64 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.736 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 74.5 t-105 -113.43 -21.99 0.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.265 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 92.1 Cg_exo -44.48 159.93 0.11 Allowed 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.698 1.599 . . . . 0.0 111.388 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.585 ' C ' ' H ' ' A' ' 683' ' ' ASP . 13.9 Cg_exo -52.24 -45.61 38.17 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.099 1.866 . . . . 0.0 112.677 -178.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.561 ' O ' ' OE2' ' A' ' 635' ' ' GLU . 31.3 Cg_exo -49.3 -8.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 121.734 1.622 . . . . 0.0 110.626 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.585 ' H ' ' C ' ' A' ' 681' ' ' PRO . 74.7 m-20 -83.42 24.67 0.81 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.831 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.35 -40.84 65.24 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.359 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 93.0 p -69.14 -35.41 76.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.458 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.768 ' SG ' HD22 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -62.35 -19.11 63.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.008 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.14 -32.99 74.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.772 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.701 ' C ' HD12 ' A' ' 688' ' ' LEU . 1.6 pp -70.09 -44.1 69.73 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.725 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.584 ' N ' HD12 ' A' ' 688' ' ' LEU . 8.0 tt -60.68 -41.4 95.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 61.1 tp -60.39 -36.1 77.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.156 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -59.98 -45.03 94.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.834 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -57.66 -50.6 72.63 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.448 -0.501 . . . . 0.0 109.949 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.8 mt -56.17 -34.92 66.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.379 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -60.57 -40.79 92.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.5 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.28 -31.86 70.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.985 0.421 . . . . 0.0 110.172 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -98.08 10.4 40.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.519 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.568 ' OE1' ' NE2' ' A' ' 720' ' ' GLN . 11.2 tp-100 -54.9 -15.52 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.734 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.583 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -80.97 131.56 35.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.583 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 4.4 t0 87.8 128.88 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.072 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -81.0 -11.96 12.12 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.593 2.195 . . . . 0.0 112.873 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.472 ' N ' ' HD2' ' A' ' 702' ' ' PRO . 0.1 OUTLIER -43.0 -53.31 10.53 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.781 0.324 . . . . 0.0 110.916 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 701' ' ' HIS . 65.6 Cg_exo -45.11 156.57 0.27 Allowed 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.874 2.382 . . . . 0.0 112.391 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.92 158.77 36.72 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 123.069 2.512 . . . . 0.0 112.466 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.503 ' H ' HD12 ' A' ' 704' ' ' LEU . 3.6 mp -77.12 149.67 35.66 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.493 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 35.7 t -114.86 129.22 71.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.352 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.834 ' HG ' ' HB3' ' A' ' 723' ' ' ALA . 5.7 mp -121.7 136.49 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.124 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -111.61 127.88 55.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.398 . . . . 0.0 111.186 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.698 HD12 ' OE2' ' A' ' 634' ' ' GLU . 72.7 mt -97.16 148.38 23.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.496 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 106.88 -132.36 11.1 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -89.88 175.18 4.03 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.382 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -82.53 135.71 8.23 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.742 2.295 . . . . 0.0 112.414 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.75 ' HB3' HD23 ' A' ' 717' ' ' LEU . 37.6 Cg_exo -51.31 150.81 14.17 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.114 1.876 . . . . 0.0 111.59 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.82 -39.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.687 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 132.14 81.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.497 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -72.19 -28.39 15.62 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.267 1.978 . . . . 0.0 111.818 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 72.1 mt -72.05 -28.84 63.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.573 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.75 HD23 ' HB3' ' A' ' 712' ' ' PRO . 40.4 tp -75.19 -42.82 54.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.858 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 718' ' ' THR . . . . . 0.601 HG23 HD12 ' A' ' 724' ' ' ILE . 57.3 m -64.6 -45.32 87.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.047 178.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.66 84.2 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.515 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.568 ' NE2' ' OE1' ' A' ' 697' ' ' GLN . 67.4 tp60 -77.73 -17.46 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.455 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.97 147.71 48.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.425 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 62.9 p -83.19 -25.08 32.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.135 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.834 ' HB3' ' HG ' ' A' ' 706' ' ' LEU . . . -171.8 157.98 4.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.563 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.601 HD12 HG23 ' A' ' 718' ' ' THR . 70.1 mt -148.65 123.33 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.395 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.45 HD11 HD13 ' A' ' 734' ' ' LEU . 46.7 mt -102.59 147.85 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.44 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.4 p -167.59 -16.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.724 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -132.07 78.26 69.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.613 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -54.03 147.81 41.72 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.636 2.224 . . . . 0.0 111.74 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 6.2 tp -178.11 -38.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.159 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.65 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 -142.98 82.29 12.16 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.15 0.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.856 2.371 . . . . 0.0 111.669 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.65 ' H ' ' C ' ' A' ' 730' ' ' ASP . 90.5 mt-30 -69.56 -29.98 67.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.666 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.48 78.07 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.45 HD13 HD11 ' A' ' 725' ' ' LEU . 13.5 tp -57.85 -46.41 84.85 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 88.4 mt -63.98 -40.48 96.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.002 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 736' ' ' THR . . . . . 0.501 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 28.6 m -59.6 -39.2 83.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 27.4 m -62.31 -47.63 83.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.016 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.462 ' C ' HD23 ' A' ' 738' ' ' LEU . 8.8 tt -66.18 -41.01 90.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.859 0.362 . . . . 0.0 110.573 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -64.0 -28.08 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.101 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.59 -44.84 12.09 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.616 HD12 ' CG2' ' A' ' 673' ' ' ILE . 58.9 mt -88.0 -94.64 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.222 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.8 t 53.86 62.9 8.47 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -80.82 116.37 3.16 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.078 1.852 . . . . 0.0 110.988 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -86.56 154.02 9.03 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.775 2.317 . . . . 0.0 112.464 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.895 -1.05 . . . . 0.0 110.464 179.856 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -173.27 -179.13 43.75 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -93.57 134.39 35.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.875 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.411 ' CG2' ' CD1' ' A' ' 676' ' ' LEU . 67.1 mt -118.38 138.82 47.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.12 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.871 HD13 ' C ' ' A' ' 631' ' ' LEU . 3.2 tm? -110.06 124.05 50.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.64 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.713 ' N ' HD13 ' A' ' 631' ' ' LEU . 20.3 tp -113.26 122.1 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.726 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.458 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 17.6 tp -108.67 117.97 35.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.458 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 94.4 mt-10 -158.76 172.2 18.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.531 -178.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 636' ' ' GLU . 48.8 tp10 -106.82 152.44 23.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.127 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 635' ' ' GLU . 83.5 tt0 69.29 127.11 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.018 0.437 . . . . 0.0 110.543 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.689 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.4 p30 -66.25 -33.66 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.489 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.852 ' O ' HG23 ' A' ' 642' ' ' VAL . 96.7 mt-10 -66.18 -42.24 89.17 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.82 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.63 -45.42 62.1 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.864 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.437 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -64.96 -40.91 95.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.917 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.557 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 32.3 m -62.58 -43.72 98.12 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.631 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 638' ' ' GLU . 84.0 t -53.78 -49.23 59.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.872 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.8 t -58.82 -42.85 86.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.009 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.497 ' O ' ' OG1' ' A' ' 648' ' ' THR . 99.2 m -64.9 -36.61 84.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.369 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -62.06 -38.42 88.73 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.957 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 646' ' ' MET . . . . . 0.402 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 64.7 mtt -68.58 -47.89 65.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.32 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.591 ' CD2' ' N ' ' A' ' 647' ' ' LEU . 1.6 mm? -69.48 -43.99 72.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.119 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.8 m -56.09 -40.51 73.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.867 179.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.8 72.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.555 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.95 -4.76 37.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.14 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.76 -0.36 60.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 652' ' ' PHE . . . . . 0.41 ' HB3' HD12 ' A' ' 630' ' ' ILE . 88.5 m-85 -93.57 141.7 28.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 0.0 110.648 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -91.83 122.06 34.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.96 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.545 HG21 ' HB2' ' A' ' 647' ' ' LEU . 23.1 t -120.11 135.48 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.183 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 655' ' ' ILE . . . . . 0.582 HD12 HD22 ' A' ' 670' ' ' LEU . 63.4 mt -110.67 131.69 61.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.138 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.59 ' O ' HD22 ' A' ' 657' ' ' LEU . 13.8 t90 -95.15 120.17 34.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.381 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 656' ' ' TRP . 3.3 mm? -116.16 135.13 54.2 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.483 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.58 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 0.2 OUTLIER -100.41 2.54 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.295 179.629 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.58 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 80.1 m-20 -146.69 162.12 39.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.107 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.401 ' H ' ' HB3' ' A' ' 685' ' ' SER . . . -87.28 -48.75 4.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.768 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 t -57.57 -41.25 80.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.741 0.305 . . . . 0.0 111.054 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 50.6 m -62.84 -37.13 85.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.192 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.49 -40.09 96.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.818 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 39.0 mt -60.01 -43.14 95.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.016 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -63.08 -39.26 94.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -88.43 -49.92 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.391 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.4 tt -46.28 -42.67 14.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.332 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.55 -33.38 73.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.758 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 66.6 mt -74.23 -45.06 50.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.731 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.582 HD22 HD12 ' A' ' 655' ' ' ILE . 1.0 OUTLIER -83.19 -18.01 40.81 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 670' ' ' LEU . 76.9 mm-40 40.87 78.49 0.37 Allowed Pre-proline 0 C--N 1.33 -0.278 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.105 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.44 153.36 39.67 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 122.858 2.372 . . . . 0.0 112.774 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 78.4 mt -93.14 -19.11 6.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 121.049 0.452 . . . . 0.0 110.001 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 45.1 t -139.46 135.16 40.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.787 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.465 HG22 ' HG3' ' A' ' 677' ' ' MET . 77.8 mt -123.85 121.26 61.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.968 0.413 . . . . 0.0 111.492 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.411 ' CD1' ' CG2' ' A' ' 630' ' ' ILE . 4.1 mp -105.39 127.52 53.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.633 ' SD ' HD22 ' A' ' 689' ' ' LEU . 69.0 mtm -140.42 133.95 30.09 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.904 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.416 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -67.99 152.62 45.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.286 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.738 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 24.6 t-105 -110.59 -28.27 0.14 Allowed Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.282 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.738 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.4 Cg_endo -98.16 26.1 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 123.241 2.627 . . . . 0.0 115.42 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 71.3 Cg_endo -79.97 154.49 22.74 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.439 1.426 . . . . 0.0 112.116 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -64.26 -35.08 53.45 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.826 2.351 . . . . 0.0 112.243 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.585 ' C ' ' H ' ' A' ' 685' ' ' SER . 65.8 t0 -87.13 112.25 21.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.039 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -64.15 12.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.862 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 685' ' ' SER . . . . . 0.585 ' H ' ' C ' ' A' ' 683' ' ' ASP . 55.9 m -60.05 -29.82 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.801 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.506 ' SG ' ' HG3' ' A' ' 681' ' ' PRO . 19.4 m -59.5 -38.28 80.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.64 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 687' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 687' ' ' LEU . 62.3 mt -67.47 -34.97 78.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.857 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.72 -42.12 82.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.886 0.374 . . . . 0.0 110.351 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.771 ' O ' HD23 ' A' ' 689' ' ' LEU . 7.2 tt -60.57 -39.53 88.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.155 0.502 . . . . 0.0 109.875 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.631 HD11 HD22 ' A' ' 717' ' ' LEU . 9.0 tt -59.84 -41.54 91.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.648 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.58 -40.49 91.9 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.501 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -57.18 -46.03 83.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.311 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.55 -49.78 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.765 ' NH1' HD21 ' A' ' 716' ' ' LEU . 54.0 ttt85 -69.05 -27.34 65.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.582 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 695' ' ' GLU . . . . . 0.661 ' O ' ' CD2' ' A' ' 696' ' ' HIS . 31.1 tp10 -62.93 -34.56 77.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.814 -178.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.661 ' CD2' ' O ' ' A' ' 695' ' ' GLU . 6.8 p80 143.97 38.49 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.246 0.341 . . . . 0.0 111.876 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 697' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -61.84 -43.73 98.26 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.778 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.597 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . -155.56 88.55 1.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.451 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.597 ' O ' ' O ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER 44.74 174.81 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.689 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 699' ' ' ASP . 27.6 Cg_exo -58.83 -9.34 7.37 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.596 2.197 . . . . 0.0 112.289 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -124.07 70.24 50.71 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.825 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.485 ' HA ' ' HB3' ' A' ' 698' ' ' ALA . 29.5 Cg_endo -66.31 165.44 24.62 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.705 2.27 . . . . 0.0 112.521 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -41.31 168.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 123.263 2.642 . . . . 0.0 112.633 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.727 ' N ' HD12 ' A' ' 704' ' ' LEU . 5.6 mp -76.93 142.76 39.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.064 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.3 t -126.61 135.25 64.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.207 0.527 . . . . 0.0 111.656 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.769 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 50.8 mt -110.33 132.94 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.304 178.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.12 126.68 55.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.924 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.744 ' CD2' HD12 ' A' ' 725' ' ' LEU . 49.2 mt -95.7 150.68 20.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.536 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 94.58 -134.88 12.19 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.71 156.77 44.69 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.951 0.405 . . . . 0.0 111.053 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.57 148.47 26.13 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 123.045 2.497 . . . . 0.0 112.326 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.592 ' HD2' HD13 ' A' ' 724' ' ' ILE . 28.9 Cg_endo -65.35 151.12 86.15 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 122.604 2.203 . . . . 0.0 111.458 179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 43.0 t -77.94 -42.88 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.942 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -72.99 140.65 80.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -75.96 -12.21 19.69 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.622 2.214 . . . . 0.0 112.61 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.765 HD21 ' NH1' ' A' ' 694' ' ' ARG . 38.6 tp -69.5 -35.87 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.926 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.631 HD22 HD11 ' A' ' 690' ' ' LEU . 66.8 mt -75.21 -34.49 61.49 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 27.1 m -63.66 -42.05 98.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.093 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.16 -39.22 93.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.094 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.509 ' OE1' ' NH1' ' A' ' 694' ' ' ARG . 25.1 mt-30 -77.58 -19.96 54.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.175 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -74.46 132.94 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.868 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.4 p -85.73 -27.04 25.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.834 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.769 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -172.72 112.62 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.917 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.592 HD13 ' HD2' ' A' ' 712' ' ' PRO . 64.6 mt -91.1 133.51 32.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.346 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.744 HD12 ' CD2' ' A' ' 708' ' ' LEU . 35.5 mt -106.93 147.04 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.974 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 726' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 725' ' ' LEU . 2.9 m -168.78 5.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.379 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -134.56 78.87 55.25 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.474 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.28 137.7 76.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.917 1.744 . . . . 0.0 112.198 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' A' ' 730' ' ' ASP . 30.6 tp -179.23 112.87 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.541 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 732' ' ' GLN . 5.5 m-20 51.32 100.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.2 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 731' ' ' PRO . . . . . 0.402 ' HB3' ' SD ' ' A' ' 646' ' ' MET . 76.8 Cg_exo -46.51 -7.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.53 0 C-N-CA 122.692 2.261 . . . . 0.0 112.257 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 730' ' ' ASP . 92.1 mt-30 -71.75 -28.28 63.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.002 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 35.6 tp -66.7 -44.58 81.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.781 ' C ' HD23 ' A' ' 734' ' ' LEU . 7.0 tt -57.78 -47.06 83.61 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.256 0.551 . . . . 0.0 109.591 178.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.94 -37.84 88.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.569 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.2 m -58.06 -39.34 78.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.487 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.0 m -59.97 -41.94 93.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.587 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.42 -35.22 80.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.232 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.462 ' C ' ' N ' ' A' ' 741' ' ' LEU . 47.8 tt0 -62.1 -34.43 76.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.52 -13.01 0.22 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.544 ' O ' ' N ' ' A' ' 743' ' ' PRO . 14.1 tp -79.01 -25.06 43.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.58 0.229 . . . . 0.0 110.487 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.575 ' CB ' ' CD ' ' A' ' 743' ' ' PRO . 1.9 m 30.08 -85.53 0.0 OUTLIER Pre-proline 0 CA--C 1.532 0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.416 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.575 ' CD ' ' CB ' ' A' ' 742' ' ' CYS . 11.3 Cg_endo -56.44 119.18 6.22 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 120.377 1.171 . . . . 0.0 111.354 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 -1.36 11.53 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.633 2.222 . . . . 0.0 112.075 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.457 -179.903 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.522 ' N ' ' CE1' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 82.48 22.26 58.81 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 629' ' ' HIS . . . . . 0.522 ' CE1' ' N ' ' A' ' 627' ' ' ALA . 35.1 m80 -89.74 133.51 34.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.595 ' C ' HD22 ' A' ' 631' ' ' LEU . 67.5 mt -113.99 135.78 52.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.627 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.595 HD22 ' C ' ' A' ' 630' ' ' ILE . 2.4 mm? -110.53 137.25 48.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.629 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 17.6 tp -126.58 125.81 42.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.582 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.752 HD23 ' SG ' ' A' ' 686' ' ' CYS . 24.8 tp -110.81 115.53 29.69 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.617 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 85.7 tt0 -159.59 161.2 35.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.804 -179.355 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 92.5 mt-10 -112.99 158.84 19.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 74.23 119.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.208 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.555 ' O ' ' OG1' ' A' ' 641' ' ' THR . 93.3 m-20 -57.5 -36.72 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.422 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.781 ' O ' HG23 ' A' ' 642' ' ' VAL . 84.0 tt0 -63.69 -43.62 96.08 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.677 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.589 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -77.46 -45.42 25.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.517 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.5 -43.18 90.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.959 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.555 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 61.3 m -63.85 -42.91 97.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.215 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 638' ' ' GLU . 51.2 t -55.59 -53.27 38.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.034 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.94 -42.57 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.431 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.545 ' SG ' HG13 ' A' ' 654' ' ' VAL . 3.3 t -60.93 -41.77 96.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.579 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.02 -38.44 88.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.621 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 646' ' ' MET . . . . . 0.483 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 61.2 ttp -70.09 -52.1 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 83.6 mt -64.73 -44.9 88.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.039 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.1 m -56.66 -40.99 76.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.075 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.06 -29.41 70.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.935 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -65.27 -5.22 6.59 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.892 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.61 -8.12 71.29 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -95.41 147.93 23.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.666 0.269 . . . . 0.0 110.424 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -91.71 129.63 37.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.991 0.424 . . . . 0.0 110.604 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.545 HG13 ' SG ' ' A' ' 644' ' ' CYS . 11.3 p -127.91 140.19 49.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.404 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 66.5 mt -108.65 133.4 53.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.129 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.618 ' C ' HD22 ' A' ' 657' ' ' LEU . 18.2 t90 -91.82 126.01 36.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.947 0.403 . . . . 0.0 110.835 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.1 mm? -112.24 145.62 39.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.463 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.553 HG12 ' CZ2' ' A' ' 656' ' ' TRP . 19.2 m -106.74 -3.97 10.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.753 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -151.59 132.36 14.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.693 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.25 -40.74 97.76 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 661' ' ' SER . . . . . 0.421 ' N ' ' OG ' ' A' ' 685' ' ' SER . 81.5 p -62.08 -39.96 94.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 54.8 m -64.44 -37.65 88.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.089 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.605 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -61.96 -41.09 97.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.327 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.678 HD21 ' HG ' ' A' ' 689' ' ' LEU . 86.0 mt -59.43 -41.62 89.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -63.25 -43.04 99.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.324 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -89.89 -52.15 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.175 0.512 . . . . 0.0 111.197 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.605 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.9 tt -48.24 -33.83 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.056 -178.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 668' ' ' ASP . . . . . 0.62 ' OD1' ' N ' ' A' ' 669' ' ' LEU . 46.4 p-10 -57.88 -38.77 76.37 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.34 -0.544 . . . . 0.0 110.46 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.62 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 63.3 mt -79.75 -24.46 41.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.967 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 631' ' ' LEU . 23.4 mt -71.9 -38.66 69.92 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.858 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.429 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 74.6 mm-40 48.9 62.67 11.78 Favored Pre-proline 0 C--N 1.329 -0.326 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.429 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 60.6 Cg_endo -79.52 159.62 25.52 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 123.36 2.707 . . . . 0.0 112.485 -179.22 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 73.5 mt -94.9 -23.27 5.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.52 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 51.7 t -138.8 133.52 41.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.162 0.506 . . . . 0.0 110.7 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 77.3 mt -128.2 121.22 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.958 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.446 HD12 ' N ' ' A' ' 676' ' ' LEU . 4.9 mp -105.29 128.92 53.7 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.832 ' SD ' HD13 ' A' ' 689' ' ' LEU . 70.5 mtm -142.02 142.8 32.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.552 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.621 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -65.78 152.57 44.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.883 178.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.752 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 72.5 t-105 -106.07 -23.79 0.19 Allowed Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.357 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.752 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.3 Cg_endo -100.32 29.29 0.12 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 123.219 2.613 . . . . 0.0 114.6 178.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.546 ' CD ' ' C ' ' A' ' 679' ' ' TRP . 63.4 Cg_endo -77.22 143.88 22.83 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.513 1.475 . . . . 0.0 111.903 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -66.97 -20.69 50.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.486 2.124 . . . . 0.0 112.12 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.404 ' C ' ' H ' ' A' ' 685' ' ' SER . 84.9 m-20 -87.27 117.38 25.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.109 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -65.65 -1.42 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.299 179.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 685' ' ' SER . . . . . 0.421 ' OG ' ' N ' ' A' ' 661' ' ' SER . 23.7 t -59.85 -34.44 73.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.437 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.752 ' SG ' HD23 ' A' ' 633' ' ' LEU . 0.6 OUTLIER -59.96 -41.89 92.9 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.168 0.509 . . . . 0.0 109.782 179.511 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.37 -32.72 74.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.675 179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 84.0 mt -67.82 -37.39 81.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.015 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.832 HD13 ' SD ' ' A' ' 677' ' ' MET . 8.0 tt -57.92 -45.33 86.72 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -62.04 -39.72 93.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.878 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -62.98 -46.07 89.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.252 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -55.84 -55.03 37.32 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.33 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.532 HD23 ' HE1' ' A' ' 696' ' ' HIS . 51.1 mt -55.8 -38.81 70.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.776 179.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 694' ' ' ARG . 39.9 ttm180 -62.62 -35.75 80.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.275 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -65.68 -35.76 81.71 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.123 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.532 ' HE1' HD23 ' A' ' 693' ' ' LEU . 0.0 OUTLIER -133.68 38.33 3.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.037 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 693' ' ' LEU . 21.2 pt20 -62.82 -26.38 68.71 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.602 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -86.28 -13.73 45.81 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.415 ' CB ' ' HD3' ' A' ' 700' ' ' PRO . 0.0 OUTLIER -73.96 -55.5 3.13 Favored Pre-proline 0 CA--C 1.534 0.329 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.942 -179.725 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.532 ' CD ' ' O ' ' A' ' 696' ' ' HIS . 85.8 Cg_endo -87.95 -158.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.862 2.375 . . . . 0.0 112.256 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -105.53 102.6 38.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.749 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -43.12 109.07 0.12 Allowed 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.509 2.139 . . . . 0.0 112.4 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.47 162.63 17.03 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.953 2.436 . . . . 0.0 112.087 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 61.4 mt -77.41 133.9 38.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.324 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.469 ' O ' ' N ' ' A' ' 722' ' ' SER . 52.8 t -125.47 132.51 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.956 0.408 . . . . 0.0 111.428 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.519 HD22 HD11 ' A' ' 734' ' ' LEU . 5.2 mp -116.92 134.28 54.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.188 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -110.99 127.47 55.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.93 0.395 . . . . 0.0 110.984 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 708' ' ' LEU . . . . . 0.82 ' N ' HD12 ' A' ' 708' ' ' LEU . 4.5 mp -96.74 145.54 25.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.522 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 105.3 -129.37 9.78 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.62 164.09 27.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.831 0.348 . . . . 0.0 110.507 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -72.93 160.83 45.1 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.865 2.377 . . . . 0.0 112.444 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.505 ' CD ' HD13 ' A' ' 724' ' ' ILE . 18.4 Cg_endo -62.7 156.11 55.09 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 123.019 2.48 . . . . 0.0 112.28 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.603 HG12 ' O ' ' A' ' 713' ' ' VAL . 22.0 t -83.42 10.3 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -161.76 140.43 7.19 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.324 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.07 -9.53 23.74 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.766 2.311 . . . . 0.0 112.753 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.7 tp -68.5 -35.2 77.17 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.351 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.582 ' O ' ' N ' ' A' ' 721' ' ' ALA . 81.7 mt -76.06 -31.85 59.0 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 97.4 m -61.82 -43.21 99.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.853 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.99 -40.86 95.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -74.74 -31.66 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.604 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 721' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -72.62 142.45 48.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 705' ' ' VAL . 65.2 p -85.36 -23.73 27.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.278 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.05 163.3 4.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.436 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.505 HD13 ' CD ' ' A' ' 712' ' ' PRO . 72.4 mt -143.09 124.35 11.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.691 ' N ' HD12 ' A' ' 725' ' ' LEU . 5.7 mp -104.51 153.6 20.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.615 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.43 18.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.433 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -139.3 88.47 12.9 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.447 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.658 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.3 Cg_exo -48.49 144.73 13.26 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.52 2.146 . . . . 0.0 111.894 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.658 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 13.5 tp 103.46 156.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.685 0.616 . . . . 0.0 110.246 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.474 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 1.4 t70 61.74 63.48 2.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.952 0.406 . . . . 0.0 111.062 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 731' ' ' PRO . . . . . 0.494 ' O ' HD23 ' A' ' 735' ' ' LEU . 33.4 Cg_endo -67.11 -4.59 11.86 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.961 2.441 . . . . 0.0 111.817 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -69.24 -29.29 67.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.908 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.1 -44.68 88.04 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.681 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.519 HD11 HD22 ' A' ' 706' ' ' LEU . 42.1 tp -59.43 -42.16 91.21 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.94 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 735' ' ' LEU . . . . . 0.494 HD23 ' O ' ' A' ' 731' ' ' PRO . 2.7 mm? -62.34 -41.05 98.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.192 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 36.1 m -59.23 -38.84 80.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.084 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.1 m -61.8 -43.03 99.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.796 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.94 -40.96 97.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.983 0.421 . . . . 0.0 110.129 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -64.99 -24.93 67.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.171 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.8 -20.36 0.42 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.55 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.402 ' N ' HD12 ' A' ' 741' ' ' LEU . 5.8 mp -81.22 -10.58 59.58 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.418 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 742' ' ' CYS . 36.5 t 54.52 62.37 8.43 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.905 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -78.31 116.63 3.92 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.089 1.859 . . . . 0.0 111.04 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -86.9 152.02 8.49 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.703 2.269 . . . . 0.0 112.47 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 25.0 m120 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.687 179.903 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 80.83 62.88 1.96 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 629' ' ' HIS . . . . . 0.52 ' CE1' ' HB3' ' A' ' 670' ' ' LEU . 13.9 p80 -84.53 164.43 18.76 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.723 ' HB ' HG22 ' A' ' 654' ' ' VAL . 64.1 mt -113.79 141.01 31.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.976 0.417 . . . . 0.0 111.522 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.666 HD23 HG23 ' A' ' 675' ' ' ILE . 9.9 tp -107.32 135.31 49.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.086 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 33.2 tp -133.93 118.98 18.52 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.227 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.461 HD23 ' C ' ' A' ' 633' ' ' LEU . 8.2 tt -112.07 117.44 32.66 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.511 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.1 tt0 -159.78 162.97 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.045 -179.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.511 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 95.3 mt-10 -97.35 167.9 10.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.897 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 61.55 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 110.038 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.433 ' O ' ' OG1' ' A' ' 641' ' ' THR . 52.5 t0 -57.93 -36.95 73.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.919 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.503 ' O ' HG23 ' A' ' 642' ' ' VAL . 54.7 mp0 -65.16 -43.78 90.64 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.737 -178.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.65 -44.17 62.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.618 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.09 93.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.078 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 50.9 m -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.711 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 638' ' ' GLU . 55.8 t -55.58 -51.91 53.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.142 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.6 t -60.68 -46.67 95.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.514 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.55 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.5 OUTLIER -66.42 -33.93 76.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.672 -179.905 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 645' ' ' GLU . . . . . 0.462 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 85.2 tt0 -60.37 -39.53 87.58 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.319 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 7.3 tpp -65.0 -50.59 65.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.103 0.478 . . . . 0.0 109.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.693 ' HB2' HG21 ' A' ' 654' ' ' VAL . 85.0 mt -67.36 -45.25 76.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.204 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 28.5 m -56.13 -43.52 78.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.622 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 649' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 651' ' ' GLY . . . -69.66 -23.91 63.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -63.92 2.93 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.979 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 651' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 649' ' ' ALA . . . 97.12 -15.63 62.14 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 652' ' ' PHE . . . . . 0.406 ' O ' ' HA ' ' A' ' 648' ' ' THR . 96.7 m-85 -93.79 152.01 19.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -93.3 125.42 37.89 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.319 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.723 HG22 ' HB ' ' A' ' 630' ' ' ILE . 22.9 t -117.83 134.79 60.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.697 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 655' ' ' ILE . . . . . 0.547 HD12 HD13 ' A' ' 670' ' ' LEU . 44.7 mt -109.06 131.4 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.065 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.467 ' C ' HD12 ' A' ' 657' ' ' LEU . 22.5 t90 -95.53 121.66 37.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.176 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.517 HD12 ' N ' ' A' ' 657' ' ' LEU . 7.1 mp -116.2 146.59 42.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.685 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.581 ' O ' HG22 ' A' ' 658' ' ' VAL . 8.8 p -123.26 21.45 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.625 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 660' ' ' GLY . 48.6 t0 -152.28 163.61 39.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.563 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.415 ' N ' ' OD1' ' A' ' 659' ' ' ASP . . . -100.4 -54.51 1.01 Allowed Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.98 -0.628 . . . . 0.0 111.824 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 33.7 m -57.21 -41.87 80.24 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.602 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 26.5 m -64.4 -35.15 79.96 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.584 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.44 -42.48 99.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.622 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.56 HD22 ' ND1' ' A' ' 692' ' ' HIS . 80.6 mt -59.49 -43.79 93.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.852 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -62.71 -41.94 99.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.484 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.409 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 94.2 mt-30 -89.28 -51.31 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 111.298 -179.548 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.661 HD12 HD22 ' A' ' 631' ' ' LEU . 3.9 tt -45.81 -37.68 6.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.265 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -56.14 -38.63 71.1 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.923 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.48 -31.46 53.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.101 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.547 HD13 HD12 ' A' ' 655' ' ' ILE . 11.1 mt -72.48 -38.48 68.19 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.247 -178.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 46.82 65.55 6.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 110.192 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.492 ' HB3' ' CE1' ' A' ' 629' ' ' HIS . 30.5 Cg_endo -68.99 152.81 73.23 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 123.159 2.572 . . . . 0.0 112.952 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.811 HG23 HG23 ' A' ' 674' ' ' VAL . 19.3 tt -95.5 -22.21 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.696 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.811 HG23 HG23 ' A' ' 673' ' ' ILE . 76.1 t -140.1 133.69 35.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.468 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.666 HG23 HD23 ' A' ' 631' ' ' LEU . 78.4 mt -123.31 122.31 64.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.574 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.675 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -106.53 138.97 41.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.538 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.944 ' SD ' HD21 ' A' ' 690' ' ' LEU . 83.8 mtp -139.1 128.15 23.78 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.51 144.04 53.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.567 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.798 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 0.5 OUTLIER -113.68 -29.96 0.11 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.151 179.474 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.798 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 41.0 Cg_exo -50.87 -40.09 57.92 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.293 1.996 . . . . 0.0 113.288 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 23.4 Cg_exo -60.58 166.19 10.22 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.97 1.78 . . . . 0.0 111.961 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.512 ' O ' ' O ' ' A' ' 683' ' ' ASP . 32.1 Cg_exo -52.0 -17.97 6.35 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.532 2.154 . . . . 0.0 112.009 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 682' ' ' PRO . 1.0 OUTLIER 58.24 132.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.988 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -176.8 -78.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.736 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 77.3 p -64.08 -30.65 71.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.969 0.414 . . . . 0.0 109.941 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 2.4 m -62.42 -32.69 73.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.019 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.0 mt -64.58 -31.56 72.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.486 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.7 mt -63.27 -42.67 99.14 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.036 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.437 HD12 HD21 ' A' ' 664' ' ' LEU . 25.4 tp -60.36 -42.83 96.56 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.944 HD21 ' SD ' ' A' ' 677' ' ' MET . 82.1 mt -61.58 -40.64 95.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.778 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.88 -40.29 97.09 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.062 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.56 ' ND1' HD22 ' A' ' 664' ' ' LEU . 12.1 t-80 -57.5 -51.54 69.02 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.456 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.559 ' O ' ' N ' ' A' ' 697' ' ' GLN . 62.5 mt -55.13 -43.15 73.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.345 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -64.44 -35.66 81.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -65.91 -32.25 73.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.121 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -149.92 49.62 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.454 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.559 ' N ' ' O ' ' A' ' 693' ' ' LEU . 7.7 tt0 -60.43 -48.83 80.05 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.169 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.543 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . 35.75 -147.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.282 0.563 . . . . 0.0 111.723 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.543 ' O ' ' O ' ' A' ' 698' ' ' ALA . 41.1 t0 38.83 104.73 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.0 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -48.63 147.02 10.04 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 C-N-CA 122.394 2.063 . . . . 0.0 111.348 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.504 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 0.0 OUTLIER 48.46 53.41 14.32 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 -178.953 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 702' ' ' PRO . . . . . 0.504 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 6.8 Cg_endo -51.44 171.55 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 123.02 2.48 . . . . 0.0 112.176 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -53.38 144.15 51.19 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.583 2.189 . . . . 0.0 111.789 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.552 ' H ' HD12 ' A' ' 704' ' ' LEU . 5.6 mp -79.39 138.42 37.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.359 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.535 ' C ' HD12 ' A' ' 706' ' ' LEU . 36.1 t -118.28 127.0 75.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.875 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.796 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.8 mp -115.63 129.85 56.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.942 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -109.15 128.23 54.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.014 0.435 . . . . 0.0 110.801 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 43.7 mt -95.44 149.97 20.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.561 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 101.34 -137.65 13.41 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -91.45 167.2 16.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.463 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.4 155.35 25.73 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.548 2.166 . . . . 0.0 112.483 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.47 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 22.5 Cg_endo -63.34 161.12 32.14 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 123.26 2.64 . . . . 0.0 112.07 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.1 -71.62 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 714' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.5 OUTLIER -70.97 148.07 94.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.663 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.91 -14.19 32.27 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.732 2.288 . . . . 0.0 112.222 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 74.2 mt -70.88 -31.52 68.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.411 ' O ' ' HB2' ' A' ' 721' ' ' ALA . 53.3 mt -77.03 -32.46 57.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 47.7 m -64.9 -43.54 92.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.039 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -66.18 -39.92 90.08 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.02 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -82.52 -11.55 58.38 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.454 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 721' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 717' ' ' LEU . . . -75.13 129.36 37.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.46 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.6 m -85.88 -23.0 27.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.057 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -168.44 139.37 2.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.351 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.551 ' C ' HD12 ' A' ' 725' ' ' LEU . 78.9 mt -123.73 126.11 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.656 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.794 ' N ' HD12 ' A' ' 725' ' ' LEU . 5.3 mp -106.82 151.9 24.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.679 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 60.7 p -167.1 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.062 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 74.99 79.38 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.018 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -48.95 125.29 12.82 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.397 2.065 . . . . 0.0 111.858 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.948 ' O ' HD23 ' A' ' 729' ' ' LEU . 0.5 OUTLIER -179.78 134.27 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.488 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.54 ' C ' ' H ' ' A' ' 732' ' ' GLN . 4.1 m-20 56.03 75.1 0.62 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.723 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.59 -7.56 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.625 2.217 . . . . 0.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 732' ' ' GLN . . . . . 0.54 ' H ' ' C ' ' A' ' 730' ' ' ASP . 14.4 mm100 -70.7 -26.41 63.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.299 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.43 -47.56 75.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.927 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 47.0 tp -58.13 -47.26 83.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.17 0.51 . . . . 0.0 109.662 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.6 tp -63.28 -38.65 91.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.133 179.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 736' ' ' THR . . . . . 0.499 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 59.5 m -58.29 -41.56 84.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.51 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 737' ' ' THR . . . . . 0.41 HG21 HD21 ' A' ' 706' ' ' LEU . 56.2 m -61.32 -41.21 96.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.922 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 13.6 tp -63.64 -39.04 93.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.364 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.486 ' O ' ' N ' ' A' ' 741' ' ' LEU . 55.0 tp60 -65.29 -32.5 74.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.985 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -46.72 -11.15 0.05 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.983 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.537 HD13 HD13 ' A' ' 673' ' ' ILE . 84.1 mt -79.86 -49.08 12.46 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.647 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 75.7 m 50.24 60.18 15.42 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.782 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -80.74 116.47 3.19 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.223 1.949 . . . . 0.0 111.247 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -86.19 150.0 9.32 Favored 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.662 2.242 . . . . 0.0 112.385 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 21.1 m120 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.506 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 72.58 52.58 9.79 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -87.55 144.18 26.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.716 0.293 . . . . 0.0 110.738 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 67.8 mt -119.21 132.37 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.621 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 51.2 tp -115.3 134.51 55.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.982 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.834 ' C ' HD12 ' A' ' 632' ' ' LEU . 0.2 OUTLIER -136.41 134.39 37.71 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.628 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.809 ' N ' HD12 ' A' ' 632' ' ' LEU . 25.9 tp -108.41 123.2 48.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.543 ' OE2' ' HB1' ' A' ' 639' ' ' ALA . 86.2 tt0 -159.45 155.32 26.35 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.509 -179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.461 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 75.8 mm-40 -95.76 167.01 11.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.492 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 62.48 112.41 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.654 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.9 p30 -64.94 -25.87 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.32 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.654 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.7 mt-10 -63.74 -40.62 97.18 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.37 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 639' ' ' ALA . . . . . 0.543 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -71.8 -41.65 68.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.292 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.477 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -67.44 -39.87 85.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.09 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 40.8 m -62.35 -44.09 97.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.796 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 638' ' ' GLU . 81.1 t -57.71 -50.47 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.66 -39.86 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.508 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.8 OUTLIER -59.04 -39.56 82.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -63.48 -36.79 84.93 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.782 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 59.8 mtt -68.75 -54.37 16.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.124 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 647' ' ' LEU . . . . . 0.552 ' N ' HD12 ' A' ' 647' ' ' LEU . 10.5 mp -67.08 -42.74 84.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.284 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 43.8 m -55.42 -42.53 74.27 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.456 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.07 -25.88 62.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.691 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.68 -5.01 40.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.992 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -9.57 70.48 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -98.2 134.13 41.68 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -92.62 127.45 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.121 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.418 HG13 ' SG ' ' A' ' 644' ' ' CYS . 14.4 p -122.84 139.78 48.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.041 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 67.7 mt -107.33 131.0 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.72 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.545 ' CZ2' ' CG1' ' A' ' 658' ' ' VAL . 10.3 t90 -94.78 117.36 30.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.473 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 663' ' ' ALA . 27.8 tp -116.44 149.73 38.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.546 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.545 ' CG1' ' CZ2' ' A' ' 656' ' ' TRP . 23.4 m -110.52 27.46 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.743 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.76 ' O ' HD13 ' A' ' 633' ' ' LEU . 67.9 m-20 -148.82 164.68 33.74 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.976 0.417 . . . . 0.0 111.143 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 660' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' A' ' 663' ' ' ALA . . . -109.47 -63.53 0.53 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 46.8 t -58.6 -40.78 84.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.0 110.725 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.6 m -62.64 -35.59 80.09 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 109.561 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.789 ' HB2' HD23 ' A' ' 657' ' ' LEU . . . -60.13 -45.55 92.62 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.418 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.827 ' O ' HD12 ' A' ' 664' ' ' LEU . 0.1 OUTLIER -57.97 -42.72 85.61 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.377 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 665' ' ' ASP . . . . . 0.508 ' N ' ' HG ' ' A' ' 664' ' ' LEU . 14.5 t70 -57.29 -39.6 76.05 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.158 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -94.56 -25.81 16.66 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.196 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.769 ' O ' HD23 ' A' ' 667' ' ' LEU . 7.5 tt -53.24 -35.22 59.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.022 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 668' ' ' ASP . . . . . 0.682 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 66.2 m-20 -54.92 -37.66 66.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.386 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 71.2 mt -76.76 -35.8 57.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.089 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.412 ' O ' ' C ' ' A' ' 671' ' ' GLN . 12.8 mt -70.44 -41.31 73.03 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.089 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.682 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 13.3 mt-30 41.35 64.64 5.15 Favored Pre-proline 0 C--N 1.331 -0.201 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -78.4 158.3 29.29 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 123.092 2.528 . . . . 0.0 113.47 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.868 HG23 HG23 ' A' ' 674' ' ' VAL . 5.9 tp -93.77 -21.28 6.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.554 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.868 HG23 HG23 ' A' ' 673' ' ' ILE . 62.1 t -142.19 137.75 29.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.539 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.508 ' C ' HD23 ' A' ' 676' ' ' LEU . 64.7 mt -127.07 120.24 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.645 HD23 ' N ' ' A' ' 676' ' ' LEU . 0.0 OUTLIER -107.37 134.1 50.93 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.156 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.9 mtm -139.13 136.2 34.89 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.404 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -66.59 144.88 56.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.382 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.742 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 4.7 t-105 -113.13 -33.56 0.11 Allowed Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.715 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.742 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 20.1 Cg_exo -56.1 -43.0 60.65 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.013 1.809 . . . . 0.0 112.696 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 84.7 Cg_endo -83.59 165.37 14.05 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.739 2.293 . . . . 0.0 111.684 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.94 -82.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.381 2.054 . . . . 0.0 111.655 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 56.07 43.67 26.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.876 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -57.71 -30.35 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.428 -179.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 94.2 p -64.61 -26.28 68.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.667 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -28.29 67.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.544 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 71.0 mt -62.7 -36.26 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.969 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 90.0 mt -68.42 -37.84 80.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.768 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.488 HD23 ' C ' ' A' ' 689' ' ' LEU . 8.6 tt -56.58 -46.37 80.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.608 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.44 -39.0 91.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.734 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -61.66 -41.04 96.97 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.394 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.612 ' CD2' HD13 ' A' ' 664' ' ' LEU . 32.2 t-80 -59.91 -48.39 81.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.911 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.95 -42.03 68.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.612 -0.435 . . . . 0.0 109.939 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.408 HH22 ' HB3' ' A' ' 716' ' ' LEU . 57.0 ttm-85 -65.73 -28.02 68.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.5 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.32 -39.32 89.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.901 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.463 ' CG ' ' N ' ' A' ' 697' ' ' GLN . 2.2 p80 -140.88 -38.42 0.43 Allowed 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 119.844 -0.742 . . . . 0.0 112.342 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.463 ' N ' ' CG ' ' A' ' 696' ' ' HIS . 59.2 tp60 -59.66 -24.99 64.35 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.962 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.646 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -85.18 144.57 28.08 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.657 0.265 . . . . 0.0 111.531 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.646 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 38.3 t0 107.71 -39.4 0.0 OUTLIER Pre-proline 0 N--CA 1.469 0.486 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.049 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.525 ' CD ' ' C ' ' A' ' 698' ' ' ALA . 79.4 Cg_endo -85.32 -94.76 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 122.294 1.996 . . . . 0.0 111.534 179.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -130.61 76.33 77.56 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.769 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -48.39 128.04 16.87 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.871 2.38 . . . . 0.0 112.426 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -73.81 163.31 37.44 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 C-N-CA 122.653 2.235 . . . . 0.0 112.015 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.76 ' H ' HD22 ' A' ' 704' ' ' LEU . 1.6 mm? -78.01 140.41 39.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.104 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 31.8 t -121.88 134.5 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.879 0.371 . . . . 0.0 111.127 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.797 HD22 ' HB3' ' A' ' 723' ' ' ALA . 47.4 mt -115.52 132.35 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.012 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -111.96 126.25 54.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.145 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.64 148.32 22.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.387 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 90.38 -128.89 9.48 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.27 163.13 37.94 Favored Pre-proline 0 CA--C 1.532 0.274 0 C-N-CA 121.264 -0.174 . . . . 0.0 110.763 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -68.45 138.9 43.59 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.157 1.904 . . . . 0.0 112.036 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.431 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -47.64 151.96 3.05 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.388 2.059 . . . . 0.0 112.496 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.543 HG13 ' N ' ' A' ' 714' ' ' ASP . 8.1 p -83.78 -46.61 18.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.115 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 714' ' ' ASP . . . . . 0.543 ' N ' HG13 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.24 147.56 90.58 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.423 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.22 -24.99 16.25 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.913 2.408 . . . . 0.0 113.175 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.408 ' HB3' HH22 ' A' ' 694' ' ' ARG . 77.0 mt -70.22 -29.61 66.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.923 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.707 HD12 ' N ' ' A' ' 717' ' ' LEU . 7.4 mp -77.76 -41.5 37.34 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.892 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 41.6 m -63.91 -42.81 97.31 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.03 90.4 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.969 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 720' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 720' ' ' GLN . 60.8 tt0 -83.82 -13.96 52.45 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.979 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 721' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -71.43 128.56 36.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.031 0.443 . . . . 0.0 110.809 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 31.9 t -85.5 -24.65 27.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.466 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.797 ' HB3' HD22 ' A' ' 706' ' ' LEU . . . -171.27 159.52 5.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.182 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 70.6 mt -136.39 125.93 38.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.779 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 50.7 mt -107.68 126.89 53.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.937 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 36.5 t -69.6 -87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.912 0.387 . . . . 0.0 110.358 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 727' ' ' LYS . . . . . 0.917 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 9.8 tttp -134.83 -34.49 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.833 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.917 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 36.9 Cg_exo -57.48 149.62 65.16 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.31 2.007 . . . . 0.0 112.659 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.48 -80.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.83 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 54.07 58.58 12.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.101 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -63.9 -15.77 50.99 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 C-N-CA 122.745 2.297 . . . . 0.0 112.165 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -70.78 -34.69 72.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.319 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.2 tp -68.85 -44.06 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.227 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.466 ' CD2' HD11 ' A' ' 647' ' ' LEU . 62.1 tp -53.19 -45.16 68.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.738 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.65 -40.22 96.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.218 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 58.3 m -58.6 -38.95 79.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.933 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 737' ' ' THR . . . . . 0.474 HG21 HD21 ' A' ' 706' ' ' LEU . 88.1 m -60.6 -39.69 89.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.994 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.511 ' CD2' HG21 ' A' ' 674' ' ' VAL . 23.5 mt -63.57 -42.38 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.659 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 741' ' ' LEU . 81.3 mt-30 -65.88 -28.71 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.244 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 740' ' ' GLY . . . . . 0.553 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -22.7 -45.76 0.01 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.56 ' N ' ' O ' ' A' ' 739' ' ' GLN . 0.1 OUTLIER -86.62 -109.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.242 179.769 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 86.4 m 58.12 60.95 5.77 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.576 -0.283 . . . . 0.0 111.066 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -81.23 117.04 3.1 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.144 1.896 . . . . 0.0 110.907 179.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 744' ' ' PRO . . . . . 0.601 ' O ' ' OD1' ' A' ' 745' ' ' ASN . 94.5 Cg_endo -86.0 142.55 7.7 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.619 2.213 . . . . 0.0 112.964 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 745' ' ' ASN . . . . . 0.601 ' OD1' ' O ' ' A' ' 744' ' ' PRO . 71.0 m-20 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.255 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -63.8 140.2 43.88 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 629' ' ' HIS . . . . . 0.443 ' HD1' ' HB3' ' A' ' 672' ' ' PRO . 21.7 t-80 -85.76 120.65 27.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.582 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.429 ' CG2' HD13 ' A' ' 676' ' ' LEU . 52.9 mt -117.68 135.48 57.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.755 0.312 . . . . 0.0 111.467 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.455 HD13 HD12 ' A' ' 667' ' ' LEU . 7.6 tt -108.17 127.62 53.99 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.047 0.451 . . . . 0.0 110.316 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.427 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 50.9 tp -110.15 125.05 52.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 9.0 tt -112.2 110.49 20.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.785 ' OE1' ' HB2' ' A' ' 678' ' ' ALA . 75.9 mm-40 -155.72 166.46 33.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.944 -179.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -111.98 165.36 12.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.23 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.3 tp10 65.76 121.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 111.078 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.526 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 81.6 m-20 -58.51 -37.18 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.023 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.55 ' O ' HG23 ' A' ' 642' ' ' VAL . 97.5 mt-10 -66.27 -45.26 81.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.061 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.7 -39.49 70.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.421 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 640' ' ' ALA . . . . . 0.636 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -68.35 -43.09 78.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.5 ' O ' ' N ' ' A' ' 645' ' ' GLU . 72.3 m -60.91 -43.55 98.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 638' ' ' GLU . 49.4 t -56.13 -54.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.771 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.65 -45.27 94.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.074 0.464 . . . . 0.0 110.112 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.598 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.4 OUTLIER -67.35 -41.0 85.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.893 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 645' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 641' ' ' THR . 86.0 tt0 -57.94 -40.6 80.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 80.8 mtp -67.04 -52.05 47.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.926 0.393 . . . . 0.0 110.428 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 80.4 mt -68.9 -43.28 75.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.826 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.598 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 34.5 m -56.24 -40.78 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.245 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.26 -25.85 62.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.684 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.71 -3.51 22.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.56 2.41 65.39 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.096 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -96.45 141.87 29.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 117.386 0.593 . . . . 0.0 110.651 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -87.85 110.89 20.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.215 0.531 . . . . 0.0 109.691 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.427 ' CG1' ' HB2' ' A' ' 632' ' ' LEU . 81.5 t -116.52 136.85 52.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.97 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 63.3 mt -108.9 133.42 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.851 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.636 ' CD1' ' HB1' ' A' ' 640' ' ' ALA . 23.8 t90 -92.96 111.59 23.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.756 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.794 ' CD2' ' HB2' ' A' ' 663' ' ' ALA . 22.7 tp -123.81 135.56 53.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.766 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 634' ' ' GLU . 21.1 m -105.72 -9.34 10.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.278 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.472 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 89.6 m-20 -100.95 152.04 21.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -102.78 -56.7 0.8 Allowed Glycine 0 CA--C 1.531 1.047 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.5 t -58.66 -40.78 84.47 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.888 0.375 . . . . 0.0 110.675 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 28.3 m -61.03 -38.85 87.61 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.794 ' HB2' ' CD2' ' A' ' 657' ' ' LEU . . . -61.55 -40.7 95.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.617 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.833 HD21 HD12 ' A' ' 689' ' ' LEU . 44.5 mt -57.8 -46.42 84.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.808 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.61 -43.49 93.59 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.817 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.401 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 94.0 mt-30 -84.67 -44.87 13.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.952 0.406 . . . . 0.0 111.391 -178.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.713 HD23 ' C ' ' A' ' 667' ' ' LEU . 9.6 tt -50.32 -35.06 25.97 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.5 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 668' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 664' ' ' LEU . 89.0 m-20 -55.36 -40.51 71.36 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.179 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 58.0 mt -74.5 -28.99 61.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 179.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 31.4 mt -72.39 -35.17 68.37 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.268 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.537 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 8.5 mm100 43.4 62.23 9.19 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.537 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 3.6 Cg_exo -72.35 156.59 54.59 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.397 2.732 . . . . 0.0 113.335 -178.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 70.9 mt -98.54 -27.52 3.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.609 HG22 ' HB2' ' A' ' 704' ' ' LEU . 38.8 t -137.04 132.97 47.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.511 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.547 ' C ' HD12 ' A' ' 676' ' ' LEU . 63.7 mt -128.67 125.21 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.227 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.1 mp -103.82 129.69 51.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.898 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.81 ' SD ' HD21 ' A' ' 690' ' ' LEU . 10.6 ptp -143.52 140.1 30.12 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.253 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.785 ' HB2' ' OE1' ' A' ' 634' ' ' GLU . . . -67.04 152.58 45.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.374 178.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.732 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 63.3 t-105 -106.4 -26.69 0.19 Allowed Pre-proline 0 C--O 1.233 0.217 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.362 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.8 Cg_endo -101.55 29.22 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 123.428 2.752 . . . . 0.0 114.6 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 66.1 Cg_endo -77.13 151.18 30.12 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.645 1.564 . . . . 0.0 111.966 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -71.82 -14.16 29.64 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.319 2.013 . . . . 0.0 112.376 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -87.63 112.47 22.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.777 0.323 . . . . 0.0 111.484 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -65.51 -8.98 22.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 87.9 p -64.53 -23.16 67.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -178.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.551 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -62.57 -38.61 90.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.052 0.453 . . . . 0.0 109.839 179.088 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 687' ' ' LEU . . . . . 0.551 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 76.0 mt -66.16 -35.83 81.51 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.992 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 688' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 688' ' ' LEU . 63.3 mt -66.52 -36.39 82.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.685 179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 689' ' ' LEU . . . . . 0.833 HD12 HD21 ' A' ' 664' ' ' LEU . 14.9 tp -59.56 -40.75 88.34 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 690' ' ' LEU . . . . . 0.81 HD21 ' SD ' ' A' ' 677' ' ' MET . 46.7 mt -59.61 -39.01 82.82 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.901 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.14 -42.21 94.39 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.62 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.7 ' HE2' ' CE1' ' A' ' 696' ' ' HIS . 4.1 t60 -62.63 -61.09 2.67 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.714 HD21 ' HA ' ' A' ' 690' ' ' LEU . 1.6 pp -54.55 -33.13 59.61 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.868 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.526 ' N ' HD12 ' A' ' 693' ' ' LEU . 23.5 ttt85 -60.82 -42.46 97.73 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.027 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -69.2 -39.79 78.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.7 ' CE1' ' HE2' ' A' ' 692' ' ' HIS . 64.5 m170 -96.11 14.3 24.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.632 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 693' ' ' LEU . 6.4 pt20 -58.07 -29.73 65.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.101 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -83.81 118.63 24.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.922 0.391 . . . . 0.0 111.039 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 701' ' ' HIS . 20.9 p-10 -172.96 135.57 0.73 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.426 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -43.62 -11.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.253 1.969 . . . . 0.0 111.937 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.585 ' N ' ' O ' ' A' ' 699' ' ' ASP . 0.3 OUTLIER -126.34 71.1 70.88 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.211 179.468 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.93 114.02 0.84 Allowed 'Trans proline' 0 C--N 1.307 -1.622 0 C-N-CA 122.802 2.334 . . . . 0.0 112.126 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.58 140.44 23.92 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 122.303 2.002 . . . . 0.0 112.183 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.708 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER -81.0 142.68 33.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.716 -179.771 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.739 ' C ' HD12 ' A' ' 706' ' ' LEU . 40.5 t -126.05 125.98 68.89 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.041 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.793 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.9 mp -122.4 135.6 54.72 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.067 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -111.23 130.3 55.69 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.132 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 72.4 mt -96.85 146.46 24.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.541 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 88.2 -136.38 13.72 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 710' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 710' ' ' GLU . 0.3 OUTLIER -87.31 151.04 50.54 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.082 0.468 . . . . 0.0 110.85 -179.231 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.17 156.14 65.78 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 123.112 2.541 . . . . 0.0 112.945 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.684 ' O ' ' N ' ' A' ' 714' ' ' ASP . 29.4 Cg_endo -67.53 3.68 1.68 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.871 2.38 . . . . 0.0 112.292 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 55.2 t 60.42 -38.84 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.684 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 714' ' ' ASP . . . . . 0.684 ' N ' ' O ' ' A' ' 712' ' ' PRO . 52.1 m-20 -70.08 133.15 87.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.38 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -73.91 -19.53 20.61 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 122.312 2.008 . . . . 0.0 113.088 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 716' ' ' LEU . . . . . 0.448 ' H ' HD12 ' A' ' 716' ' ' LEU . 5.3 mp -71.36 -40.82 70.38 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.295 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.56 -37.09 57.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.652 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 31.8 m -63.37 -39.68 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.64 91.96 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.784 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -78.97 -20.23 49.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.548 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 721' ' ' ALA . . . . . 0.477 ' CB ' HD11 ' A' ' 724' ' ' ILE . . . -71.38 142.79 50.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.53 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.408 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 91.9 p -85.95 -29.02 23.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.33 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -167.2 129.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.477 HD11 ' CB ' ' A' ' 721' ' ' ALA . 18.2 mm -98.19 128.3 49.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.542 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 725' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.1 mp -107.68 145.02 33.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.674 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 726' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 727' ' ' LYS . 12.3 t -164.86 -16.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.062 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 727' ' ' LYS . . . . . 0.424 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.1 OUTLIER -129.96 74.81 80.25 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.136 179.711 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -50.36 142.93 28.23 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.845 2.364 . . . . 0.0 112.748 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 729' ' ' LEU . . . . . 0.422 ' O ' ' O ' ' A' ' 730' ' ' ASP . 39.6 tp -174.43 93.17 0.08 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.402 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 729' ' ' LEU . 25.2 m-20 57.76 147.06 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.47 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -68.98 3.22 2.52 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 123.142 2.561 . . . . 0.0 112.319 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -67.42 -31.61 71.92 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.731 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 24.9 tp -67.69 -53.72 25.35 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.094 -0.642 . . . . 0.0 110.667 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 734' ' ' LEU . . . . . 0.643 HD11 HD21 ' A' ' 676' ' ' LEU . 9.1 tt -57.15 -41.37 79.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.038 0.447 . . . . 0.0 110.76 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 24.2 tp -60.03 -39.52 86.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 35.4 m -58.33 -39.42 79.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.388 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 52.2 m -60.8 -43.33 98.28 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.901 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 738' ' ' LEU . . . . . 0.425 ' CD2' HG21 ' A' ' 674' ' ' VAL . 57.6 mt -63.22 -37.01 85.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.108 0.48 . . . . 0.0 110.388 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -64.67 -29.18 70.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.082 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.69 -20.3 3.92 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 741' ' ' LEU . 67.4 mt -81.66 -74.2 0.35 Allowed 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.436 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.405 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 98.5 m 51.36 59.62 15.35 Favored Pre-proline 0 C--N 1.326 -0.456 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.293 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.405 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 60.6 Cg_endo -77.54 116.5 4.09 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 C-N-CA 122.465 2.11 . . . . 0.0 111.44 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 744' ' ' PRO . . . . . 0.553 ' HG2' ' H ' ' A' ' 745' ' ' ASN . 90.6 Cg_endo -86.44 -75.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.46 2.107 . . . . 0.0 112.469 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 745' ' ' ASN . . . . . 0.553 ' H ' ' HG2' ' A' ' 744' ' ' PRO . 25.6 t-20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.046 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 108.62 78.41 1.07 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -89.09 131.27 35.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 110.376 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 630' ' ' ILE . . . . . 0.681 ' HB ' HG12 ' A' ' 654' ' ' VAL . 54.6 mt -114.67 141.54 30.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 631' ' ' LEU . . . . . 0.743 HD21 HD12 ' A' ' 670' ' ' LEU . 83.2 mt -103.9 131.5 51.06 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.209 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 632' ' ' LEU . . . . . 0.474 HD11 HG11 ' A' ' 643' ' ' VAL . 10.6 tp -124.18 117.36 24.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.011 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.469 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 9.4 tt -117.21 120.1 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.386 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 634' ' ' GLU . . . . . 0.469 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 92.4 mt-10 -158.56 170.29 22.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.194 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 635' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 636' ' ' GLU . 96.4 mt-10 -110.06 158.52 18.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.352 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 636' ' ' GLU . . . . . 0.529 ' HG2' ' H ' ' A' ' 638' ' ' GLU . 83.3 tt0 62.16 127.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.925 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 637' ' ' ASP . . . . . 0.706 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 51.6 p30 -61.94 -29.97 70.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 638' ' ' GLU . . . . . 0.859 ' O ' HG23 ' A' ' 642' ' ' VAL . 50.8 tp10 -63.29 -41.11 98.95 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.058 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.62 59.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 110.278 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.97 76.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.064 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 641' ' ' THR . . . . . 0.574 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 67.1 m -62.47 -46.18 89.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.085 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 642' ' ' VAL . . . . . 0.859 HG23 ' O ' ' A' ' 638' ' ' GLU . 89.4 t -56.77 -52.66 51.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.285 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 643' ' ' VAL . . . . . 0.474 HG11 HD11 ' A' ' 632' ' ' LEU . 98.4 t -60.31 -41.9 88.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.803 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 644' ' ' CYS . . . . . 0.505 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.7 OUTLIER -58.58 -42.39 87.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.779 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.1 -39.28 91.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.171 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.0 mtt -66.97 -50.14 63.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.061 0.457 . . . . 0.0 110.109 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 73.1 mt -69.08 -46.03 68.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.293 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 648' ' ' THR . . . . . 0.505 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 61.7 m -56.3 -41.98 76.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.105 0.479 . . . . 0.0 109.858 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.95 -24.97 64.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.649 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.72 -6.24 39.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.905 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.41 -12.76 66.29 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.758 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -96.03 142.35 28.35 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.742 179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -92.77 134.34 35.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.184 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 654' ' ' VAL . . . . . 0.681 HG12 ' HB ' ' A' ' 630' ' ' ILE . 4.0 m -122.99 153.66 28.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.025 0.441 . . . . 0.0 111.099 -179.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 655' ' ' ILE . . . . . 0.446 ' CD1' HD13 ' A' ' 670' ' ' LEU . 69.6 mt -108.96 135.44 47.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.708 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 656' ' ' TRP . . . . . 0.682 ' C ' HD22 ' A' ' 657' ' ' LEU . 18.9 t90 -92.7 126.1 37.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 111.241 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 657' ' ' LEU . . . . . 0.682 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.9 mm? -115.12 143.2 45.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.677 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 658' ' ' VAL . . . . . 0.612 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 82.2 t -98.28 -18.95 6.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.17 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 659' ' ' ASP . . . . . 0.612 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 98.6 m-20 -147.85 150.13 33.58 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.473 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -65.49 -39.68 95.79 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 18.9 t -58.16 -40.34 81.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.759 0.314 . . . . 0.0 110.796 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.6 m -64.64 -38.94 92.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 663' ' ' ALA . . . . . 0.448 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.63 -46.41 85.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.495 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 664' ' ' LEU . . . . . 0.568 HD22 ' ND1' ' A' ' 692' ' ' HIS . 67.5 mt -59.39 -42.19 91.12 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.811 -0.355 . . . . 0.0 111.134 -179.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -62.74 -40.13 96.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.804 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 666' ' ' GLN . . . . . 0.403 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 84.0 mt-30 -84.63 -42.93 14.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.097 0.475 . . . . 0.0 110.66 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 667' ' ' LEU . . . . . 0.776 HD23 ' C ' ' A' ' 667' ' ' LEU . 8.7 tt -45.29 -44.6 11.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.215 -179.013 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -58.56 -35.02 71.7 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.25 -38.52 56.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.928 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.743 HD12 HD21 ' A' ' 631' ' ' LEU . 0.1 OUTLIER -77.41 -41.7 38.98 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.709 -178.832 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 671' ' ' GLN . . . . . 0.463 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 8.0 mm-40 58.88 62.71 4.18 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 0.0 109.899 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 672' ' ' PRO . . . . . 0.521 ' HG3' HD11 ' A' ' 631' ' ' LEU . 50.5 Cg_endo -80.35 165.76 20.76 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.365 2.71 . . . . 0.0 112.554 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 673' ' ' ILE . . . . . 0.408 ' CG2' HD22 ' A' ' 741' ' ' LEU . 97.2 mt -94.92 -19.63 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.139 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 674' ' ' VAL . . . . . 0.672 HG13 HG23 ' A' ' 630' ' ' ILE . 14.9 p -141.05 141.92 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.309 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.711 HD12 HD12 ' A' ' 631' ' ' LEU . 12.9 mm -119.93 124.51 72.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.134 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 676' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' A' ' 706' ' ' LEU . 51.1 mt -107.07 126.8 52.82 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 677' ' ' MET . . . . . 0.453 ' SD ' HG13 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -141.9 135.16 29.19 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.931 -0.707 . . . . 0.0 112.383 -178.699 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 678' ' ' ALA . . . . . 0.586 ' O ' ' SG ' ' A' ' 686' ' ' CYS . . . -68.09 152.55 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.67 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 679' ' ' TRP . . . . . 0.599 ' CG ' ' O ' ' A' ' 679' ' ' TRP . 74.6 t-105 -125.23 49.73 3.63 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.286 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' A' ' 679' ' ' TRP . 95.0 Cg_endo -84.2 135.07 6.18 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.547 2.165 . . . . 0.0 111.319 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 681' ' ' PRO . . . . . 0.608 ' C ' ' H ' ' A' ' 683' ' ' ASP . 16.3 Cg_exo -51.27 -47.42 25.99 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 121.93 1.754 . . . . 0.0 113.305 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 682' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 32.7 Cg_endo -65.91 29.58 0.1 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.69 1.594 . . . . 0.0 111.163 -179.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 683' ' ' ASP . . . . . 0.608 ' H ' ' C ' ' A' ' 681' ' ' PRO . 21.9 t70 -151.27 71.93 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.043 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.53 0.35 0.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.532 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 685' ' ' SER . . . . . 0.45 ' H ' ' C ' ' A' ' 683' ' ' ASP . 20.4 m -61.45 -33.41 73.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.299 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 686' ' ' CYS . . . . . 0.586 ' SG ' ' O ' ' A' ' 678' ' ' ALA . 91.0 m -59.05 -27.34 65.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.919 0.39 . . . . 0.0 110.342 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.68 -33.3 75.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.31 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.56 -39.1 84.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.301 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.53 -42.26 96.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.416 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.5 -44.1 96.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.868 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -61.99 -38.78 89.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.904 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 692' ' ' HIS . . . . . 0.568 ' ND1' HD22 ' A' ' 664' ' ' LEU . 9.9 t-160 -56.86 -50.12 73.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.0 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 693' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 697' ' ' GLN . 61.3 mt -55.07 -42.85 73.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.999 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 694' ' ' ARG . . . . . 0.753 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 84.2 mtp180 -67.68 -33.1 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -65.81 -32.15 73.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.488 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 696' ' ' HIS . . . . . 0.608 ' C ' ' H ' ' A' ' 698' ' ' ALA . 84.6 m-70 -126.25 -59.42 1.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.613 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 697' ' ' GLN . . . . . 0.639 ' N ' ' OE1' ' A' ' 697' ' ' GLN . 1.0 OUTLIER -63.85 19.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.374 -179.372 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.753 ' HB2' ' O ' ' A' ' 694' ' ' ARG . . . -86.02 21.7 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.898 0.38 . . . . 0.0 110.568 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 699' ' ' ASP . . . . . 0.591 ' H ' ' HD2' ' A' ' 700' ' ' PRO . 0.1 OUTLIER -168.73 -51.08 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.578 179.871 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 700' ' ' PRO . . . . . 0.591 ' HD2' ' H ' ' A' ' 699' ' ' ASP . 53.1 Cg_exo -52.41 -135.35 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.801 2.334 . . . . 0.0 112.054 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 701' ' ' HIS . . . . . 0.484 ' CD2' ' O ' ' A' ' 701' ' ' HIS . 39.6 p-80 -116.64 89.67 28.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.197 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.89 130.78 19.99 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.738 2.292 . . . . 0.0 112.549 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.97 166.35 29.41 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.687 2.258 . . . . 0.0 111.791 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.65 HD11 HG22 ' A' ' 737' ' ' THR . 6.4 tt -77.26 125.58 29.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.453 HG13 ' SD ' ' A' ' 677' ' ' MET . 61.2 t -122.81 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.121 0.486 . . . . 0.0 111.706 -179.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 706' ' ' LEU . . . . . 0.716 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 19.7 mt -118.35 135.92 54.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.692 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -107.88 121.57 45.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.599 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 40.3 mt -98.94 134.55 41.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.164 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 134.1 -138.01 9.74 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.411 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 710' ' ' GLU . . . . . 0.603 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.9 OUTLIER -93.59 -176.93 0.62 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.674 0.273 . . . . 0.0 111.017 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' A' ' 710' ' ' GLU . 19.4 Cg_exo -61.74 157.49 42.36 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.719 2.28 . . . . 0.0 112.323 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 712' ' ' PRO . . . . . 0.678 ' HB3' HD11 ' A' ' 717' ' ' LEU . 29.1 Cg_endo -65.45 146.07 84.36 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.174 2.583 . . . . 0.0 112.778 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 713' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 713' ' ' VAL . 54.4 t -84.22 -15.65 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.715 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -162.12 150.08 12.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.905 0.383 . . . . 0.0 110.398 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.4 -9.75 21.36 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.913 2.408 . . . . 0.0 112.939 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.4 mt -70.15 -39.88 75.1 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.767 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.759 ' C ' HD12 ' A' ' 717' ' ' LEU . 1.9 pp -80.56 -37.34 31.57 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 718' ' ' THR . . . . . 0.548 ' N ' HD12 ' A' ' 717' ' ' LEU . 30.9 m -63.83 -40.85 97.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.608 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.04 91.43 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-O 121.029 0.442 . . . . 0.0 109.998 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -74.25 -37.72 63.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.378 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.57 48.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.594 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 722' ' ' SER . . . . . 0.413 ' CB ' ' HG ' ' A' ' 704' ' ' LEU . 4.7 m -85.65 -23.15 27.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 723' ' ' ALA . . . . . 0.716 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -170.47 163.99 8.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.371 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 724' ' ' ILE . . . . . 0.408 HD13 HG21 ' A' ' 724' ' ' ILE . 31.6 mt -139.88 128.77 27.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.927 -179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 37.0 mt -106.9 125.41 50.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.131 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 59.0 m -72.1 -90.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.404 -179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 727' ' ' LYS . . . . . 0.891 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 26.9 tttt -130.71 -32.44 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 728' ' ' PRO . . . . . 0.891 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 48.0 Cg_exo -53.78 151.15 26.79 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.26 1.973 . . . . 0.0 112.08 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.54 -51.11 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.673 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 730' ' ' ASP . . . . . 0.477 ' N ' ' HD3' ' A' ' 731' ' ' PRO . 82.2 m-20 40.74 57.22 8.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.966 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 731' ' ' PRO . . . . . 0.477 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 68.1 Cg_endo -82.55 -28.11 1.91 Allowed 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.567 2.178 . . . . 0.0 112.045 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -73.5 -37.39 65.7 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 49.5 tp -67.31 -40.51 86.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.862 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 27.5 tp -55.55 -47.22 76.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.932 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 735' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 735' ' ' LEU . 9.4 tt -64.21 -44.42 91.99 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.271 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 91.3 m -61.2 -38.2 85.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.598 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 737' ' ' THR . . . . . 0.65 HG22 HD11 ' A' ' 704' ' ' LEU . 39.9 m -60.93 -42.54 98.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.202 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.6 -38.78 92.42 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.389 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 739' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 741' ' ' LEU . 97.0 mt-30 -64.49 -34.5 78.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.937 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -60.64 1.68 0.69 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 741' ' ' LEU . . . . . 0.501 ' H ' ' C ' ' A' ' 739' ' ' GLN . 63.1 tp -82.84 -15.87 49.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.797 0.332 . . . . 0.0 110.602 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 742' ' ' CYS . . . . . 0.447 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 0.5 OUTLIER 60.22 65.74 2.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.015 0.436 . . . . 0.0 110.594 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 743' ' ' PRO . . . . . 0.447 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 3.0 Cg_exo -70.5 116.34 4.59 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.133 1.889 . . . . 0.0 110.583 179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 744' ' ' PRO . . . . . 0.506 ' HG2' ' H ' ' A' ' 745' ' ' ASN . 94.4 Cg_endo -88.52 -72.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.448 2.099 . . . . 0.0 112.611 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 745' ' ' ASN . . . . . 0.506 ' H ' ' HG2' ' A' ' 744' ' ' PRO . 4.5 p30 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.501 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -96.09 135.18 38.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.789 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' A' ' 654' ' ' VAL . 57.5 mt -118.87 134.11 63.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.193 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.791 HD21 ' HB1' ' A' ' 663' ' ' ALA . 27.1 tp -107.21 131.67 53.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.097 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.456 HD12 ' HB2' ' A' ' 676' ' ' LEU . 4.6 tp -133.06 127.36 33.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.889 0.376 . . . . 0.0 111.877 -178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 633' ' ' LEU . 7.9 mp -109.68 119.12 38.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.57 ' OE2' ' HB1' ' A' ' 639' ' ' ALA . 83.9 tt0 -159.06 156.97 30.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.012 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.65 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 85.3 tt0 -115.59 138.17 51.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.65 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 69.1 tt0 103.56 113.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.47 ' O ' ' OG1' ' A' ' 641' ' ' THR . 62.1 t0 -57.54 -36.04 71.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.333 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.4 -44.47 82.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.664 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.57 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -70.58 -43.2 69.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.832 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.35 87.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 86.9 m -62.22 -44.28 96.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.686 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 56.6 t -57.75 -53.73 40.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.46 -46.26 92.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.149 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.566 ' O ' ' OG1' ' A' ' 648' ' ' THR . 73.2 m -61.46 -35.74 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.031 -179.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -62.48 -40.32 96.3 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.913 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 89.5 mtp -67.36 -51.61 50.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.944 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.678 HD22 HG21 ' A' ' 654' ' ' VAL . 6.6 mp -67.89 -42.68 80.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.675 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.566 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 87.1 m -55.64 -42.08 74.5 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.759 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.06 -29.57 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.029 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.31 -6.65 47.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.735 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.25 2.4 73.98 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . 0.621 ' CE2' HD22 ' A' ' 735' ' ' LEU . 84.2 m-85 -96.88 145.15 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.122 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -93.43 128.92 39.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.689 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.678 HG21 HD22 ' A' ' 647' ' ' LEU . 71.8 t -124.61 138.01 55.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.552 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 53.3 mt -105.66 130.74 56.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 0.0 110.495 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.535 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 24.4 t90 -96.66 111.51 23.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.429 ' CD1' ' HA ' ' A' ' 663' ' ' ALA . 64.6 mt -116.4 141.86 47.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.708 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.532 ' O ' HG12 ' A' ' 658' ' ' VAL . 18.4 t -101.35 2.28 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -148.42 136.33 20.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 0.0 110.879 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.484 ' H ' ' HB2' ' A' ' 685' ' ' SER . . . -61.48 -37.9 94.9 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 90.0 p -60.02 -34.98 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.832 0.349 . . . . 0.0 110.229 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 19.2 m -64.75 -39.6 93.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.642 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.791 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -63.87 -43.61 95.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.043 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.72 -39.31 84.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.37 . . . . 0.0 110.834 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . 0.576 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 23.4 t70 -62.43 -41.52 98.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.949 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.574 ' O ' HD23 ' A' ' 670' ' ' LEU . 42.5 mt-30 -90.08 -45.23 9.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.126 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 663' ' ' ALA . 0.9 OUTLIER -44.56 -44.64 8.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.2 -179.132 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.576 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 30.1 p-10 -61.81 -35.74 79.08 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.45 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.482 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 65.3 mt -78.23 -48.16 16.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.933 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.574 HD23 ' O ' ' A' ' 666' ' ' GLN . 0.7 OUTLIER -82.62 -29.32 30.2 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.527 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 667' ' ' LEU . 6.6 mt-30 45.56 81.17 0.26 Allowed Pre-proline 0 C--N 1.329 -0.321 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.115 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.69 157.19 18.69 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 123.028 2.485 . . . . 0.0 112.427 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.745 HG13 HG23 ' A' ' 674' ' ' VAL . 26.3 pt -94.02 -10.7 9.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.69 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.745 HG23 HG13 ' A' ' 673' ' ' ILE . 83.4 t -139.7 134.05 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.49 HD11 HD11 ' A' ' 667' ' ' LEU . 62.2 mt -128.93 119.54 49.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.05 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.456 ' HB2' HD12 ' A' ' 632' ' ' LEU . 3.5 mp -107.68 137.68 45.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.071 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.572 ' CE ' ' HG ' ' A' ' 686' ' ' CYS . 74.8 mtm -138.17 133.44 33.31 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.197 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.587 ' O ' ' OD2' ' A' ' 683' ' ' ASP . . . -67.51 145.05 55.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.248 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.767 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 32.9 t-105 -113.21 -15.1 0.11 Allowed Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.767 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 75.4 Cg_exo -46.6 162.79 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.711 1.607 . . . . 0.0 112.296 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.537 ' N ' ' HD2' ' A' ' 682' ' ' PRO . 23.8 Cg_exo -50.47 -49.99 14.91 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.678 2.252 . . . . 0.0 114.112 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 10.7 Cg_endo -55.79 -6.12 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 121.51 1.474 . . . . 0.0 111.234 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.587 ' OD2' ' O ' ' A' ' 678' ' ' ALA . 27.3 t0 -83.53 155.23 23.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.96 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -179.09 -31.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.508 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . 0.484 ' HB2' ' H ' ' A' ' 660' ' ' GLY . 83.7 p -66.3 -28.31 68.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.592 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.572 ' HG ' ' CE ' ' A' ' 677' ' ' MET . 1.6 t -61.25 -22.25 64.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 687' ' ' LEU . 88.1 mt -64.79 -34.61 78.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.913 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.2 -39.86 86.4 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.968 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.616 ' O ' HD23 ' A' ' 689' ' ' LEU . 7.3 tt -61.85 -40.88 96.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.022 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.46 HD13 HD22 ' A' ' 717' ' ' LEU . 95.4 mt -60.26 -38.56 83.89 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.335 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . 0.476 ' HA ' ' NH1' ' A' ' 694' ' ' ARG . 60.8 tt0 -61.01 -42.14 97.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.978 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -58.36 -49.35 77.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.105 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.0 mt -55.53 -38.77 69.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.523 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.476 ' NH1' ' HA ' ' A' ' 691' ' ' GLN . 34.0 ttm105 -65.24 -37.57 87.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -68.41 -37.79 80.66 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.738 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.428 179.878 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 703' ' ' PRO . 11.8 Cg_endo . . . . . 0 N--CA 1.494 1.512 0 CA-C-O 120.492 0.121 . . . . 0.0 112.4 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 702' ' ' PRO . 46.5 Cg_exo -51.35 -149.61 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 94.8 mt -154.25 123.25 6.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.328 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.524 ' O ' ' OG ' ' A' ' 722' ' ' SER . 21.1 t -107.36 127.17 63.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.17 0.509 . . . . 0.0 111.499 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.622 ' N ' HD12 ' A' ' 706' ' ' LEU . 5.2 mp -121.35 139.37 53.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.363 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -106.78 128.79 54.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.105 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.6 mt -93.71 146.79 23.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.598 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 86.66 -126.04 7.7 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -90.26 159.44 41.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 110.779 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.513 ' HB3' HD13 ' A' ' 724' ' ' ILE . 72.6 Cg_endo -79.04 149.05 22.23 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.787 2.324 . . . . 0.0 112.338 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -64.92 145.61 86.09 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.71 2.274 . . . . 0.0 112.052 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 79.7 t -80.13 -37.68 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . 0.636 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.3 OUTLIER -71.98 139.57 82.7 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.494 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.28 -17.01 21.88 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.599 2.199 . . . . 0.0 112.925 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 21.3 tp -70.05 -38.93 75.95 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.829 -0.349 . . . . 0.0 111.015 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.513 ' CD1' ' CH2' ' A' ' 679' ' ' TRP . 48.5 mt -77.06 -34.86 57.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 61.0 m -64.98 -41.14 95.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.922 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.89 96.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.429 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -82.76 -8.22 59.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.56 131.66 41.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 705' ' ' VAL . 83.4 p -86.42 -29.18 23.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.667 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.08 131.77 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.513 HD13 ' HB3' ' A' ' 711' ' ' PRO . 60.9 mt -93.16 128.48 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.119 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 33.8 mt -107.79 148.48 29.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.387 . . . . 0.0 111.252 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.5 t -167.42 -66.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.517 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . 0.441 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 0.7 OUTLIER -135.06 59.74 35.72 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.207 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 63.5 Cg_endo -79.72 141.14 15.19 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.915 2.41 . . . . 0.0 112.295 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.517 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.2 OUTLIER -67.01 109.3 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.771 179.698 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.517 ' O ' ' O ' ' A' ' 729' ' ' LEU . 31.1 m-20 54.85 147.84 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.39 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -63.32 0.25 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 123.083 2.522 . . . . 0.0 111.898 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 730' ' ' ASP . 95.0 mt-30 -68.13 -29.95 68.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.581 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.8 tp -63.71 -42.86 97.89 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.55 -43.65 89.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.193 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . 0.621 HD22 ' CE2' ' A' ' 652' ' ' PHE . 31.4 mt -61.53 -36.9 81.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.168 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.7 m -58.9 -42.26 89.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.331 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.8 m -62.0 -42.78 99.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.609 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.5 tt -64.78 -43.95 91.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.668 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 741' ' ' LEU . 96.9 mm-40 -66.53 -32.33 73.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.889 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.39 -5.93 0.37 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.145 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 739' ' ' GLN . 38.7 tp . . . . . 0 C--N 1.328 -0.337 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.783 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.78 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -93.98 135.64 35.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.62 HG23 HG13 ' A' ' 674' ' ' VAL . 59.1 mt -115.82 135.93 54.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.366 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 1.096 HD22 HD12 ' A' ' 667' ' ' LEU . 16.3 tp -111.0 130.41 55.6 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.868 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.458 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 19.0 tp -116.09 125.65 52.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.771 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 14.7 tp -118.37 112.93 20.65 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.575 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 84.2 tt0 -160.35 164.96 32.06 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.719 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 77.5 mm-40 -106.07 168.2 9.29 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.409 ' HB3' ' O ' ' A' ' 635' ' ' GLU . 43.3 tp10 67.7 110.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.42 . . . . 0.0 110.48 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.563 ' OD1' ' OG1' ' A' ' 641' ' ' THR . 63.0 t0 -56.99 -36.02 69.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.292 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -62.67 -42.13 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.353 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.32 -45.99 57.53 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.563 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.474 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -65.1 -36.39 84.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.576 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.563 ' OG1' ' OD1' ' A' ' 637' ' ' ASP . 77.2 m -63.34 -46.55 86.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.646 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 41.7 t -54.69 -50.25 61.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.515 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 98.8 t -58.92 -43.52 88.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.87 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.588 ' O ' ' OG1' ' A' ' 648' ' ' THR . 71.1 m -67.34 -37.51 83.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.796 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -62.25 -39.48 93.01 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.352 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.6 mtm -65.8 -49.75 67.14 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.942 -0.703 . . . . 0.0 109.855 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.719 ' CD1' HG21 ' A' ' 654' ' ' VAL . 42.0 mt -70.52 -43.58 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.663 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 85.0 m -55.83 -42.36 75.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.938 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.91 -33.79 76.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -76.14 -5.46 46.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.43 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.74 14.8 66.91 Favored Glycine 0 CA--C 1.53 1.023 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . 0.568 ' CZ ' HD11 ' A' ' 735' ' ' LEU . 9.2 m-85 -91.33 143.68 26.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -91.37 114.54 27.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.719 HG21 ' CD1' ' A' ' 647' ' ' LEU . 61.1 t -128.82 134.25 64.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.095 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . 0.459 ' HB ' HD12 ' A' ' 631' ' ' LEU . 53.0 mt -112.49 125.02 69.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.403 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.575 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 22.6 t90 -94.53 119.92 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.502 HD12 ' HB2' ' A' ' 663' ' ' ALA . 52.8 mt -119.58 149.31 42.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.992 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.574 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 30.6 m -113.38 10.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.635 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 85.5 m-20 -149.86 121.06 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.271 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.92 -42.29 99.62 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 79.9 p -58.93 -37.67 77.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.074 0.464 . . . . 0.0 110.22 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 29.0 m -65.27 -39.69 92.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.103 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -64.62 -41.78 95.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.184 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.19 -46.12 89.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 111.446 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -61.78 -40.38 94.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.022 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -88.61 -54.79 4.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.476 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 1.096 HD12 HD22 ' A' ' 631' ' ' LEU . 10.3 tt -48.32 -35.19 11.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.484 -178.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -53.55 -40.61 65.68 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.193 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 57.0 mt -79.51 -24.98 41.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.724 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 32.3 mt -71.57 -35.61 70.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.801 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.499 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.2 mm-40 47.23 63.87 9.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 5.9 Cg_exo -73.11 160.02 46.38 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 123.178 2.586 . . . . 0.0 112.857 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 81.1 mt -94.53 -23.1 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.992 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.62 HG13 HG23 ' A' ' 630' ' ' ILE . 10.5 p -145.82 141.07 21.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.067 0.461 . . . . 0.0 111.13 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 79.0 mt -124.32 119.35 56.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.192 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.439 HD23 ' HB2' ' A' ' 706' ' ' LEU . 70.2 mt -105.5 131.44 52.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.36 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 7.2 ptm -145.83 138.29 25.58 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.99 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.38 149.31 48.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.743 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 28.3 t-105 -110.63 -34.33 0.13 Allowed Pre-proline 0 C--N 1.328 -0.334 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.993 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.743 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 39.0 Cg_exo -52.56 -41.48 67.99 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.23 1.954 . . . . 0.0 112.762 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 24.0 Cg_exo -59.63 134.52 58.32 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.133 1.889 . . . . 0.0 112.094 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.35 33.33 0.52 Allowed 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.883 2.389 . . . . 0.0 112.437 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -81.45 111.76 18.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.153 0.502 . . . . 0.0 110.873 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -61.04 -24.94 66.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.68 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 38.6 m -59.95 -36.54 77.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.511 ' O ' ' CD1' ' A' ' 690' ' ' LEU . 73.6 m -59.97 -34.55 73.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.58 -34.91 79.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.416 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.773 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -70.48 -35.65 73.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.24 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.489 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 4.9 tp -60.47 -43.71 96.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.71 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.511 ' CD1' ' O ' ' A' ' 686' ' ' CYS . 7.0 mp -61.94 -38.89 90.18 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.857 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -60.13 -41.98 93.84 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.206 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -61.6 -54.63 40.46 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.575 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . 0.609 HD13 ' NE2' ' A' ' 696' ' ' HIS . 1.7 mm? -55.17 -37.66 67.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.124 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -60.37 -37.16 79.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.263 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -68.44 -40.89 80.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.164 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.628 ' C ' ' HD1' ' A' ' 696' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.236 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 N--CA 1.488 1.177 0 CA-C-O 120.764 0.235 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -69.59 149.16 67.65 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.721 2.281 . . . . 0.0 111.914 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 37.1 mt -78.71 141.35 37.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.661 ' C ' HD12 ' A' ' 706' ' ' LEU . 59.8 t -121.84 125.96 73.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.309 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.661 HD12 ' C ' ' A' ' 705' ' ' VAL . 5.4 mp -131.2 138.17 49.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.072 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . 0.852 ' CE2' ' HB2' ' A' ' 721' ' ' ALA . 13.0 m-85 -113.37 130.31 56.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.505 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.711 ' N ' HD12 ' A' ' 708' ' ' LEU . 5.4 mp -94.88 148.72 22.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.408 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . 0.581 ' O ' ' O ' ' A' ' 725' ' ' LEU . . . 101.83 -134.93 11.94 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.36 154.09 48.73 Favored Pre-proline 0 CA--C 1.529 0.173 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -81.87 131.83 7.24 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 C-N-CA 122.655 2.236 . . . . 0.0 112.586 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.474 ' HB3' HD23 ' A' ' 717' ' ' LEU . 24.2 Cg_exo -52.17 152.01 15.75 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.106 1.871 . . . . 0.0 111.636 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 76.9 t -80.99 -21.9 10.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.868 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -72.53 132.27 83.81 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.678 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -74.45 -30.22 8.41 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.281 1.987 . . . . 0.0 111.886 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.507 ' HG ' ' N ' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -75.69 -32.18 60.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.957 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.507 ' N ' ' HG ' ' A' ' 716' ' ' LEU . 42.3 tp -76.78 -42.91 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . 0.409 HG23 ' CD1' ' A' ' 724' ' ' ILE . 30.4 m -64.4 -39.41 93.79 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.72 -32.1 73.46 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -71.06 -31.43 67.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.853 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . 0.852 ' HB2' ' CE2' ' A' ' 707' ' ' PHE . . . -70.87 150.46 45.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.683 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.498 ' N ' ' O ' ' A' ' 705' ' ' VAL . 74.2 m -84.18 -26.95 28.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.148 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 159.45 5.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.359 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.409 ' CD1' HG23 ' A' ' 718' ' ' THR . 73.9 mt -142.45 131.99 22.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.157 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.581 ' O ' ' O ' ' A' ' 709' ' ' GLY . 5.3 mp -102.93 148.43 25.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.242 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 20.6 p -165.71 6.63 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.128 0.49 . . . . 0.0 110.06 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -139.22 64.12 31.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.953 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -55.91 126.4 22.3 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.269 1.979 . . . . 0.0 112.477 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.938 ' O ' HD12 ' A' ' 729' ' ' LEU . 0.3 OUTLIER 178.49 -14.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.907 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -143.87 75.23 16.08 Favored Pre-proline 0 CA--C 1.528 0.12 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.378 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -56.52 -9.89 4.34 Favored 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.621 2.214 . . . . 0.0 111.408 179.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.671 ' O ' ' NE2' ' A' ' 732' ' ' GLN . 0.0 OUTLIER -72.64 -22.48 60.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.438 -179.462 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.71 -47.63 68.81 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 66.9 tp -59.97 -43.96 94.75 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.676 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . 0.568 HD11 ' CZ ' ' A' ' 652' ' ' PHE . 24.4 tp -59.06 -38.46 79.47 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 94.1 m -60.45 -37.1 79.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.505 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 57.7 m -59.85 -47.72 84.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.418 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.503 ' O ' HD23 ' A' ' 738' ' ' LEU . 8.2 tt -66.73 -38.77 87.34 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.504 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.612 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.4 mm-40 -64.61 -28.92 69.95 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.916 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -55.11 3.21 0.02 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.612 ' H ' ' C ' ' A' ' 739' ' ' GLN . 39.6 tp . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 120.805 0.336 . . . . 0.0 110.906 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.671 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -88.0 136.21 33.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.968 0.414 . . . . 0.0 110.925 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.836 ' HB ' HG12 ' A' ' 654' ' ' VAL . 78.6 mt -115.69 140.17 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.459 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.734 HD23 HD12 ' A' ' 667' ' ' LEU . 63.2 tp -108.76 132.08 54.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.964 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.649 HD23 ' C ' ' A' ' 632' ' ' LEU . 8.4 tt -135.19 123.32 22.88 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.189 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.719 HD22 HD22 ' A' ' 689' ' ' LEU . 9.6 mp -107.59 115.48 30.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.094 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.481 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.9 tt0 -159.92 157.59 29.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.886 0.374 . . . . 0.0 111.177 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.654 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.1 tt0 -115.37 144.52 43.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.394 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.654 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 42.6 tp10 110.96 109.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.724 0.64 . . . . 0.0 110.338 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.702 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.0 p30 -66.62 -34.42 77.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.745 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.702 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.8 mt-10 -67.43 -50.7 58.25 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.679 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -68.23 -36.14 79.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.171 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 656' ' ' TRP . . . -68.85 -40.15 79.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.23 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 62.4 m -60.89 -47.63 85.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.023 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 92.0 t -58.11 -53.37 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.467 . . . . 0.0 110.439 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.96 -46.43 94.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.252 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.527 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.7 t -56.09 -39.96 72.9 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.574 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -61.38 -37.32 82.97 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.95 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.1 mtt -66.12 -54.18 28.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.324 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.05 -43.68 78.13 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.539 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.527 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 29.3 m -55.86 -42.38 75.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.251 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.92 64.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.758 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -68.99 -4.93 18.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.611 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.35 -0.85 78.62 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -98.19 137.3 37.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.164 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -93.6 126.91 39.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.866 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.836 HG12 ' HB ' ' A' ' 630' ' ' ILE . 10.5 m -126.04 151.59 32.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 110.986 -179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 19.1 mm -108.91 127.48 65.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.62 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.533 ' CE2' ' HB1' ' A' ' 640' ' ' ALA . 3.6 t-105 -96.16 119.3 34.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.05 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.906 HD23 ' HB2' ' A' ' 663' ' ' ALA . 16.7 tp -132.62 139.08 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.969 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 17.6 m -99.13 -7.81 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.143 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.573 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 93.0 m-20 -98.39 155.15 17.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -97.24 -64.14 0.9 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.95 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.8 t -57.78 -39.9 78.56 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 121.128 -0.229 . . . . 0.0 111.441 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 60.2 m -62.78 -37.95 88.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.936 0.398 . . . . 0.0 110.406 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.906 ' HB2' HD23 ' A' ' 657' ' ' LEU . . . -62.6 -41.3 98.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.528 HD13 ' ND1' ' A' ' 692' ' ' HIS . 61.1 mt -58.82 -47.45 84.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.065 0.459 . . . . 0.0 110.719 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -61.4 -38.82 88.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.688 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -83.87 -34.1 24.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.72 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.781 ' O ' HD23 ' A' ' 667' ' ' LEU . 8.1 tt -50.93 -39.25 54.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.659 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -56.06 -35.95 67.52 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 669' ' ' LEU . 74.5 mt -75.81 -30.54 59.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.459 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.58 ' CD1' HD13 ' A' ' 631' ' ' LEU . 28.4 mt -71.79 -37.41 70.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.187 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.483 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 42.2 mm-40 45.36 60.78 13.04 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.647 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 95.6 Cg_endo -89.67 157.93 5.21 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 123.43 2.754 . . . . 0.0 112.552 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.542 HG13 HG23 ' A' ' 674' ' ' VAL . 24.0 pt -97.33 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.783 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.646 HG21 ' HG ' ' A' ' 738' ' ' LEU . 41.7 t -142.66 139.52 28.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.928 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 73.4 mt -124.73 126.05 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.431 HD21 HD11 ' A' ' 734' ' ' LEU . 5.1 mp -104.63 137.8 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.737 ' SD ' ' N ' ' A' ' 678' ' ' ALA . 0.2 OUTLIER -137.22 121.97 18.67 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.03 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.737 ' N ' ' SD ' ' A' ' 677' ' ' MET . . . -66.63 153.91 41.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.79 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 56.9 t-105 -110.19 66.19 0.44 Allowed Pre-proline 0 C--N 1.328 -0.336 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.564 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.418 ' HD3' ' C ' ' A' ' 678' ' ' ALA . 40.2 Cg_endo -69.54 169.17 19.26 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.962 2.442 . . . . 0.0 111.454 178.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 682' ' ' PRO . 2.7 Cg_endo -50.02 172.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.243 1.962 . . . . 0.0 111.225 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.703 ' O ' ' N ' ' A' ' 684' ' ' GLN . 60.3 Cg_exo -25.73 -65.52 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.267 2.645 . . . . 0.0 112.989 -179.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.66 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 91.9 m-20 54.11 -70.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.482 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 682' ' ' PRO . 0.2 OUTLIER 103.37 -29.2 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.592 0.558 . . . . 0.0 111.113 179.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 86.5 p -66.04 -42.05 90.06 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 90.6 m -65.98 -36.65 83.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 110.578 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.4 mt -64.59 -32.79 74.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.869 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.819 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.95 -36.01 74.94 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.038 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.719 HD22 HD22 ' A' ' 633' ' ' LEU . 6.3 tp -59.51 -47.38 85.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.378 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.458 HD13 HD12 ' A' ' 693' ' ' LEU . 4.6 mm? -61.76 -41.58 97.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.388 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.36 -42.78 96.5 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.623 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.528 ' ND1' HD13 ' A' ' 664' ' ' LEU . 5.7 t60 -58.07 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.569 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . 0.458 HD12 HD13 ' A' ' 690' ' ' LEU . 88.2 mt -54.56 -42.75 71.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.115 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -65.11 -34.37 78.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.358 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.79 -36.54 78.4 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.487 ' CD2' ' HE2' ' A' ' 692' ' ' HIS . 2.0 m-70 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.423 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 N--CA 1.49 1.269 0 CA-C-O 120.865 0.277 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -49.26 155.67 2.97 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.716 2.277 . . . . 0.0 111.596 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 27.0 mt -77.03 138.62 39.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.691 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 24.8 t -121.69 132.59 70.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.651 HD21 HG21 ' A' ' 737' ' ' THR . 67.9 mt -111.19 137.51 48.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.634 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -113.77 121.83 45.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.259 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.713 ' N ' HD12 ' A' ' 708' ' ' LEU . 4.1 mp -98.72 142.24 30.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.892 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 104.63 -134.3 11.93 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -92.14 157.29 41.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.946 0.403 . . . . 0.0 110.784 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -70.94 145.16 49.64 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.747 2.298 . . . . 0.0 111.719 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.72 145.81 70.67 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.636 2.224 . . . . 0.0 112.282 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.51 -40.09 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.7 144.53 86.03 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.373 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.38 -14.87 14.42 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 112.292 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.61 -32.21 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.652 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -76.67 -34.95 58.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.513 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 25.6 m -62.83 -41.88 99.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.782 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.82 92.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.032 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tp60 -75.95 -28.96 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.579 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.5 126.53 30.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.949 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 84.8 p -86.61 -24.18 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.85 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.602 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -170.78 126.75 0.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.386 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.5 mt -90.19 131.06 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.624 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.4 HD11 HD13 ' A' ' 706' ' ' LEU . 18.6 mt -107.52 155.78 19.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.902 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 2.2 p -166.48 60.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.921 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . 0.472 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 15.1 tttt 57.65 61.77 5.78 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.308 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.472 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 62.7 Cg_endo -86.42 145.41 8.2 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.535 ' C ' ' CG ' ' A' ' 730' ' ' ASP . 1.6 mp -67.11 151.66 47.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.51 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.679 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.0 OUTLIER 50.88 93.43 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.13 8.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.847 2.364 . . . . 0.0 111.794 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.679 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -68.02 -25.66 65.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.671 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.03 -46.78 79.89 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.618 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.451 ' C ' HD23 ' A' ' 734' ' ' LEU . 10.1 tt -58.57 -44.78 89.87 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . 0.462 HD23 ' C ' ' A' ' 735' ' ' LEU . 9.7 tt -61.73 -39.56 91.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.577 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 31.8 m -60.09 -36.85 78.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.101 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . 0.651 HG21 HD21 ' A' ' 706' ' ' LEU . 44.6 m -60.56 -46.41 90.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.604 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.646 ' HG ' HG21 ' A' ' 674' ' ' VAL . 6.5 mp -65.45 -39.52 92.13 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.677 ' C ' ' H ' ' A' ' 741' ' ' LEU . 6.2 tp-100 -63.86 -28.02 69.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.367 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.68 2.86 0.01 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.677 ' H ' ' C ' ' A' ' 739' ' ' GLN . 20.0 tp . . . . . 0 C--N 1.33 -0.246 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.652 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -88.37 135.35 33.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.944 0.402 . . . . 0.0 110.64 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.592 HG23 HG13 ' A' ' 674' ' ' VAL . 90.9 mt -112.67 138.51 41.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.286 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 17.3 tp -107.49 127.59 53.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.402 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.55 HD23 ' C ' ' A' ' 632' ' ' LEU . 9.6 tt -131.63 123.41 27.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.664 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.468 ' CD1' HD13 ' A' ' 689' ' ' LEU . 47.9 mt -106.76 124.21 49.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.902 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.521 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.2 tt0 -159.47 163.53 35.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.672 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 78.5 tt0 -105.4 159.83 15.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.576 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.483 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 84.6 tt0 68.42 117.51 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.57 ' O ' ' OG1' ' A' ' 641' ' ' THR . 4.2 p30 -63.21 -34.58 77.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.669 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.93 -45.29 82.37 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.214 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.83 77.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.04 0.447 . . . . 0.0 110.127 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.548 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -66.44 -35.64 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.595 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.57 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.0 m -62.32 -46.63 87.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.694 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 55.2 t -56.91 -51.94 61.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.552 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.97 -48.1 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.667 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 656' ' ' TRP . 71.7 m -67.04 -30.53 70.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 641' ' ' THR . 51.2 tp10 -61.34 -43.39 98.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.024 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 9.1 mmt -67.28 -43.88 80.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.182 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.69 -45.98 77.07 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.92 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 26.8 m -56.34 -42.83 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.465 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.66 65.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.449 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.23 -4.99 28.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.365 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.55 -4.98 73.59 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.56 139.48 32.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -94.07 126.94 39.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.43 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.2 p -130.54 142.96 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.571 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 18.7 mm -108.19 122.89 63.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.329 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.548 ' CG ' ' HB1' ' A' ' 640' ' ' ALA . 19.5 t90 -95.75 117.07 29.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.766 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 66.0 mt -118.57 147.49 43.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 658' ' ' VAL . 3.6 p -110.12 20.64 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.265 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -149.44 123.67 9.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.677 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.35 -40.03 96.95 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.544 -0.623 . . . . 0.0 111.544 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 55.5 p -60.26 -38.72 84.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.081 0.467 . . . . 0.0 110.17 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.3 m -65.23 -35.46 81.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.902 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.78 -45.1 91.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.228 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 44.6 mt -59.75 -41.06 90.14 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.558 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -63.0 -42.72 99.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.425 ' O ' HD23 ' A' ' 670' ' ' LEU . 96.5 mm-40 -86.25 -42.6 13.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.973 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 663' ' ' ALA . 1.1 tt -45.24 -44.67 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.889 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.97 -34.54 76.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.513 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 50.8 mt -78.4 -45.94 21.11 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.4 OUTLIER -83.49 -13.55 54.38 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.183 -0.607 . . . . 0.0 112.07 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.456 ' C ' ' O ' ' A' ' 670' ' ' LEU . 1.5 mt-30 38.24 74.82 0.61 Allowed Pre-proline 0 C--N 1.327 -0.393 0 C-N-CA 120.375 -0.53 . . . . 0.0 109.997 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -76.89 146.39 26.08 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.84 2.36 . . . . 0.0 112.289 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 21.8 pt -92.55 -13.13 8.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.592 HG13 HG23 ' A' ' 630' ' ' ILE . 14.5 p -145.02 139.06 22.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.215 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 63.3 mt -124.16 125.09 70.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.934 0.397 . . . . 0.0 111.204 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.4 mp -105.26 136.9 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.431 ' CE ' HD12 ' A' ' 633' ' ' LEU . 92.5 mtp -140.36 117.58 11.29 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.731 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.405 ' C ' ' HD3' ' A' ' 680' ' ' PRO . . . -67.59 153.02 44.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.981 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.425 ' NE1' ' HA ' ' A' ' 712' ' ' PRO . 6.2 t-105 -120.98 57.97 6.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.209 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.444 ' O ' ' CB ' ' A' ' 683' ' ' ASP . 72.5 Cg_endo -77.0 152.78 31.97 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.891 2.394 . . . . 0.0 111.591 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.655 ' C ' ' H ' ' A' ' 683' ' ' ASP . 1.7 Cg_endo -51.11 -57.45 2.23 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.292 1.994 . . . . 0.0 112.523 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.487 ' HD2' ' CD ' ' A' ' 681' ' ' PRO . 10.0 Cg_endo -53.55 6.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.333 2.022 . . . . 0.0 111.987 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.655 ' H ' ' C ' ' A' ' 681' ' ' PRO . 56.8 t0 -76.45 148.93 36.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . 0.555 ' N ' ' OD1' ' A' ' 683' ' ' ASP . 10.3 pt20 -175.18 -43.85 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 34.1 t -64.09 -30.14 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.024 0.44 . . . . 0.0 110.382 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 87.6 m -58.84 -23.58 60.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.953 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.68 -37.97 89.36 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.508 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.697 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.8 OUTLIER -71.23 -39.55 71.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.941 -179.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.494 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 10.0 tt -60.84 -42.07 97.07 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.621 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 83.5 mt -60.48 -45.9 92.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.184 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -63.15 -40.99 99.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.199 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -60.27 -60.94 3.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . 0.798 ' C ' HD12 ' A' ' 693' ' ' LEU . 0.4 OUTLIER -55.46 -39.87 70.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.5 ' N ' ' HG ' ' A' ' 693' ' ' LEU . 79.3 ttt180 -65.02 -33.86 77.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.026 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . 0.475 ' HG2' ' CE1' ' A' ' 696' ' ' HIS . 78.2 tt0 -65.64 -36.66 84.33 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.276 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.475 ' CE1' ' HG2' ' A' ' 695' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.117 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 120.743 0.226 . . . . 0.0 112.403 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.2 173.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.579 2.186 . . . . 0.0 111.784 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.706 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.3 OUTLIER -77.15 137.36 38.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.461 HG12 ' CE1' ' A' ' 707' ' ' PHE . 44.1 t -122.05 131.18 73.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.067 0.46 . . . . 0.0 111.896 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.749 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.8 mp -112.35 134.63 53.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.731 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . 0.461 ' CE1' HG12 ' A' ' 705' ' ' VAL . 90.2 m-85 -115.64 129.92 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.465 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.411 ' O ' ' N ' ' A' ' 679' ' ' TRP . 62.0 mt -106.11 140.49 39.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.884 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 117.32 -142.86 17.65 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -92.52 165.83 18.42 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.027 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.37 154.96 10.35 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.418 2.079 . . . . 0.0 112.022 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.425 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 17.0 Cg_endo -60.06 169.22 5.04 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 123.076 2.518 . . . . 0.0 112.129 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.561 HG12 ' O ' ' A' ' 713' ' ' VAL . 42.7 t -80.53 0.36 3.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.297 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -161.8 143.05 8.33 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.02 -10.98 25.11 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.694 2.263 . . . . 0.0 112.431 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.584 HD22 ' N ' ' A' ' 716' ' ' LEU . 3.5 mm? -69.52 -35.3 75.35 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.313 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.85 -31.43 59.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.8 m -60.98 -44.23 97.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.665 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.68 -37.12 85.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.871 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -77.37 -19.97 55.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.669 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.76 137.79 49.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.14 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.433 ' CB ' ' H ' ' A' ' 705' ' ' VAL . 67.3 m -86.26 -29.77 22.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.584 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.88 105.65 0.2 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 60.1 mt -93.13 129.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.658 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.476 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.4 mp -111.36 97.94 7.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 110.32 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 50.2 p -75.42 0.22 17.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.664 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -126.63 89.4 52.25 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.927 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.634 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 49.0 Cg_exo -51.99 154.65 9.86 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 123.016 2.477 . . . . 0.0 112.533 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.634 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 1.5 tp 98.15 -157.41 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.272 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 50.18 62.76 11.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.86 -19.43 62.02 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.445 2.097 . . . . 0.0 111.714 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.62 -36.31 65.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -70.13 -50.03 44.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.327 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 10.5 tp -58.02 -42.16 84.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.885 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 26.3 tp -62.84 -39.04 93.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.145 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.6 m -58.48 -47.62 83.47 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.412 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.9 m -65.15 -40.87 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.578 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.539 HD11 HG11 ' A' ' 674' ' ' VAL . 5.7 tt -64.09 -45.72 87.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.657 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.672 ' O ' ' N ' ' A' ' 741' ' ' LEU . 98.1 mt-30 -66.08 -27.7 68.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.103 0.478 . . . . 0.0 109.955 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . 0.505 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -27.75 -33.01 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.432 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.676 ' N ' HD12 ' A' ' 741' ' ' LEU . 6.3 mp . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 120.852 0.358 . . . . 0.0 110.163 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.639 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -95.72 134.02 39.14 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 64.7 mt -116.92 136.71 53.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 120.966 0.413 . . . . 0.0 110.461 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.927 HD22 ' CD1' ' A' ' 667' ' ' LEU . 21.1 tp -104.66 129.96 52.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.659 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 8.0 tt -127.47 121.96 32.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.183 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.869 HD12 ' O ' ' A' ' 657' ' ' LEU . 12.2 tp -110.17 121.51 45.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.429 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.541 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 85.9 tt0 -159.47 165.97 31.93 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.195 -0.602 . . . . 0.0 111.345 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.541 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 94.4 mt-10 -107.62 160.65 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.97 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 71.31 108.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 27.1 p-10 -57.19 -37.74 72.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.073 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.596 ' O ' HG23 ' A' ' 642' ' ' VAL . 85.7 tt0 -63.76 -43.15 97.26 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.857 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.6 -36.92 70.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.483 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.04 -42.64 80.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.023 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 645' ' ' GLU . 31.6 m -63.26 -45.84 89.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.801 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 638' ' ' GLU . 86.5 t -56.62 -53.55 39.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.825 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.05 -47.59 92.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.403 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.525 ' O ' ' OG1' ' A' ' 648' ' ' THR . 70.2 m -65.35 -29.91 70.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.111 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 641' ' ' THR . 73.8 tt0 -61.55 -45.81 92.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.671 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 92.0 mmm -70.27 -42.86 71.54 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.784 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.616 ' CB ' HG21 ' A' ' 654' ' ' VAL . 73.5 mt -66.73 -43.01 85.36 Favored 'General case' 0 CA--C 1.522 -0.121 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.525 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 83.5 m -55.71 -40.15 72.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.28 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.81 -21.2 61.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.531 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 647' ' ' LEU . . . -65.19 -5.1 6.03 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.809 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 102.45 -19.23 48.81 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -98.46 152.32 19.65 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.98 129.65 37.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.988 0.423 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.616 HG21 ' CB ' ' A' ' 647' ' ' LEU . 16.2 t -119.85 133.21 67.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 27.1 mm -108.95 135.87 46.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.61 ' C ' HD22 ' A' ' 657' ' ' LEU . 23.3 t90 -89.85 114.02 25.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.514 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.869 ' O ' HD12 ' A' ' 633' ' ' LEU . 4.6 mm? -112.27 136.24 51.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.047 0.451 . . . . 0.0 110.288 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.61 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 4.4 p -117.42 19.95 6.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.994 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.61 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 89.4 m-20 -150.62 174.27 13.17 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.457 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -105.14 -63.47 0.65 Allowed Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.421 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 23.0 t -57.69 -36.99 72.69 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 51.1 m -62.86 -39.34 94.1 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.552 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.59 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -63.46 -39.67 95.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.585 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 664' ' ' LEU . 61.9 mt -59.34 -39.42 83.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.003 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.78 -47.5 83.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.379 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -89.71 -42.68 11.19 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.683 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.927 ' CD1' HD22 ' A' ' 631' ' ' LEU . 8.6 tt -50.13 -36.78 31.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.041 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -56.22 -36.66 68.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.844 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 39.4 mt -77.47 -26.41 51.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.304 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 37.6 mt -73.05 -32.93 65.38 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.687 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.446 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 39.3 mm-40 46.3 58.87 16.15 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-O 121.207 0.527 . . . . 0.0 110.167 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.446 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 50.9 Cg_endo -74.06 150.07 42.48 Favored 'Trans proline' 0 C--N 1.302 -1.921 0 C-N-CA 123.459 2.773 . . . . 0.0 112.83 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.747 HG13 HG23 ' A' ' 674' ' ' VAL . 24.6 pt -100.54 -19.49 5.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.747 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.747 HG23 HG13 ' A' ' 673' ' ' ILE . 76.8 t -137.12 137.51 46.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.416 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 631' ' ' LEU . 65.9 mt -127.25 118.65 50.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 8.8 tt -105.1 130.81 53.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.838 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.449 ' HE3' HD22 ' A' ' 689' ' ' LEU . 61.4 mtt -138.53 133.1 32.18 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.481 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -71.0 150.84 45.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.695 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.783 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -116.88 -24.79 0.1 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 C-N-CA 120.274 -0.571 . . . . 0.0 112.302 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.783 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -48.61 -39.71 37.6 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 121.887 1.724 . . . . 0.0 113.14 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 15.0 Cg_exo -65.43 155.29 69.57 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.653 1.568 . . . . 0.0 111.799 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -53.55 -19.41 13.7 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.284 1.989 . . . . 0.0 112.093 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 61.55 161.2 0.07 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.507 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 179.77 -80.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.148 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 31.3 m -63.11 -32.87 74.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.573 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 5.9 p -60.94 -24.12 65.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.748 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.44 -35.3 80.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.559 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 1.0 OUTLIER -73.47 -37.77 65.65 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.308 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.559 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 8.4 tt -61.7 -46.94 87.54 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.79 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.402 HD21 ' SD ' ' A' ' 677' ' ' MET . 82.6 mt -63.04 -42.42 99.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.515 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.12 -39.59 93.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.828 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -57.9 -53.55 56.92 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.801 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.0 mt -55.82 -37.68 69.0 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.531 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.674 ' NE ' ' OE1' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.78 -40.28 94.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.52 -39.2 77.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.754 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 15.9 m170 . . . . . 0 C--N 1.326 -0.433 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.721 -179.578 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo . . . . . 0 N--CA 1.49 1.309 0 CA-C-O 120.682 0.201 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -74.81 151.14 40.13 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.164 1.91 . . . . 0.0 112.069 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 48.0 mt -74.95 139.97 43.38 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' A' ' 722' ' ' SER . 46.1 t -123.73 129.04 74.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.918 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.552 ' C ' HD23 ' A' ' 706' ' ' LEU . 9.2 tt -116.22 133.58 55.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.935 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . 0.515 ' N ' HD23 ' A' ' 706' ' ' LEU . 97.2 m-85 -116.22 137.51 52.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.01 0.434 . . . . 0.0 111.614 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 708' ' ' LEU . 80.6 mt -99.77 154.76 18.06 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.037 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 84.89 -132.9 11.38 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -87.21 151.83 51.96 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 0.0 111.076 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.21 165.38 19.73 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 123.059 2.506 . . . . 0.0 112.325 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -62.51 160.47 31.75 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.868 2.378 . . . . 0.0 112.138 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.538 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.1 t -91.06 23.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.472 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . 0.538 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 12.7 m-20 -161.3 141.71 8.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.038 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.27 -15.62 35.22 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.801 2.334 . . . . 0.0 112.972 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.535 ' H ' HD12 ' A' ' 716' ' ' LEU . 5.9 mp -69.77 -35.28 74.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.024 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 89.1 mt -75.46 -31.53 60.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 45.4 m -64.22 -43.91 93.52 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.14 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.12 -40.11 95.49 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.088 0.47 . . . . 0.0 109.956 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.674 ' OE1' ' NE ' ' A' ' 694' ' ' ARG . 31.8 tt0 -73.62 -29.28 62.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.813 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -68.59 140.45 55.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.94 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 705' ' ' VAL . 34.5 t -87.28 -28.13 22.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.292 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.68 168.54 6.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.186 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 53.2 mt -151.17 113.01 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.624 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.6 mp -105.89 136.53 45.37 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.132 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.0 t -69.17 -81.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -103.39 128.36 27.68 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.64 142.29 52.75 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 121.997 1.798 . . . . 0.0 112.006 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 20.2 tp -176.38 138.8 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.404 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.4 OUTLIER 57.72 74.13 0.68 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.763 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.92 -5.19 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.492 2.128 . . . . 0.0 111.691 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.568 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -69.84 -30.26 67.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.219 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.7 -45.31 79.21 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 25.5 tp -57.26 -41.66 80.09 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.3 -40.37 96.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.208 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 87.9 m -59.28 -40.64 86.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.292 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 26.1 m -61.08 -41.76 97.25 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.154 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.37 -44.29 95.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.012 0.434 . . . . 0.0 110.374 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.519 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.7 mm-40 -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.568 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -59.0 4.77 0.09 OUTLIER Glycine 0 CA--C 1.529 0.914 0 C-N-CA 121.211 -0.519 . . . . 0.0 111.92 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.519 ' H ' ' C ' ' A' ' 739' ' ' GLN . 27.0 tp . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 117.0 0.4 . . . . 0.0 110.284 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.697 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -94.84 139.04 31.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.863 0.363 . . . . 0.0 111.296 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.498 ' CG2' HD13 ' A' ' 676' ' ' LEU . 89.9 mt -114.3 145.56 19.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.289 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.898 HD22 HD12 ' A' ' 667' ' ' LEU . 10.1 tp -107.69 134.5 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.765 0.317 . . . . 0.0 110.69 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' ' 633' ' ' LEU . 0.2 OUTLIER -129.13 116.9 19.93 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 632' ' ' LEU . 6.6 tt -109.41 120.38 42.32 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.505 ' N ' HD23 ' A' ' 633' ' ' LEU . 85.6 tt0 -159.41 153.96 24.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.479 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.658 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 82.6 tt0 -112.68 138.81 48.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.174 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.658 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 81.8 tt0 106.02 115.62 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.69 0.619 . . . . 0.0 110.381 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -60.65 -37.08 80.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.044 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -67.46 -50.1 60.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.301 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.37 87.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.973 0.416 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.641 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.54 -38.78 81.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.808 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 53.1 m -62.67 -44.39 96.37 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.782 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.85 -54.05 34.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.458 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.81 -41.26 87.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.452 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.772 ' SG ' ' CZ3' ' A' ' 656' ' ' TRP . 91.3 m -55.78 -43.47 76.8 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.454 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.17 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 90.1 mtp -68.08 -50.73 53.22 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.594 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 650' ' ' ALA . 74.8 mt -68.25 -43.54 77.65 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.143 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 90.5 m -56.43 -42.27 77.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.98 -28.7 69.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.372 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 647' ' ' LEU . . . -63.51 -17.03 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 86.5 2.68 84.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -95.04 149.17 21.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.052 0.453 . . . . 0.0 111.002 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -92.22 123.47 35.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.848 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.434 HG12 ' HB ' ' A' ' 630' ' ' ILE . 5.4 m -126.34 150.05 31.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.815 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 26.9 mm -108.49 125.45 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.772 ' CZ3' ' SG ' ' A' ' 644' ' ' CYS . 0.5 OUTLIER -95.24 125.71 40.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 111.383 -179.073 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 663' ' ' ALA . 86.7 mt -124.45 143.52 50.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.457 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 7.6 m -101.15 2.91 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.048 0.452 . . . . 0.0 109.989 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.406 ' OD1' ' C ' ' A' ' 659' ' ' ASP . 57.1 p30 -153.21 173.62 15.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.909 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.415 ' O ' ' HG ' ' A' ' 664' ' ' LEU . . . -102.23 -35.25 3.96 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.144 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 13.3 m -55.8 -44.29 77.68 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.863 0.363 . . . . 0.0 110.959 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 70.2 m -62.69 -36.78 84.03 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.66 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.25 -38.7 92.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.597 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 660' ' ' GLY . 18.3 mt -57.75 -47.68 81.8 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.881 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -63.83 -40.86 97.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.532 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -89.78 -54.56 4.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.947 0.403 . . . . 0.0 111.757 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.898 HD12 HD22 ' A' ' 631' ' ' LEU . 8.1 tt -45.05 -39.17 5.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.73 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -55.33 -37.28 67.21 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.535 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.17 -30.94 49.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.627 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 13.9 mt -71.91 -38.45 69.91 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.636 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 48.01 66.34 5.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -78.36 160.64 29.04 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 123.133 2.556 . . . . 0.0 113.156 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 74.7 mt -96.25 -23.03 4.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.098 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 40.6 t -143.73 140.12 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 120.872 0.368 . . . . 0.0 111.114 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.864 HG22 ' SD ' ' A' ' 677' ' ' MET . 76.0 mt -126.46 121.89 59.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.032 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 676' ' ' LEU . 2.8 mp -114.75 133.91 55.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.864 ' SD ' HG22 ' A' ' 675' ' ' ILE . 3.5 mpp? -138.87 139.17 38.02 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.54 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.24 146.16 53.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.603 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.776 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -132.1 14.25 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.776 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 6.6 Cg_exo -50.89 -44.17 43.13 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 121.423 1.415 . . . . 0.0 112.353 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 40.7 Cg_endo -86.88 164.31 8.91 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 123.098 2.532 . . . . 0.0 112.827 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -71.04 -65.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.969 2.446 . . . . 0.0 111.937 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.462 ' OD1' ' O ' ' A' ' 683' ' ' ASP . 50.2 p30 -82.5 156.91 23.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . 0.515 ' O ' HD12 ' A' ' 687' ' ' LEU . 49.5 tt0 -177.48 135.96 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.381 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . 0.428 ' C ' ' N ' ' A' ' 687' ' ' LEU . 37.0 m -61.18 -27.99 68.81 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.856 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.718 ' SG ' ' CZ3' ' A' ' 679' ' ' TRP . 25.8 p -52.84 -14.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.01 0.434 . . . . 0.0 109.867 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 684' ' ' GLN . 32.3 mt -64.22 -38.92 92.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.777 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.495 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 2.3 pp -70.46 -35.59 73.4 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.495 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 22.4 tp -57.84 -42.95 85.46 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.308 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.426 HD23 HD12 ' A' ' 693' ' ' LEU . 47.1 mt -62.18 -36.46 81.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.021 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . 0.412 ' HG3' HH21 ' A' ' 694' ' ' ARG . 49.8 tt0 -56.79 -41.75 78.27 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.434 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 29.3 t-80 -59.96 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.292 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . 0.426 HD12 HD23 ' A' ' 690' ' ' LEU . 40.8 mt -54.81 -40.36 69.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.718 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.412 HH21 ' HG3' ' A' ' 691' ' ' GLN . 66.2 mtm180 -63.97 -35.45 80.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -69.38 -35.94 76.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.012 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.616 ' CG ' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.236 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.216 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 120.497 0.124 . . . . 0.0 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.62 135.86 63.28 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.312 2.008 . . . . 0.0 112.45 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.711 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.5 mp -80.87 141.91 34.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.998 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.795 HG23 ' O ' ' A' ' 675' ' ' ILE . 14.6 p -130.57 136.3 58.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.336 0.588 . . . . 0.0 110.998 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.819 HD12 ' O ' ' A' ' 723' ' ' ALA . 12.4 tp -118.45 133.1 56.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.948 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -110.02 130.33 55.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.014 0.435 . . . . 0.0 111.487 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.67 147.0 25.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.414 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 99.05 -131.58 10.62 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.639 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.2 162.92 35.98 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.21 151.93 20.85 Favored 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.631 2.22 . . . . 0.0 112.616 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.404 ' CB ' ' HB2' ' A' ' 717' ' ' LEU . 58.5 Cg_exo -45.06 171.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.891 2.394 . . . . 0.0 112.868 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 713' ' ' VAL . 96.9 t -83.63 3.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . 0.533 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -161.68 152.77 15.3 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.029 0.443 . . . . 0.0 110.817 -179.588 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -69.63 -8.8 24.53 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.941 2.427 . . . . 0.0 112.41 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.45 -34.35 74.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.665 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 1.6 mm? -77.22 -36.04 55.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.7 m -62.56 -41.78 99.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.864 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.95 92.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.209 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -75.59 -28.9 59.1 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . 0.419 ' HA ' ' CG1' ' A' ' 705' ' ' VAL . . . -69.67 153.78 42.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.849 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 57.6 p -85.18 -31.61 23.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.819 ' O ' HD12 ' A' ' 706' ' ' LEU . . . -174.35 151.1 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.403 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.463 ' C ' HD12 ' A' ' 725' ' ' LEU . 65.6 mt -133.15 127.91 55.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.93 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.797 ' CD1' HD11 ' A' ' 706' ' ' LEU . 8.9 mp -105.09 158.8 16.32 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.86 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.43 9.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.518 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . 0.46 ' CB ' ' HZ3' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -132.85 92.58 25.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.498 179.633 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.52 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 53.2 Cg_exo -47.48 149.18 4.69 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.611 2.208 . . . . 0.0 112.415 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 59.3 mt 98.85 172.99 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.132 0.895 . . . . 0.0 110.148 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 61.77 62.81 2.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.054 179.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -64.36 -8.46 16.92 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.918 2.412 . . . . 0.0 112.272 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -69.4 -29.71 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.209 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 11.4 tp -66.63 -43.01 85.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.461 ' CD1' HD22 ' A' ' 706' ' ' LEU . 53.0 tp -57.97 -43.72 86.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.301 179.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.08 -38.6 86.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 75.5 m -57.66 -41.46 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.3 m -62.23 -46.46 88.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.497 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 63.1 mt -66.06 -40.12 90.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 741' ' ' LEU . 41.9 tt0 -66.21 -21.04 66.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.593 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.1 -2.73 0.01 OUTLIER Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.664 ' N ' ' O ' ' A' ' 739' ' ' GLN . 69.7 mt . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.685 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . 0.433 ' HB2' HD11 ' A' ' 670' ' ' LEU . 72.9 m80 -94.64 136.75 34.58 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.499 ' CD1' HD22 ' A' ' 647' ' ' LEU . 75.6 mt -117.19 135.74 56.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.874 0.369 . . . . 0.0 111.054 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.555 HD13 HD12 ' A' ' 667' ' ' LEU . 8.4 tt -109.03 128.65 55.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.784 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.711 HD23 ' C ' ' A' ' 632' ' ' LEU . 8.6 tt -127.16 127.38 44.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.952 0.406 . . . . 0.0 111.913 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.497 ' N ' HD23 ' A' ' 632' ' ' LEU . 44.6 tp -108.74 111.76 23.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.768 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.842 ' OE1' ' HB2' ' A' ' 678' ' ' ALA . 45.9 tp10 -160.28 156.9 27.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.933 0.397 . . . . 0.0 111.229 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 634' ' ' GLU . 85.4 tt0 -96.53 156.25 16.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.942 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.475 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 77.6 tt0 71.72 119.57 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.262 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 40.9 p-10 -62.99 -31.91 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.534 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.3 mt-10 -65.0 -40.83 95.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.336 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.84 62.3 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.918 0.389 . . . . 0.0 110.644 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -62.06 -35.28 78.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.946 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.41 ' O ' ' N ' ' A' ' 645' ' ' GLU . 86.6 m -62.79 -44.82 95.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.935 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 43.5 t -55.19 -53.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.448 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 58.4 t -60.77 -43.26 94.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.207 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.0 OUTLIER -67.39 -30.67 70.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.921 -179.676 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 641' ' ' THR . 41.6 tp10 -61.4 -45.49 94.11 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.163 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 93.6 mmm -65.3 -44.29 88.39 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.912 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.936 HD21 HD21 ' A' ' 734' ' ' LEU . 34.6 mt -67.71 -43.45 80.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.252 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.5 m -55.9 -42.04 75.42 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -62.83 -32.34 73.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.329 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.43 -6.34 45.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.827 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 92.46 -0.21 70.82 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.293 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -91.61 148.25 22.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 117.073 0.436 . . . . 0.0 110.829 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -91.05 130.73 36.92 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.68 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.437 HG21 ' HB2' ' A' ' 647' ' ' LEU . 24.6 t -116.86 137.06 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.257 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.42 127.13 66.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.703 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -95.49 114.51 26.28 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 111.355 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 53.1 mt -116.46 145.23 43.44 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 2.4 p -116.17 10.86 7.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.183 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -149.64 128.25 12.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.459 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.472 ' HA2' HD23 ' A' ' 689' ' ' LEU . . . -61.49 -38.09 95.22 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 m -59.2 -38.59 80.24 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.843 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 86.4 m -63.91 -40.31 96.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.859 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.7 -41.88 98.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.848 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.511 HD22 ' CE1' ' A' ' 692' ' ' HIS . 54.3 mt -59.2 -43.5 92.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -63.94 -38.75 92.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.376 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 670' ' ' LEU . 25.5 mt-30 -89.68 -49.86 6.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.083 0.468 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.1 tt -46.08 -46.2 16.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.427 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.597 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 52.3 t0 -62.6 -41.08 98.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 72.7 mt -77.2 -36.88 54.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.361 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 1.052 HD12 ' O ' ' A' ' 670' ' ' LEU . 0.1 OUTLIER -82.25 -39.99 22.23 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.137 -179.327 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 3.4 mt-30 54.08 75.38 0.63 Allowed Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 121.262 0.553 . . . . 0.0 110.236 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.33 165.3 32.13 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 123.684 2.923 . . . . 0.0 112.463 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 75.3 mt -93.25 -26.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.163 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.426 HG13 HG23 ' A' ' 630' ' ' ILE . 10.9 p -142.68 138.62 28.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.069 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 71.9 mt -116.6 129.42 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.179 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 706' ' ' LEU . 0.0 OUTLIER -106.5 130.43 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 38.9 ttm -141.08 137.59 32.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.317 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.842 ' HB2' ' OE1' ' A' ' 634' ' ' GLU . . . -67.66 153.06 44.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.495 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.76 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 37.9 t-105 -103.53 -19.82 0.19 Allowed Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.788 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.76 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 85.9 Cg_endo -85.51 121.45 2.24 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.966 1.778 . . . . 0.0 110.937 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -74.94 111.97 3.45 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.422 2.081 . . . . 0.0 112.748 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.8 -18.49 2.96 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.833 2.355 . . . . 0.0 111.061 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.531 ' O ' ' HB2' ' A' ' 684' ' ' GLN . 22.3 t70 -160.31 -11.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.43 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . 0.531 ' HB2' ' O ' ' A' ' 683' ' ' ASP . 90.3 mt-30 100.89 2.03 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 O-C-N 124.092 0.87 . . . . 0.0 110.873 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 21.9 m -65.13 -37.67 88.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.77 0.319 . . . . 0.0 111.158 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 78.8 m -62.13 -34.22 75.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.95 -32.83 74.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.186 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.2 -37.13 77.95 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.237 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.623 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.2 OUTLIER -62.16 -41.55 98.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.245 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.799 HD13 ' C ' ' A' ' 690' ' ' LEU . 3.0 tm? -59.82 -40.63 89.1 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.47 -42.63 96.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.781 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.511 ' CE1' HD22 ' A' ' 664' ' ' LEU . 24.0 t-80 -57.73 -50.18 74.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.505 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . 0.447 HD13 HG21 ' A' ' 705' ' ' VAL . 79.4 mt -54.95 -39.74 69.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.558 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -62.74 -33.55 75.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.646 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -67.5 -35.99 80.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.084 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.212 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.489 1.222 0 CA-C-O 120.737 0.224 . . . . 0.0 111.874 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.19 151.56 43.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.816 2.344 . . . . 0.0 112.021 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.8 mp -77.51 140.13 39.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.138 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 722' ' ' SER . 44.4 t -120.29 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.113 0.482 . . . . 0.0 111.097 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.624 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 5.5 mp -118.84 134.63 55.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -110.05 130.93 55.46 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.947 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.668 HD12 ' C ' ' A' ' 708' ' ' LEU . 0.9 OUTLIER -101.05 140.48 35.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . 0.429 ' N ' HD12 ' A' ' 708' ' ' LEU . . . 119.12 -131.77 9.25 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 158.24 48.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.768 0.318 . . . . 0.0 110.352 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -75.14 116.31 4.52 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.786 2.324 . . . . 0.0 112.127 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.45 ' HD2' HD13 ' A' ' 724' ' ' ILE . 51.5 Cg_exo -49.88 142.59 25.8 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.048 . . . . 0.0 111.997 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 93.3 t -82.75 -20.09 9.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.811 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.4 128.22 89.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.673 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -73.14 -30.14 10.95 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.213 1.942 . . . . 0.0 111.635 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.86 -35.12 69.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.208 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.613 ' CD2' ' CZ3' ' A' ' 679' ' ' TRP . 66.1 tp -73.3 -37.7 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.55 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . 0.493 HG23 HD11 ' A' ' 724' ' ' ILE . 33.2 m -63.48 -40.07 96.14 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.857 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.09 89.82 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.352 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -74.69 -29.62 61.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.441 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -69.13 139.59 54.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.522 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.616 ' N ' ' O ' ' A' ' 705' ' ' VAL . 80.5 p -85.25 -28.59 25.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.502 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.624 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -173.93 121.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.208 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.493 HD11 HG23 ' A' ' 718' ' ' THR . 54.3 mt -91.65 124.14 44.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.893 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.582 HD11 HD13 ' A' ' 734' ' ' LEU . 59.9 mt -103.14 124.37 48.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.726 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 5.1 m -72.93 -79.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.746 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -142.84 167.4 16.21 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.176 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -60.99 119.65 6.92 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 121.81 1.673 . . . . 0.0 111.477 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.691 ' O ' HD23 ' A' ' 729' ' ' LEU . 7.1 tt -178.65 -40.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.823 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 730' ' ' ASP . 0.0 OUTLIER -129.82 72.17 81.99 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.955 0.407 . . . . 0.0 110.909 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -71.55 7.49 1.52 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.866 2.378 . . . . 0.0 111.9 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.478 ' HG3' ' N ' ' A' ' 733' ' ' LEU . 21.5 pt20 -71.92 -36.22 69.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.455 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . 0.478 ' N ' ' HG3' ' A' ' 732' ' ' GLN . 14.4 tp -66.93 -42.91 84.54 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.078 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.936 HD21 HD21 ' A' ' 647' ' ' LEU . 14.2 tp -56.63 -50.14 72.91 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.42 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 85.6 mt -62.27 -37.12 84.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.147 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 66.1 m -59.0 -40.33 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.349 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 86.5 m -61.26 -47.5 85.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.622 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.529 HD12 ' N ' ' A' ' 738' ' ' LEU . 7.0 mp -66.28 -45.08 81.69 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.511 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -66.35 -28.21 68.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.276 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.25 -36.9 16.94 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 179.548 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.683 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -89.81 136.1 33.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.773 0.321 . . . . 0.0 110.525 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.4 mm -112.11 134.78 53.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.661 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.689 ' CD2' HD12 ' A' ' 667' ' ' LEU . 56.1 tp -114.11 136.01 53.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.746 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.827 HD23 ' C ' ' A' ' 632' ' ' LEU . 6.8 tt -133.96 125.1 27.51 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.038 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.742 ' N ' HD23 ' A' ' 632' ' ' LEU . 9.3 tt -118.9 127.74 53.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.751 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.796 ' CD ' ' HB2' ' A' ' 640' ' ' ALA . 0.0 OUTLIER -159.06 171.57 19.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 0.0 111.028 -179.509 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -107.33 163.2 13.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.28 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 66.75 118.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.402 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -58.21 -37.33 74.61 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.185 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -64.91 -41.82 95.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.083 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -65.45 -39.11 91.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.906 0.384 . . . . 0.0 110.448 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.796 ' HB2' ' CD ' ' A' ' 634' ' ' GLU . . . -66.7 -39.51 88.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.727 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 59.6 m -62.06 -47.05 86.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.006 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.6 t -57.38 -53.67 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . 0.665 HG11 HD11 ' A' ' 632' ' ' LEU . 61.1 t -60.53 -42.82 92.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.904 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.656 ' SG ' ' O ' ' A' ' 640' ' ' ALA . 74.9 m -56.89 -36.78 70.52 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -62.35 -40.07 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.293 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 16.3 mmt -65.38 -50.25 66.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.962 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.605 ' N ' HD12 ' A' ' 647' ' ' LEU . 10.0 mp -70.35 -45.55 65.88 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.434 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 48.5 m -55.87 -42.98 76.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.038 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.06 65.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.581 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.42 -11.3 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.18 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.12 -3.88 67.14 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.73 149.24 21.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.647 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -93.36 127.73 39.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.019 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.5 p -126.52 142.0 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.966 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . 0.424 HG22 ' CD2' ' A' ' 657' ' ' LEU . 14.9 mm -103.5 133.67 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.726 ' C ' HD22 ' A' ' 657' ' ' LEU . 16.4 t90 -91.42 112.82 24.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.979 0.418 . . . . 0.0 111.509 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.726 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.8 mm? -111.93 138.49 48.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.89 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 35.4 m -110.88 8.51 8.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.465 ' C ' HD11 ' A' ' 633' ' ' LEU . 18.6 t70 -150.48 130.82 13.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.51 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.449 ' CA ' HD23 ' A' ' 689' ' ' LEU . . . -63.63 -45.09 95.42 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.269 -0.491 . . . . 0.0 111.99 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 19.8 m -60.84 -44.71 96.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 111.117 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.9 m -64.55 -35.15 80.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.04 -43.19 99.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.465 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.906 HD22 ' ND1' ' A' ' 692' ' ' HIS . 90.8 mt -59.73 -47.26 86.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.348 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . 0.554 ' OD1' ' C ' ' A' ' 665' ' ' ASP . 0.5 OUTLIER -64.48 -37.55 87.92 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.97 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.544 ' N ' ' OD1' ' A' ' 665' ' ' ASP . 23.8 mt-30 -83.36 -43.77 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.702 HD23 ' C ' ' A' ' 667' ' ' LEU . 9.8 tt -48.57 -36.46 15.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.48 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -54.62 -39.83 68.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.022 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 73.6 mt -78.3 -27.65 47.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.357 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 15.7 mt -73.06 -38.82 66.33 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.594 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.437 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.4 mm-40 46.35 63.74 9.3 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 74.4 Cg_endo -83.56 152.95 13.54 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 C-N-CA 123.227 2.618 . . . . 0.0 112.61 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.77 HG23 HG23 ' A' ' 674' ' ' VAL . 19.5 tt -93.46 -18.75 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.272 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.77 HG23 HG23 ' A' ' 673' ' ' ILE . 59.7 t -145.24 137.57 20.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.01 0.434 . . . . 0.0 110.938 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.428 ' O ' HG23 ' A' ' 705' ' ' VAL . 59.3 mt -126.08 122.49 61.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.011 -179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.616 HD12 ' N ' ' A' ' 676' ' ' LEU . 4.5 mp -109.66 133.73 52.78 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 76.1 mtm -144.69 133.79 22.76 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.987 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 680' ' ' PRO . . . -66.14 154.13 40.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.786 178.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -117.05 80.45 11.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.78 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.409 ' C ' ' HD2' ' A' ' 682' ' ' PRO . 90.1 Cg_endo -94.7 114.61 0.19 Allowed 'Trans proline' 0 C--N 1.31 -1.489 0 C-N-CA 123.426 2.751 . . . . 0.0 112.142 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.55 ' N ' ' CD ' ' A' ' 682' ' ' PRO . 20.3 Cg_exo -53.79 -42.59 65.1 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.207 1.938 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.599 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 31.9 Cg_exo -52.73 -5.17 0.17 Allowed 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.02 1.813 . . . . 0.0 111.033 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.599 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 83.2 m-20 -150.44 73.67 1.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.874 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.16 8.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.629 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . 0.539 ' H ' ' C ' ' A' ' 683' ' ' ASP . 43.8 m -59.75 -27.47 66.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.806 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.421 ' O ' HD23 ' A' ' 690' ' ' LEU . 85.6 m -57.01 -23.19 44.49 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.539 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 82.0 mt -63.76 -32.92 74.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.363 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.655 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.7 OUTLIER -69.68 -36.28 75.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.468 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.634 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.2 OUTLIER -61.63 -43.24 99.23 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.514 HD11 ' CZ ' ' A' ' 707' ' ' PHE . 3.8 mm? -60.83 -36.87 80.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.01 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -60.05 -43.55 95.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.906 ' ND1' HD22 ' A' ' 664' ' ' LEU . 15.5 t-80 -59.15 -49.75 76.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.511 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.14 -40.38 70.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.29 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.413 ' NH2' HD21 ' A' ' 717' ' ' LEU . 37.8 ttm180 -61.99 -33.8 74.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.985 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -67.08 -33.78 76.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.416 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.565 ' NE2' ' NE2' ' A' ' 692' ' ' HIS . 96.1 m-70 . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.626 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo . . . . . 0 N--CA 1.489 1.245 0 N-CA-C 111.576 -0.202 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.81 146.2 23.36 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.798 2.332 . . . . 0.0 113.201 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.712 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.4 mp -81.5 143.89 31.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.659 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.662 ' C ' HD12 ' A' ' 706' ' ' LEU . 12.3 p -133.25 137.89 52.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.53 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.851 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.3 mp -119.37 135.56 54.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.25 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . 0.514 ' CZ ' HD11 ' A' ' 690' ' ' LEU . 95.3 m-85 -117.88 131.5 56.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.689 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 54.6 mt -99.89 142.52 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.805 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 726' ' ' SER . . . 110.71 -140.85 16.16 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -87.09 152.95 53.92 Favored Pre-proline 0 C--N 1.328 -0.326 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.523 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -74.19 153.1 45.85 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.547 2.165 . . . . 0.0 112.482 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -48.38 162.4 0.33 Allowed 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.757 2.305 . . . . 0.0 112.863 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 2.2 t -84.46 16.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.056 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.63 148.21 11.27 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.983 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.83 -10.76 23.46 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.766 2.311 . . . . 0.0 112.958 -178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.672 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 0.9 OUTLIER -70.58 -37.34 73.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.5 -179.63 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.413 HD21 ' NH2' ' A' ' 694' ' ' ARG . 48.1 mt -78.09 -38.8 43.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 86.7 m -63.8 -40.61 97.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.852 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.91 89.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.24 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -76.57 -25.36 53.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.357 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.4 146.69 48.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 19.0 t -85.38 -27.36 25.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.669 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -169.84 154.77 5.45 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.165 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 39.0 mt -148.98 120.03 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.063 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 25.4 mt -104.23 115.12 29.84 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.784 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 709' ' ' GLY . 8.8 m -70.08 -36.65 75.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.663 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -134.74 96.38 14.9 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -48.11 133.53 23.95 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.282 1.988 . . . . 0.0 111.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 16.6 tp -176.39 138.53 0.31 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.419 ' C ' ' H ' ' A' ' 732' ' ' GLN . 29.6 m-20 62.06 75.69 0.42 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.734 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.54 -9.3 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.715 2.277 . . . . 0.0 111.77 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 730' ' ' ASP . 93.1 mt-30 -69.89 -35.79 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 32.6 tp -67.3 -39.75 85.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 13.0 tp -57.32 -41.04 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.05 -38.95 93.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.752 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 71.9 m -59.2 -46.83 87.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.968 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.8 m -63.43 -41.68 98.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.583 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.423 ' C ' HD23 ' A' ' 738' ' ' LEU . 9.8 tt -63.32 -37.92 89.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.106 0.479 . . . . 0.0 110.045 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 741' ' ' LEU . 6.7 tt0 -64.84 -30.43 71.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.797 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.42 -5.06 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.16 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.674 ' N ' ' O ' ' A' ' 739' ' ' GLN . 19.1 tp . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.194 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.637 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -88.13 163.59 16.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.754 0.311 . . . . 0.0 110.538 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 65.4 mt -111.58 141.74 26.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.959 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.79 HD13 ' C ' ' A' ' 631' ' ' LEU . 2.8 tm? -110.96 123.75 50.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.309 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.778 ' N ' HD13 ' A' ' 631' ' ' LEU . 10.2 tt -123.1 126.66 47.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.993 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 41.8 tp -111.13 117.08 32.29 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.498 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 84.2 tt0 -159.7 159.91 33.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.729 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.599 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 84.7 tt0 -106.91 141.08 38.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.382 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.599 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 28.6 tp10 93.23 115.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.443 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.7 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 57.3 p30 -63.6 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.7 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 49.5 tp10 -63.81 -47.2 81.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.941 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.37 -43.51 66.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.977 0.418 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.45 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -65.14 -40.49 94.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.128 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 645' ' ' GLU . 90.3 m -61.73 -45.35 94.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.924 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 52.1 t -55.89 -52.0 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.237 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.53 -46.7 95.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.726 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . . . . . . . . . 72.6 m -69.36 -32.99 72.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.015 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 641' ' ' THR . 85.0 tt0 -60.23 -43.48 96.01 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.575 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 73.6 mtp -71.25 -40.73 70.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.367 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.44 ' HA ' HD23 ' A' ' 647' ' ' LEU . 83.1 mt -67.84 -45.45 74.6 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.958 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 30.0 m -56.16 -42.59 77.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.72 -31.07 69.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.492 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -75.7 -1.97 27.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.535 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 84.64 10.42 79.42 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -94.92 136.14 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.439 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -95.82 121.52 37.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.933 0.396 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 13.0 p -136.6 140.24 43.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.313 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.47 128.69 65.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.45 ' CG ' ' HB1' ' A' ' 640' ' ' ALA . 26.3 t90 -95.38 117.64 30.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.342 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.58 HD11 HE21 ' A' ' 666' ' ' GLN . 69.2 mt -118.69 150.79 39.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.542 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.632 ' O ' HG22 ' A' ' 658' ' ' VAL . 14.5 p -103.91 7.36 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.267 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.8 t0 -148.09 119.98 8.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -55.78 -35.85 64.15 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . 0.52 ' HA ' HD12 ' A' ' 664' ' ' LEU . 37.5 m -58.88 -40.42 84.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.881 0.372 . . . . 0.0 110.467 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 53.2 m -63.76 -38.66 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.872 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.581 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -62.31 -40.27 95.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.973 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.6 HD21 HD12 ' A' ' 689' ' ' LEU . 60.7 mt -59.94 -37.58 79.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.636 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -63.04 -44.59 95.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.319 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.58 HE21 HD11 ' A' ' 657' ' ' LEU . 6.2 mt-30 -90.38 -41.68 11.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.623 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.5 tt -47.0 -46.02 21.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.27 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -61.85 -35.19 77.54 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.488 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 45.1 mt -76.97 -44.21 32.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.237 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.41 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.9 OUTLIER -83.55 -12.83 55.67 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.629 -178.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.41 ' C ' ' O ' ' A' ' 670' ' ' LEU . 37.4 mm-40 40.09 74.36 0.72 Allowed Pre-proline 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.35 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.463 ' CD ' ' HG ' ' A' ' 667' ' ' LEU . 56.2 Cg_endo -73.14 150.79 48.54 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.909 2.406 . . . . 0.0 112.448 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.82 HG13 HG23 ' A' ' 674' ' ' VAL . 27.5 pt -95.3 -12.13 8.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.461 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.82 HG23 HG13 ' A' ' 673' ' ' ILE . 88.4 t -140.13 134.77 36.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.304 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.3 mt -128.7 124.91 62.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.982 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.3 mp -103.38 143.59 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.932 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.46 ' HE1' ' SG ' ' A' ' 686' ' ' CYS . 80.3 mtp -139.12 116.25 11.03 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.002 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.72 146.19 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.003 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.778 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 20.6 t-105 -118.22 -35.67 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.74 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.778 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 26.0 Cg_exo -54.0 -42.54 65.96 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.252 1.968 . . . . 0.0 113.053 -179.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.511 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 74.1 Cg_endo -84.47 157.26 12.48 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.312 2.008 . . . . 0.0 112.07 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -48.54 -81.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.702 2.268 . . . . 0.0 111.528 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 686' ' ' CYS . 85.4 m-20 53.35 57.13 6.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.587 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -53.67 -32.0 49.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.891 0.377 . . . . 0.0 110.26 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 17.3 m -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.212 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.46 ' SG ' ' HE1' ' A' ' 677' ' ' MET . 4.5 t -57.19 -29.55 63.79 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.286 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.88 -38.16 88.06 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.751 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.756 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.4 OUTLIER -70.45 -37.89 74.4 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.468 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.6 HD12 HD21 ' A' ' 664' ' ' LEU . 9.7 tp -60.07 -41.56 92.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.831 HD13 ' C ' ' A' ' 690' ' ' LEU . 3.1 tm? -59.72 -42.73 93.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.515 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -60.29 -43.33 96.37 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.821 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -59.29 -51.65 69.03 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.085 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 74.2 mt -54.24 -43.33 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.275 0.56 . . . . 0.0 109.822 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -65.31 -30.56 71.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.106 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 696' ' ' HIS . 40.6 tp10 -65.3 -50.96 63.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.441 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.511 ' CD2' ' O ' ' A' ' 696' ' ' HIS . 0.6 OUTLIER . . . . . 0 N--CA 1.463 0.214 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.72 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo . . . . . 0 N--CA 1.491 1.367 0 CA-C-O 120.751 0.229 . . . . 0.0 111.92 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -47.17 155.01 1.13 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.938 2.426 . . . . 0.0 111.861 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.433 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 34.0 mt -76.69 146.53 38.01 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.737 ' C ' HD12 ' A' ' 706' ' ' LEU . 13.7 p -123.74 135.72 62.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.22 0.533 . . . . 0.0 110.931 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.809 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.3 mp -122.16 138.14 54.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.654 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -107.3 130.08 54.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.908 0.385 . . . . 0.0 110.188 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 1.159 HD12 ' N ' ' A' ' 709' ' ' GLY . 0.1 OUTLIER -94.9 136.88 34.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.392 -179.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . 1.159 ' N ' HD12 ' A' ' 708' ' ' LEU . . . 99.62 -132.74 11.04 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -90.01 149.39 41.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.886 0.374 . . . . 0.0 110.67 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.518 ' HB3' HG21 ' A' ' 724' ' ' ILE . 57.1 Cg_endo -73.75 151.27 45.98 Favored 'Trans proline' 0 C--N 1.307 -1.626 0 C-N-CA 122.866 2.378 . . . . 0.0 112.158 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.53 157.39 41.81 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 122.675 2.25 . . . . 0.0 111.789 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 80.5 t -77.98 -38.54 24.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.795 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -72.73 136.27 80.5 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.562 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -74.76 -12.88 22.09 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 C-N-CA 122.596 2.197 . . . . 0.0 112.495 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.4 mt -70.86 -31.44 68.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 61.4 mt -76.48 -33.71 58.68 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 62.2 m -63.11 -42.48 99.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.885 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.77 91.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.354 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -78.55 -22.63 46.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.729 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.97 138.09 47.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.453 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.433 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 22.2 t -85.56 -26.79 25.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.147 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.526 ' HB3' ' HG ' ' A' ' 706' ' ' LEU . . . -169.19 152.43 5.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.518 HG21 ' HB3' ' A' ' 711' ' ' PRO . 69.3 mt -130.11 128.83 65.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.012 0.434 . . . . 0.0 110.642 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.529 ' O ' ' O ' ' A' ' 709' ' ' GLY . 58.1 mt -104.59 149.76 25.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.143 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . 0.428 ' H ' ' H ' ' A' ' 727' ' ' LYS . 55.7 p -165.45 -2.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.81 0.338 . . . . 0.0 110.626 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . 0.428 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.3 OUTLIER -127.07 81.9 69.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.828 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.654 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.5 Cg_exo -49.67 147.99 12.65 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.061 2.507 . . . . 0.0 112.57 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.654 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 15.9 tp 105.5 154.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.945 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 732' ' ' GLN . 17.3 t0 63.19 62.65 1.71 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 28.6 Cg_exo -57.44 -0.06 0.3 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.869 2.379 . . . . 0.0 111.868 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 730' ' ' ASP . 12.1 mm100 -69.91 -29.77 67.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.595 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.66 -45.84 81.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.555 HD11 HD22 ' A' ' 706' ' ' LEU . 37.6 tp -58.37 -40.87 83.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.573 178.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.6 -38.72 88.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.265 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 28.3 m -57.76 -40.24 79.27 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 82.9 m -60.96 -40.91 95.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.011 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.711 HD11 HG21 ' A' ' 674' ' ' VAL . 4.1 mm? -64.63 -38.38 90.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -63.49 -35.19 79.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -62.2 -11.25 31.92 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 53.3 tp . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.992 -179.896 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.58 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -90.89 148.99 22.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.076 0.465 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.6 mm -112.18 134.92 53.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.202 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.817 HD13 ' N ' ' A' ' 632' ' ' LEU . 1.0 OUTLIER -107.44 124.61 50.12 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.237 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.817 ' N ' HD13 ' A' ' 631' ' ' LEU . 9.1 tt -131.33 127.05 36.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.648 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.859 HD22 ' SG ' ' A' ' 686' ' ' CYS . 6.7 tt -109.47 116.3 31.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.127 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.499 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 82.9 tt0 -159.97 158.15 30.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.599 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.519 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 22.2 pt-20 -100.5 162.46 12.92 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.519 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.8 tp10 83.56 112.65 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.458 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.686 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 93.2 m-20 -63.9 -36.0 82.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.625 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.414 ' CG ' ' N ' ' A' ' 639' ' ' ALA . 5.3 pt-20 -67.21 -37.33 83.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.138 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.414 ' N ' ' CG ' ' A' ' 638' ' ' GLU . . . -71.29 -45.3 63.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.388 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.453 ' HB1' ' HB2' ' A' ' 656' ' ' TRP . . . -66.89 -35.68 80.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.749 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 89.5 m -62.29 -48.08 81.49 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.741 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.79 -47.43 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.147 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . 0.544 HG11 HD13 ' A' ' 632' ' ' LEU . 57.4 t -61.07 -42.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.581 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.705 ' SG ' HG13 ' A' ' 654' ' ' VAL . 0.8 OUTLIER -62.43 -45.64 92.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -61.78 -38.38 87.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.905 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.96 -52.34 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.796 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.408 ' N ' HD12 ' A' ' 647' ' ' LEU . 8.0 mp -68.46 -46.42 69.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.961 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.577 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.0 m -55.66 -39.86 71.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.773 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.24 -29.36 68.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.776 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -79.33 -3.18 44.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.02 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.71 -10.11 68.61 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . 0.592 ' CG ' HD13 ' A' ' 738' ' ' LEU . 81.9 m-85 -94.46 130.02 40.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -94.71 133.33 38.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.402 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.705 HG13 ' SG ' ' A' ' 644' ' ' CYS . 9.0 p -131.0 140.88 47.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.194 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 11.5 mm -103.01 134.02 45.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.686 ' CH2' ' OD1' ' A' ' 637' ' ' ASP . 9.5 t90 -93.21 115.11 27.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.65 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.607 HD11 HD21 ' A' ' 631' ' ' LEU . 54.3 mt -114.84 141.57 47.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.606 ' CG2' ' CZ2' ' A' ' 656' ' ' TRP . 40.2 t -98.39 -0.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.777 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.571 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 74.4 m-20 -150.76 146.91 26.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.789 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -69.32 -40.62 80.46 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.104 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 95.9 p -59.43 -37.93 79.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.718 0.294 . . . . 0.0 111.215 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.5 m -62.17 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 109.787 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.77 -43.21 97.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.005 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.58 -45.51 81.29 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.831 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 88.9 m-20 -64.08 -43.61 94.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.836 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.404 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 27.7 mt-30 -86.67 -52.6 5.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.091 0.472 . . . . 0.0 111.226 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 667' ' ' LEU . 8.6 tt -45.08 -37.83 4.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.139 -178.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.559 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 21.4 p-10 -56.26 -40.02 73.53 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.047 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.518 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 33.7 mt -79.3 -26.94 42.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 10.6 mt -72.23 -41.95 66.27 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.422 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 51.76 67.53 4.04 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.64 159.13 25.18 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.41 2.74 . . . . 0.0 113.369 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 61.1 mt -95.1 -23.37 5.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.988 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 17.3 t -143.54 139.39 26.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.556 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.603 HG23 ' HB3' ' A' ' 631' ' ' LEU . 63.5 mt -124.1 130.89 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.982 0.42 . . . . 0.0 111.539 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.735 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -105.06 146.11 29.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.699 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.36 119.22 14.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.529 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.95 144.96 54.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.597 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.786 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.8 t-105 -118.16 -32.36 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.786 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.1 Cg_exo -49.33 -41.09 43.6 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.001 1.801 . . . . 0.0 112.769 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 11.0 Cg_exo -67.44 159.43 52.44 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.287 1.991 . . . . 0.0 111.513 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.39 -7.38 1.24 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.518 2.145 . . . . 0.0 111.349 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.642 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 13.6 t70 56.27 -129.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.458 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . 0.642 ' CB ' ' O ' ' A' ' 683' ' ' ASP . 3.3 tm0? 100.84 -78.31 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.372 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 60.5 p -66.88 -26.75 67.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.965 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.859 ' SG ' HD22 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -61.25 -22.04 64.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.562 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.9 mt -62.72 -34.41 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.422 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 77.1 mt -67.76 -38.03 82.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.677 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.17 -47.64 84.57 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.03 0.443 . . . . 0.0 110.215 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.472 HD12 ' H ' ' A' ' 690' ' ' LEU . 6.5 mp -62.16 -32.88 73.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.62 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -60.29 -41.53 93.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.658 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.643 ' NE2' ' ND1' ' A' ' 696' ' ' HIS . 19.1 t-160 -56.93 -49.53 75.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.45 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . 0.472 HD21 HD12 ' A' ' 675' ' ' ILE . 97.0 mt -56.32 -41.31 75.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.691 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -63.18 -39.82 95.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.948 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -69.78 -32.26 70.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.771 -0.371 . . . . 0.0 110.81 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.643 ' ND1' ' NE2' ' A' ' 692' ' ' HIS . 55.1 m170 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.315 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo . . . . . 0 N--CA 1.488 1.165 0 CA-C-O 120.549 0.145 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.85 149.08 32.89 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.579 2.186 . . . . 0.0 112.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.617 ' H ' HD12 ' A' ' 704' ' ' LEU . 5.3 mp -78.69 145.98 34.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.963 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 58.6 t -121.61 126.39 74.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.017 0.437 . . . . 0.0 111.087 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.917 HD22 ' HB3' ' A' ' 723' ' ' ALA . 44.6 mt -117.66 140.1 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.396 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -111.92 132.16 54.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.443 HD11 HD11 ' A' ' 632' ' ' LEU . 23.9 mt -94.84 148.29 22.46 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.391 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . 0.445 ' O ' ' OG ' ' A' ' 726' ' ' SER . . . 69.63 -119.51 9.21 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.4 148.57 40.79 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.854 0.359 . . . . 0.0 110.851 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.804 ' HB3' HD13 ' A' ' 724' ' ' ILE . 73.9 Cg_endo -76.0 161.05 36.3 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.182 2.588 . . . . 0.0 112.937 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.7 154.21 70.61 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 123.252 2.635 . . . . 0.0 111.91 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 92.7 t -79.44 -34.77 16.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.44 127.61 92.71 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.24 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -69.63 -25.12 29.53 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.676 HD22 ' N ' ' A' ' 716' ' ' LEU . 3.7 mm? -71.49 -33.89 69.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 85.5 mt -78.13 -36.0 48.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 721' ' ' ALA . 91.9 m -64.33 -44.91 90.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.919 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.05 -36.77 82.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.366 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -77.78 -6.9 55.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.114 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 718' ' ' THR . . . -73.98 144.27 45.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.245 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.419 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 38.0 m -85.45 -33.47 21.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.443 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.917 ' HB3' HD22 ' A' ' 706' ' ' LEU . . . -171.5 131.83 0.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.804 HD13 ' HB3' ' A' ' 711' ' ' PRO . 78.0 mt -92.8 123.94 45.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.68 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.6 mt -109.52 150.91 27.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.657 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 709' ' ' GLY . 0.7 OUTLIER -168.27 -57.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -103.58 145.31 30.38 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.295 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.3 149.39 88.46 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.722 2.281 . . . . 0.0 111.707 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.512 ' O ' HD23 ' A' ' 729' ' ' LEU . 7.0 tt -177.87 85.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.696 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.619 ' C ' ' H ' ' A' ' 732' ' ' GLN . 39.0 m-20 53.49 86.71 0.16 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.307 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.17 -0.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.568 2.179 . . . . 0.0 111.753 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.619 ' H ' ' C ' ' A' ' 730' ' ' ASP . 97.1 mt-30 -68.12 -28.87 67.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.482 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.46 -44.16 91.97 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.676 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.37 -43.51 92.87 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.73 -39.58 92.05 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.688 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . 0.459 ' O ' ' N ' ' A' ' 740' ' ' GLY . 58.4 m -60.16 -39.8 87.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.62 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 30.2 m -59.36 -46.15 89.44 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.949 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.592 HD13 ' CG ' ' A' ' 652' ' ' PHE . 87.9 mt -68.03 -50.71 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.981 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -66.94 -27.25 67.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.344 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 736' ' ' THR . . . -49.83 -29.89 14.15 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.731 ' N ' HD12 ' A' ' 741' ' ' LEU . 5.5 mp . . . . . 0 C--N 1.329 -0.292 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.456 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -90.72 136.59 32.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.407 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.82 HG23 HG13 ' A' ' 674' ' ' VAL . 74.3 mt -114.93 135.79 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 667' ' ' LEU . 8.1 tt -122.46 125.51 45.96 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.519 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.566 HD12 ' N ' ' A' ' 632' ' ' LEU . 4.5 mp -117.28 135.2 54.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.127 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.461 ' HB3' ' SG ' ' A' ' 686' ' ' CYS . 5.0 mp -107.96 111.41 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.65 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.529 ' HA ' HE22 ' A' ' 684' ' ' GLN . 87.2 tt0 -160.05 157.08 28.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.646 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.644 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 94.1 mt-10 -111.07 150.63 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.105 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.644 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 72.8 tt0 103.76 102.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.666 0.604 . . . . 0.0 109.705 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.512 ' O ' ' OG1' ' A' ' 641' ' ' THR . 54.4 t0 -56.19 -36.08 67.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.637 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.706 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.65 -45.49 52.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.937 0.398 . . . . 0.0 110.449 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.514 ' HB2' ' NE1' ' A' ' 656' ' ' TRP . . . -65.2 -38.79 91.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.913 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.2 m -62.37 -46.48 88.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.844 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 42.1 t -56.24 -53.51 38.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.777 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . 0.406 HG11 ' HH2' ' A' ' 656' ' ' TRP . 76.2 t -59.22 -42.78 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.724 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.502 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.3 m -58.17 -40.86 82.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.16 -38.39 88.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.192 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 12.2 mmm -68.03 -49.14 63.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.279 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.523 HD13 HG11 ' A' ' 654' ' ' VAL . 39.4 mt -68.73 -43.08 76.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.973 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.502 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 65.6 m -56.05 -41.32 74.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.787 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.21 70.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.24 -5.39 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.781 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.73 5.98 83.45 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -95.47 135.41 37.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.879 0.371 . . . . 0.0 110.867 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . 0.45 ' HZ2' HD11 ' A' ' 655' ' ' ILE . 20.2 tttm -93.78 122.66 36.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.64 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.786 HG12 ' HB ' ' A' ' 630' ' ' ILE . 6.2 m -128.31 150.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 111.276 -179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . 0.56 HG21 ' NE2' ' A' ' 666' ' ' GLN . 27.4 mm -114.16 129.87 69.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.005 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.791 ' C ' HD22 ' A' ' 657' ' ' LEU . 1.4 t-105 -96.77 133.86 40.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.88 0.371 . . . . 0.0 111.475 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.791 HD22 ' C ' ' A' ' 656' ' ' TRP . 4.3 mm? -120.12 140.94 50.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.589 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 19.3 m -107.53 6.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.957 0.408 . . . . 0.0 109.975 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.486 ' C ' ' OD1' ' A' ' 659' ' ' ASP . 48.6 p30 -153.36 -168.76 3.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.337 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -113.12 -37.24 1.38 Allowed Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 24.4 m -58.84 -45.77 89.29 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . 0.499 HG22 ' OE1' ' A' ' 666' ' ' GLN . 53.7 m -65.01 -36.71 85.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.228 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.13 -45.9 91.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.797 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' A' ' 689' ' ' LEU . 94.4 mt -57.88 -45.08 86.9 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.323 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -63.1 -41.16 99.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.004 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.67 ' OE1' HD11 ' A' ' 657' ' ' LEU . 19.8 pt20 -94.46 -45.75 7.3 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.561 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.9 tt -48.15 -41.54 27.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.833 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -61.58 -35.27 77.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.701 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 90.1 mt -76.5 -44.2 36.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.194 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' A' ' 667' ' ' LEU . 1.4 pp -81.54 -15.69 54.07 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.866 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 670' ' ' LEU . 2.8 mm-40 37.97 77.99 0.38 Allowed Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.385 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -69.35 156.98 62.87 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.555 2.17 . . . . 0.0 112.465 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 10.0 mm -93.16 -24.95 5.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.323 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.82 HG13 HG23 ' A' ' 630' ' ' ILE . 13.2 p -143.57 142.11 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.371 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.2 mt -127.82 127.27 68.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.101 0.477 . . . . 0.0 111.755 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.36 131.47 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.416 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 65.7 ttp -139.92 127.61 21.79 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.3 152.22 44.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.864 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.407 ' CZ3' ' CD2' ' A' ' 687' ' ' LEU . 32.2 t-105 -124.93 72.09 62.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -87.51 144.37 6.65 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.118 2.545 . . . . 0.0 112.11 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.73 ' O ' ' N ' ' A' ' 683' ' ' ASP . 5.8 Cg_exo -51.25 -50.39 14.09 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.651 2.234 . . . . 0.0 113.26 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 52.8 Cg_exo -38.35 -11.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 122.538 2.159 . . . . 0.0 112.064 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.73 ' N ' ' O ' ' A' ' 681' ' ' PRO . 13.2 t0 73.72 78.15 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . 0.531 ' O ' HD12 ' A' ' 687' ' ' LEU . 45.4 tt0 -60.35 138.8 57.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.465 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . 0.442 ' C ' ' N ' ' A' ' 687' ' ' LEU . 38.1 m -62.27 -29.34 70.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.623 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.461 ' SG ' ' HB3' ' A' ' 633' ' ' LEU . 83.7 m -53.59 -14.05 0.77 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . 0.588 ' CD1' ' OD1' ' A' ' 683' ' ' ASP . 47.2 mt -62.65 -32.38 73.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.146 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 56.5 mt -64.26 -39.73 94.53 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.88 HD13 ' C ' ' A' ' 689' ' ' LEU . 2.4 tm? -60.22 -44.11 95.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.182 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 19.5 tp -59.22 -39.57 83.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.749 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -60.2 -39.21 85.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.91 0.386 . . . . 0.0 110.064 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.412 ' CD2' ' C ' ' A' ' 692' ' ' HIS . 5.3 t60 -57.51 -50.0 74.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.963 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.92 -35.41 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.576 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.512 HH22 ' HA ' ' A' ' 717' ' ' LEU . 24.4 mmt180 -62.04 -36.76 82.59 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.107 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -68.74 -33.86 74.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.467 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.166 -179.754 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo . . . . . 0 N--CA 1.49 1.274 0 CA-C-O 120.694 0.206 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -63.05 161.16 30.9 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.703 2.269 . . . . 0.0 111.722 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.3 tp -76.63 124.9 28.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.975 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.499 ' C ' HD12 ' A' ' 706' ' ' LEU . 61.0 t -122.56 132.26 71.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 121.157 0.503 . . . . 0.0 111.874 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.641 ' N ' HD12 ' A' ' 706' ' ' LEU . 5.2 mp -125.01 145.68 49.78 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.438 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -106.25 123.37 47.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.979 0.418 . . . . 0.0 110.585 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.2 mt -96.76 150.83 20.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.575 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -123.7 6.46 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.04 156.1 46.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -71.05 156.4 59.98 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 123.099 2.533 . . . . 0.0 112.286 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.521 ' HD2' HD13 ' A' ' 724' ' ' ILE . 36.8 Cg_endo -68.29 -153.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.898 2.399 . . . . 0.0 111.771 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 1.5 t -145.12 -52.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.498 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.09 145.07 90.83 Favored Pre-proline 0 C--N 1.327 -0.374 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.191 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.53 -17.62 33.96 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.592 2.195 . . . . 0.0 112.437 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 60.7 tp -70.27 -34.98 73.45 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.613 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.512 ' HA ' HH22 ' A' ' 694' ' ' ARG . 71.0 mt -76.38 -37.91 56.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 39.7 m -65.66 -43.0 90.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.261 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.62 -41.12 93.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.465 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.503 ' CD ' ' CZ ' ' A' ' 694' ' ' ARG . 42.7 tt0 -78.37 -22.97 47.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.72 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -72.92 139.47 46.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.56 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.468 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -86.89 -30.27 21.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.63 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.49 124.25 0.69 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.767 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.521 HD13 ' HD2' ' A' ' 712' ' ' PRO . 62.6 mt -91.41 125.56 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.82 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.669 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.9 mp -107.2 147.91 29.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.535 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.1 m -166.89 -3.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.431 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 9.4 tptm -133.24 79.63 61.05 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.328 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.07 141.0 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.794 2.33 . . . . 0.0 112.087 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.3 OUTLIER -179.09 116.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.492 ' O ' ' O ' ' A' ' 729' ' ' LEU . 57.3 t0 56.42 121.2 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.721 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.2 -11.85 30.99 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.327 2.018 . . . . 0.0 112.205 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -71.42 -27.45 63.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.443 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 46.8 tp -66.13 -49.75 66.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.364 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.475 ' H ' HD12 ' A' ' 734' ' ' LEU . 4.7 mp -58.84 -42.9 90.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.955 0.407 . . . . 0.0 110.079 179.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.319 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 56.1 m -60.53 -39.66 88.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.637 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . 0.532 HG21 HD21 ' A' ' 706' ' ' LEU . 48.9 m -61.5 -44.18 97.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.7 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.489 ' CD2' HG21 ' A' ' 674' ' ' VAL . 39.8 mt -65.59 -37.35 86.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.122 0.486 . . . . 0.0 109.944 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.669 ' O ' ' N ' ' A' ' 741' ' ' LEU . 47.2 tt0 -64.55 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.4 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.96 -6.52 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.478 -0.649 . . . . 0.0 111.478 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.669 ' N ' ' O ' ' A' ' 739' ' ' GLN . 66.1 mt . . . . . 0 C--N 1.329 -0.313 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.543 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.607 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -90.52 128.92 36.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.436 HG23 ' O ' ' A' ' 674' ' ' VAL . 38.7 mt -118.35 142.9 30.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.753 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 1.023 HD21 ' HB1' ' A' ' 663' ' ' ALA . 23.6 tp -106.89 133.06 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.572 ' CD1' HG11 ' A' ' 643' ' ' VAL . 9.3 tt -130.41 120.22 23.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 657' ' ' LEU . 14.3 tp -107.28 119.25 38.87 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.64 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 87.7 tt0 -159.72 158.33 31.12 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.274 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.653 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.8 tt0 -109.02 133.43 53.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.776 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.653 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 75.3 tt0 105.47 113.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.653 0.596 . . . . 0.0 109.677 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.678 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.8 p30 -61.94 -33.49 74.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.38 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.678 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.6 mt-10 -65.77 -41.54 91.94 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.792 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.547 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -76.24 -46.04 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.168 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.4 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -62.39 -41.19 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.539 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 87.1 m -63.87 -43.27 96.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.306 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 638' ' ' GLU . 41.4 t -54.5 -52.76 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.154 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . 0.572 HG11 ' CD1' ' A' ' 632' ' ' LEU . 87.6 t -58.15 -41.82 81.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.523 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.459 ' HA ' HG11 ' A' ' 654' ' ' VAL . 73.0 m -59.91 -39.09 84.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.6 -36.92 84.29 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.098 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 67.9 mmm -68.69 -48.88 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.477 ' N ' HD12 ' A' ' 647' ' ' LEU . 9.5 mp -69.08 -43.31 74.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 32.1 m -55.58 -41.42 73.32 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.34 -29.68 69.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.28 -5.23 30.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -8.23 70.39 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -97.41 138.34 35.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 15.9 ttmm -92.1 133.11 36.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.947 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.459 HG11 ' HA ' ' A' ' 644' ' ' CYS . 7.1 p -125.6 141.38 45.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.964 0.411 . . . . 0.0 111.195 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . 0.489 HG22 ' CD2' ' A' ' 657' ' ' LEU . 59.6 mt -107.35 129.76 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.921 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.64 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 19.9 t90 -93.85 118.96 32.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.82 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.605 ' O ' HD12 ' A' ' 633' ' ' LEU . 2.7 mm? -109.12 143.22 38.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.665 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.69 ' O ' HG12 ' A' ' 658' ' ' VAL . 88.5 t -103.95 4.45 10.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.591 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 97.3 m-20 -145.77 121.27 10.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.06 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.427 ' CA ' HD12 ' A' ' 689' ' ' LEU . . . -57.06 -43.17 93.31 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.271 -0.731 . . . . 0.0 111.271 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 88.5 p -61.34 -40.25 93.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.718 0.294 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 34.0 m -64.1 -38.28 90.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.122 0.487 . . . . 0.0 110.184 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 1.023 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -63.75 -44.6 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.458 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.08 -44.72 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.9 0.381 . . . . 0.0 111.161 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -59.24 -41.04 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.568 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.571 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 97.9 mt-30 -86.73 -23.99 25.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.028 0.442 . . . . 0.0 109.99 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.566 ' N ' ' O ' ' A' ' 663' ' ' ALA . 2.8 tp -50.44 -45.67 56.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.32 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -62.59 -30.33 71.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.866 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 29.1 mt -73.88 -47.2 39.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.925 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.571 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.82 -17.75 42.88 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.488 -179.467 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 670' ' ' LEU . 12.9 mm-40 41.35 64.16 5.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.931 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -72.38 155.52 55.51 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 123.106 2.537 . . . . 0.0 112.79 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 95.9 mt -93.88 -22.18 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.194 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 630' ' ' ILE . 22.0 t -138.41 136.44 44.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.475 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.69 HG22 ' SD ' ' A' ' 677' ' ' MET . 75.6 mt -120.98 123.31 69.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.579 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.585 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.5 mp -106.9 128.52 54.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.449 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.69 ' SD ' HG22 ' A' ' 675' ' ' ILE . 1.7 mpp? -141.02 141.17 34.36 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.259 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.717 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -65.2 153.91 39.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.749 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.755 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 57.9 t-105 -99.56 -25.59 0.23 Allowed Pre-proline 0 C--N 1.328 -0.341 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.872 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 2.8 Cg_exo -70.29 149.18 63.11 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 121.893 1.729 . . . . 0.0 110.316 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.77 110.66 2.95 Favored 'Trans proline' 0 C--N 1.301 -1.938 0 C-N-CA 122.447 2.098 . . . . 0.0 112.444 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.583 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 62.0 Cg_endo -91.76 -33.14 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.899 2.4 . . . . 0.0 111.487 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.583 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 81.7 m-20 -157.01 -81.05 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 179.72 -25.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.768 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 22.7 t -64.18 -33.74 76.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -59.99 -33.81 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.79 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . 0.465 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 80.9 mt -66.76 -39.22 87.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.897 0.379 . . . . 0.0 110.554 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.777 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.96 -34.64 73.67 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.489 HD23 ' C ' ' A' ' 689' ' ' LEU . 9.7 tt -58.83 -41.66 87.4 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 49.9 tp -59.68 -43.06 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.092 179.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.02 -42.96 99.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.796 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -57.91 -48.05 81.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.384 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 91.8 mt -55.53 -37.77 68.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.969 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -63.19 -40.52 97.75 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.778 -0.369 . . . . 0.0 110.909 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.72 -33.61 74.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.68 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.713 179.898 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo . . . . . 0 N--CA 1.489 1.212 0 CA-C-O 120.537 0.141 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.07 150.39 42.93 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.457 2.105 . . . . 0.0 111.919 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 737' ' ' THR . 52.5 mt -78.15 138.72 38.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 29.4 t -115.99 129.33 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.095 0.474 . . . . 0.0 111.323 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.46 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.5 mp -117.07 136.63 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.659 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . 0.4 ' CE1' ' HE2' ' A' ' 677' ' ' MET . 94.8 m-85 -110.86 137.08 48.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.125 0.488 . . . . 0.0 111.77 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 56.6 mt -96.63 156.4 16.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.452 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -140.03 17.9 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.72 150.07 47.46 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.965 0.412 . . . . 0.0 110.983 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.76 146.08 33.26 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.966 2.444 . . . . 0.0 112.582 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -50.85 154.26 7.26 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.216 1.944 . . . . 0.0 111.178 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 54.2 t -77.7 -42.89 29.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.488 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -72.96 137.76 79.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.21 -13.48 18.94 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.391 2.061 . . . . 0.0 112.322 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.94 -36.53 75.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.802 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 80.1 mt -75.48 -34.23 60.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 91.6 m -63.79 -43.46 96.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.082 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.24 -37.35 86.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.603 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -73.26 -27.28 61.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.184 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.16 149.29 46.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.396 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 8.1 t -85.65 -31.15 22.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.235 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -172.28 160.52 5.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.476 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.4 HD13 HG21 ' A' ' 724' ' ' ILE . 54.3 mt -147.1 120.99 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.707 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.5 mt -112.94 129.52 56.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.804 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 14.8 m -68.12 -40.48 82.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.058 0.456 . . . . 0.0 109.947 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.81 145.23 27.08 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.011 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 129.57 30.16 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.243 1.962 . . . . 0.0 111.651 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.458 ' HG ' ' N ' ' A' ' 730' ' ' ASP . 34.8 tp -179.5 149.8 0.4 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.458 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 2.4 m-20 57.66 68.02 2.12 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.761 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.31 -15.7 8.73 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.923 2.415 . . . . 0.0 112.052 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -69.86 -33.35 72.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.257 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 25.4 tp -67.05 -42.36 84.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.965 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.447 ' CD1' HD22 ' A' ' 706' ' ' LEU . 43.1 tp -56.45 -43.97 80.03 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.037 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.46 -39.64 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.22 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.8 m -59.05 -40.41 85.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . 0.494 ' O ' ' CD1' ' A' ' 704' ' ' LEU . 73.4 m -63.35 -39.92 95.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.126 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.684 ' C ' HD23 ' A' ' 738' ' ' LEU . 7.3 tt -63.97 -47.78 79.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.357 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.578 ' C ' ' H ' ' A' ' 741' ' ' LEU . 2.8 pt20 -69.14 -22.34 63.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.91 0.15 0.06 OUTLIER Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 1.074 ' O ' HD12 ' A' ' 741' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 120.844 0.354 . . . . 0.0 110.486 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -90.25 133.21 35.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.971 0.415 . . . . 0.0 111.029 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 63.8 mt -118.29 141.96 35.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.914 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.574 HD21 ' HB1' ' A' ' 663' ' ' ALA . 1.2 tp -106.06 129.09 54.23 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.44 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.433 HD23 ' C ' ' A' ' 632' ' ' LEU . 9.6 tt -134.33 120.58 20.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.751 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.55 HD23 ' C ' ' A' ' 633' ' ' LEU . 8.3 tt -108.43 120.09 41.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.913 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.524 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 81.7 tt0 -159.78 161.21 34.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.535 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.601 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 93.9 mt-10 -113.55 155.73 24.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.19 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.601 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.4 tp10 91.65 113.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.889 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -58.15 -38.23 76.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.145 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.733 ' O ' HG23 ' A' ' 642' ' ' VAL . 76.3 mm-40 -66.88 -41.44 87.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.118 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 636' ' ' GLU . . . -76.23 -45.15 34.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.811 0.339 . . . . 0.0 110.948 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.9 -46.2 82.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.05 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 58.4 m -63.63 -44.46 93.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 638' ' ' GLU . 41.1 t -55.86 -52.88 44.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.802 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . 0.418 HG11 HD11 ' A' ' 632' ' ' LEU . 70.7 t -60.29 -44.42 95.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 645' ' ' GLU . 0.5 OUTLIER -62.55 -37.32 85.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.745 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . 0.486 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 84.2 tt0 -62.37 -39.46 93.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.688 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 43.0 tpp -67.92 -50.31 56.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.722 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 647' ' ' LEU . 7.9 mp -68.57 -44.74 73.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.551 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 62.5 m -56.26 -43.46 78.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.021 0.438 . . . . 0.0 109.975 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.36 -23.74 63.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.54 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.25 -3.07 21.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.53 -9.81 69.04 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -95.31 138.55 32.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 110.604 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.27 129.74 38.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.134 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 9.5 p -129.12 138.7 53.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 3.1 mp -106.37 131.36 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.921 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.67 ' C ' HD22 ' A' ' 657' ' ' LEU . 16.0 t90 -90.56 122.22 33.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.11 -178.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.67 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.5 mm? -111.06 140.31 45.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.712 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.57 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 1.5 t -109.35 5.71 9.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.319 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.57 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 62.9 m-20 -147.34 137.72 23.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.357 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.447 ' O ' HD23 ' A' ' 689' ' ' LEU . . . -65.17 -46.7 86.92 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 -179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 21.4 m -60.05 -38.37 82.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 110.956 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 46.4 m -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.502 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.574 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.017 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.585 HD21 HD21 ' A' ' 689' ' ' LEU . 39.1 mt -59.05 -40.33 84.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.901 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . 0.582 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 86.3 m-20 -62.37 -42.33 99.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.161 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.569 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 88.4 mt-30 -87.84 -36.23 17.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.931 0.396 . . . . 0.0 110.92 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.494 HD11 HD11 ' A' ' 675' ' ' ILE . 0.8 OUTLIER -48.54 -44.44 36.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.995 -179.614 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.582 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 50.7 p-10 -63.71 -32.02 73.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.383 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.546 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 81.4 mt -72.39 -46.71 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.91 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.569 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.87 -15.76 50.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.798 -179.121 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.465 ' HA ' HE21 ' A' ' 671' ' ' GLN . 3.5 mm-40 40.72 61.1 7.21 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.1 0.476 . . . . 0.0 110.111 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.06 151.76 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.352 2.701 . . . . 0.0 112.447 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.586 HG13 HG23 ' A' ' 674' ' ' VAL . 7.0 pt -95.94 -11.54 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.586 HG23 HG13 ' A' ' 673' ' ' ILE . 63.6 t -138.68 135.2 43.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.458 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.494 HD11 HD11 ' A' ' 667' ' ' LEU . 67.0 mt -127.85 124.16 62.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.809 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.5 mp -102.74 138.03 40.18 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 74.1 mtp -139.27 134.38 32.56 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.086 -0.646 . . . . 0.0 111.623 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.52 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -67.71 150.84 48.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.594 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.75 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 25.2 t-105 -115.03 -21.03 0.11 Allowed Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 66.2 Cg_exo -47.74 158.67 0.7 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.859 1.706 . . . . 0.0 112.104 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.641 ' C ' ' H ' ' A' ' 683' ' ' ASP . 2.5 Cg_endo -50.2 -54.85 4.77 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.894 2.396 . . . . 0.0 113.402 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 2.1 Cg_endo -49.17 0.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.059 1.839 . . . . 0.0 111.945 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.641 ' H ' ' C ' ' A' ' 681' ' ' PRO . 84.8 m-20 -82.48 45.5 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.822 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -58.65 -38.45 78.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.103 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . 0.4 ' O ' ' HG ' ' A' ' 688' ' ' LEU . 59.8 p -67.35 -30.09 69.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.104 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.06 -25.13 67.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.149 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 77.2 mt -66.19 -39.66 89.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.752 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.697 ' C ' HD12 ' A' ' 688' ' ' LEU . 1.2 pp -72.75 -43.26 63.13 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.717 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.792 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.5 OUTLIER -61.49 -41.23 96.96 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 690' ' ' LEU . 8.9 tt -59.61 -42.16 92.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.601 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.51 -40.54 94.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.227 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.664 ' NE2' ' NE2' ' A' ' 696' ' ' HIS . 5.8 t60 -57.83 -47.51 82.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.263 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 693' ' ' LEU . 44.8 mt -54.68 -39.81 68.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -63.34 -34.13 77.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.142 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.2 -31.46 71.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.664 ' NE2' ' NE2' ' A' ' 692' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.157 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo . . . . . 0 N--CA 1.491 1.328 0 CA-C-O 120.747 0.228 . . . . 0.0 111.869 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.73 152.62 34.01 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.664 2.243 . . . . 0.0 112.197 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.423 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 29.2 mt -76.87 139.09 40.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.286 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 722' ' ' SER . 16.9 t -122.94 130.98 74.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.12 0.486 . . . . 0.0 111.554 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.6 mp -119.23 138.96 52.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.996 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . 0.544 ' CE2' HD21 ' A' ' 717' ' ' LEU . 35.8 m-85 -108.93 126.8 53.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.918 0.39 . . . . 0.0 110.89 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.9 mt -97.46 145.91 25.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.308 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 97.77 -127.64 9.29 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.825 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . 0.52 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.1 OUTLIER -87.15 153.99 54.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.993 0.425 . . . . 0.0 111.245 -178.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.02 161.99 24.18 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.916 2.411 . . . . 0.0 112.425 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.673 ' HB3' HD23 ' A' ' 717' ' ' LEU . 26.5 Cg_endo -62.85 151.03 86.38 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 123.39 2.727 . . . . 0.0 112.683 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.544 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.7 t -86.91 16.15 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.381 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.5 OUTLIER -161.81 143.24 8.41 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.0 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.41 -20.43 31.8 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.643 2.228 . . . . 0.0 111.881 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 716' ' ' LEU . 84.8 mt -70.06 -34.08 72.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.673 HD23 ' HB3' ' A' ' 712' ' ' PRO . 59.6 tp -75.5 -35.18 60.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.692 179.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . 0.409 ' OG1' ' HG2' ' A' ' 712' ' ' PRO . 57.3 m -62.6 -41.55 99.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.9 92.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.094 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -75.11 -28.54 60.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.14 144.58 51.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.598 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.612 ' N ' ' O ' ' A' ' 705' ' ' VAL . 32.7 t -86.16 -27.28 24.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.443 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 122.88 0.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.837 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 28.8 mm -89.55 122.83 41.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.53 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 5.0 mp -109.05 146.21 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.971 0.415 . . . . 0.0 110.796 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.6 p -167.93 -22.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.954 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.67 81.03 64.95 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.665 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -46.22 122.53 5.56 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.751 2.301 . . . . 0.0 112.453 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 24.2 tp 179.2 141.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.57 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 60.94 68.75 1.2 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.915 0.388 . . . . 0.0 110.718 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -51.91 -1.32 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.955 2.436 . . . . 0.0 112.027 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 730' ' ' ASP . 1.4 pt20 -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.866 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.91 -45.84 84.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.085 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.0 tp -57.98 -48.0 81.3 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.42 -41.86 93.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 64.6 m -59.83 -40.51 88.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.621 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 41.7 m -61.08 -45.77 93.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.9 -41.73 86.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.091 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.43 ' C ' ' H ' ' A' ' 741' ' ' LEU . 72.4 tp60 -64.53 -35.92 82.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.317 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.76 -11.35 1.98 Allowed Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 739' ' ' GLN . 24.3 tp . . . . . 0 C--N 1.328 -0.332 0 CA-C-O 120.88 0.372 . . . . 0.0 110.32 179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.658 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -92.94 134.31 35.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.707 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.665 ' HB ' HG12 ' A' ' 654' ' ' VAL . 2.4 mp -115.42 139.8 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.297 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 1.015 ' C ' HD13 ' A' ' 632' ' ' LEU . 8.4 tt -112.51 129.59 56.29 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.621 -0.431 . . . . 0.0 110.596 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 1.03 HD22 ' H ' ' A' ' 632' ' ' LEU . 0.0 OUTLIER -130.99 122.29 26.58 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.732 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.768 HD22 ' SG ' ' A' ' 686' ' ' CYS . 7.0 tt -108.32 125.28 51.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.963 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.698 ' OE2' HD12 ' A' ' 708' ' ' LEU . 94.0 mt-10 -158.4 170.24 22.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.069 0.461 . . . . 0.0 110.909 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.561 ' OE2' ' O ' ' A' ' 682' ' ' PRO . 95.8 mt-10 -114.76 162.11 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.987 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 69.59 123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.34 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.489 ' O ' ' OG1' ' A' ' 641' ' ' THR . 90.9 m-20 -58.83 -34.4 71.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.185 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.484 ' O ' HG23 ' A' ' 642' ' ' VAL . 44.1 tp10 -63.64 -42.05 98.17 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.064 -179.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.46 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.812 0.339 . . . . 0.0 110.888 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.434 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -65.87 -39.68 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.049 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 54.3 m -62.84 -45.07 94.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.064 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 638' ' ' GLU . 52.8 t -56.7 -52.56 52.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.896 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 57.4 t -60.22 -46.28 94.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.541 ' O ' ' OG1' ' A' ' 648' ' ' THR . 96.1 m -66.99 -36.8 82.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -61.67 -38.28 87.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.477 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.3 mtt -68.36 -50.61 51.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.29 -43.63 77.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.625 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.541 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 41.1 m -56.17 -41.55 75.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.34 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.1 73.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.74 -1.81 17.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.542 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 82.4 10.63 83.26 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -91.43 140.39 29.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -93.52 120.32 33.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.665 HG12 ' HB ' ' A' ' 630' ' ' ILE . 5.7 m -129.0 150.42 34.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.941 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . 0.674 ' O ' HD22 ' A' ' 632' ' ' LEU . 24.1 mm -111.8 127.12 69.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.888 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.618 ' C ' HD22 ' A' ' 657' ' ' LEU . 32.6 t90 -93.76 118.54 31.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.997 0.427 . . . . 0.0 111.285 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 656' ' ' TRP . 4.0 mm? -115.59 144.51 43.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.456 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.542 ' O ' HG22 ' A' ' 658' ' ' VAL . 9.7 p -113.8 12.08 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -147.49 123.6 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.414 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -61.11 -43.89 98.85 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 17.6 t -59.69 -48.68 80.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 110.931 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.9 m -64.27 -38.02 89.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.38 98.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.946 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 87.1 mt -58.57 -43.4 89.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.712 0.292 . . . . 0.0 111.09 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.8 -40.89 96.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.056 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -86.29 -41.99 14.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.928 HD12 HD13 ' A' ' 631' ' ' LEU . 9.3 tt -47.68 -38.14 14.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.423 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 62.6 t0 -56.54 -37.09 70.02 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 60.8 mt -77.71 -30.31 51.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.605 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.985 HD12 HD12 ' A' ' 631' ' ' LEU . 16.2 mt -72.04 -36.16 69.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.558 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.464 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 32.7 mm-40 46.68 62.4 11.66 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -178.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 66.3 Cg_endo -81.67 156.03 18.42 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 123.37 2.713 . . . . 0.0 112.957 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.616 ' CG2' HD12 ' A' ' 741' ' ' LEU . 81.0 mt -96.54 -23.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.681 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 48.7 t -138.65 139.11 41.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.903 0.383 . . . . 0.0 110.75 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.549 ' C ' HD12 ' A' ' 676' ' ' LEU . 72.0 mt -128.6 123.44 59.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.588 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 676' ' ' LEU . 7.9 mp -105.67 131.98 52.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.535 ' SD ' HD22 ' A' ' 689' ' ' LEU . 69.2 mtm -138.06 138.68 39.02 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.527 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.538 ' C ' ' OD2' ' A' ' 683' ' ' ASP . . . -65.91 151.1 47.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.64 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.736 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 74.5 t-105 -113.43 -21.99 0.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.265 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 92.1 Cg_exo -44.48 159.93 0.11 Allowed 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.698 1.599 . . . . 0.0 111.388 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.585 ' C ' ' H ' ' A' ' 683' ' ' ASP . 13.9 Cg_exo -52.24 -45.61 38.17 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.099 1.866 . . . . 0.0 112.677 -178.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.561 ' O ' ' OE2' ' A' ' 635' ' ' GLU . 31.3 Cg_exo -49.3 -8.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 121.734 1.622 . . . . 0.0 110.626 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.585 ' H ' ' C ' ' A' ' 681' ' ' PRO . 74.7 m-20 -83.42 24.67 0.81 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.831 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.35 -40.84 65.24 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.359 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 93.0 p -69.14 -35.41 76.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.458 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.768 ' SG ' HD22 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -62.35 -19.11 63.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.008 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.14 -32.99 74.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.772 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.701 ' C ' HD12 ' A' ' 688' ' ' LEU . 1.6 pp -70.09 -44.1 69.73 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.725 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.584 ' N ' HD12 ' A' ' 688' ' ' LEU . 8.0 tt -60.68 -41.4 95.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 61.1 tp -60.39 -36.1 77.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.156 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -59.98 -45.03 94.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.834 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -57.66 -50.6 72.63 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.448 -0.501 . . . . 0.0 109.949 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.8 mt -56.17 -34.92 66.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.379 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -60.57 -40.79 92.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.5 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.28 -31.86 70.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.985 0.421 . . . . 0.0 110.172 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.519 179.782 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_exo . . . . . 0 N--CA 1.49 1.275 0 CA-C-O 121.023 0.343 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.92 158.77 36.72 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 123.069 2.512 . . . . 0.0 112.466 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.503 ' H ' HD12 ' A' ' 704' ' ' LEU . 3.6 mp -77.12 149.67 35.66 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.493 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 35.7 t -114.86 129.22 71.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.352 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.834 ' HG ' ' HB3' ' A' ' 723' ' ' ALA . 5.7 mp -121.7 136.49 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.124 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -111.61 127.88 55.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.398 . . . . 0.0 111.186 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.698 HD12 ' OE2' ' A' ' 634' ' ' GLU . 72.7 mt -97.16 148.38 23.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.496 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 106.88 -132.36 11.1 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -89.88 175.18 4.03 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.382 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -82.53 135.71 8.23 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.742 2.295 . . . . 0.0 112.414 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.75 ' HB3' HD23 ' A' ' 717' ' ' LEU . 37.6 Cg_exo -51.31 150.81 14.17 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.114 1.876 . . . . 0.0 111.59 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.82 -39.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.687 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 132.14 81.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.497 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -72.19 -28.39 15.62 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.267 1.978 . . . . 0.0 111.818 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 72.1 mt -72.05 -28.84 63.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.573 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.75 HD23 ' HB3' ' A' ' 712' ' ' PRO . 40.4 tp -75.19 -42.82 54.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.858 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . 0.601 HG23 HD12 ' A' ' 724' ' ' ILE . 57.3 m -64.6 -45.32 87.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.047 178.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.66 84.2 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.515 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 67.4 tp60 -77.73 -17.46 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.455 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.97 147.71 48.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.425 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 62.9 p -83.19 -25.08 32.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.135 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.834 ' HB3' ' HG ' ' A' ' 706' ' ' LEU . . . -171.8 157.98 4.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.563 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.601 HD12 HG23 ' A' ' 718' ' ' THR . 70.1 mt -148.65 123.33 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.395 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.45 HD11 HD13 ' A' ' 734' ' ' LEU . 46.7 mt -102.59 147.85 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.44 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.4 p -167.59 -16.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.724 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -132.07 78.26 69.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.613 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -54.03 147.81 41.72 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.636 2.224 . . . . 0.0 111.74 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 6.2 tp -178.11 -38.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.159 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.65 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 -142.98 82.29 12.16 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.15 0.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.856 2.371 . . . . 0.0 111.669 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.65 ' H ' ' C ' ' A' ' 730' ' ' ASP . 90.5 mt-30 -69.56 -29.98 67.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.666 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.48 78.07 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.45 HD13 HD11 ' A' ' 725' ' ' LEU . 13.5 tp -57.85 -46.41 84.85 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 88.4 mt -63.98 -40.48 96.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.002 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . 0.501 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 28.6 m -59.6 -39.2 83.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 27.4 m -62.31 -47.63 83.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.016 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.462 ' C ' HD23 ' A' ' 738' ' ' LEU . 8.8 tt -66.18 -41.01 90.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.859 0.362 . . . . 0.0 110.573 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -64.0 -28.08 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.101 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.59 -44.84 12.09 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.616 HD12 ' CG2' ' A' ' 673' ' ' ILE . 58.9 mt . . . . . 0 C--N 1.329 -0.296 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.222 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.648 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -93.57 134.39 35.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.875 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.411 ' CG2' ' CD1' ' A' ' 676' ' ' LEU . 67.1 mt -118.38 138.82 47.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.12 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.871 HD13 ' C ' ' A' ' 631' ' ' LEU . 3.2 tm? -110.06 124.05 50.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.64 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.713 ' N ' HD13 ' A' ' 631' ' ' LEU . 20.3 tp -113.26 122.1 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.726 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.458 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 17.6 tp -108.67 117.97 35.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.458 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 94.4 mt-10 -158.76 172.2 18.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.531 -178.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 636' ' ' GLU . 48.8 tp10 -106.82 152.44 23.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.127 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 635' ' ' GLU . 83.5 tt0 69.29 127.11 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.018 0.437 . . . . 0.0 110.543 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.689 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.4 p30 -66.25 -33.66 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.489 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.852 ' O ' HG23 ' A' ' 642' ' ' VAL . 96.7 mt-10 -66.18 -42.24 89.17 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.82 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.63 -45.42 62.1 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.864 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.437 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -64.96 -40.91 95.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.917 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.557 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 32.3 m -62.58 -43.72 98.12 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.631 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 638' ' ' GLU . 84.0 t -53.78 -49.23 59.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.872 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.8 t -58.82 -42.85 86.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.009 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.497 ' O ' ' OG1' ' A' ' 648' ' ' THR . 99.2 m -64.9 -36.61 84.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.369 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -62.06 -38.42 88.73 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.957 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . 0.402 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 64.7 mtt -68.58 -47.89 65.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.32 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.591 ' CD2' ' N ' ' A' ' 647' ' ' LEU . 1.6 mm? -69.48 -43.99 72.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.119 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.8 m -56.09 -40.51 73.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.867 179.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.8 72.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.555 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.95 -4.76 37.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.14 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.76 -0.36 60.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . 0.41 ' HB3' HD12 ' A' ' 630' ' ' ILE . 88.5 m-85 -93.57 141.7 28.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 0.0 110.648 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -91.83 122.06 34.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.96 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.545 HG21 ' HB2' ' A' ' 647' ' ' LEU . 23.1 t -120.11 135.48 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.183 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . 0.582 HD12 HD22 ' A' ' 670' ' ' LEU . 63.4 mt -110.67 131.69 61.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.138 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.59 ' O ' HD22 ' A' ' 657' ' ' LEU . 13.8 t90 -95.15 120.17 34.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.381 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 656' ' ' TRP . 3.3 mm? -116.16 135.13 54.2 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.483 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.58 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 0.2 OUTLIER -100.41 2.54 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.295 179.629 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.58 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 80.1 m-20 -146.69 162.12 39.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.107 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.401 ' H ' ' HB3' ' A' ' 685' ' ' SER . . . -87.28 -48.75 4.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.768 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 t -57.57 -41.25 80.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.741 0.305 . . . . 0.0 111.054 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 50.6 m -62.84 -37.13 85.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.192 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.49 -40.09 96.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.818 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 39.0 mt -60.01 -43.14 95.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.016 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -63.08 -39.26 94.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -88.43 -49.92 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.391 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.4 tt -46.28 -42.67 14.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.332 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.55 -33.38 73.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.758 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 66.6 mt -74.23 -45.06 50.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.731 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.582 HD22 HD12 ' A' ' 655' ' ' ILE . 1.0 OUTLIER -83.19 -18.01 40.81 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 670' ' ' LEU . 76.9 mm-40 40.87 78.49 0.37 Allowed Pre-proline 0 C--N 1.33 -0.278 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.105 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.44 153.36 39.67 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 122.858 2.372 . . . . 0.0 112.774 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 78.4 mt -93.14 -19.11 6.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 121.049 0.452 . . . . 0.0 110.001 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 45.1 t -139.46 135.16 40.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.787 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.465 HG22 ' HG3' ' A' ' 677' ' ' MET . 77.8 mt -123.85 121.26 61.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.968 0.413 . . . . 0.0 111.492 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.411 ' CD1' ' CG2' ' A' ' 630' ' ' ILE . 4.1 mp -105.39 127.52 53.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.633 ' SD ' HD22 ' A' ' 689' ' ' LEU . 69.0 mtm -140.42 133.95 30.09 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.904 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.416 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -67.99 152.62 45.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.286 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.738 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 24.6 t-105 -110.59 -28.27 0.14 Allowed Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.282 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.738 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.4 Cg_endo -98.16 26.1 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 123.241 2.627 . . . . 0.0 115.42 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 71.3 Cg_endo -79.97 154.49 22.74 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.439 1.426 . . . . 0.0 112.116 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -64.26 -35.08 53.45 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.826 2.351 . . . . 0.0 112.243 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.585 ' C ' ' H ' ' A' ' 685' ' ' SER . 65.8 t0 -87.13 112.25 21.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.039 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -64.15 12.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.862 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . 0.585 ' H ' ' C ' ' A' ' 683' ' ' ASP . 55.9 m -60.05 -29.82 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.801 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.506 ' SG ' ' HG3' ' A' ' 681' ' ' PRO . 19.4 m -59.5 -38.28 80.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.64 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 687' ' ' LEU . 62.3 mt -67.47 -34.97 78.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.857 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.72 -42.12 82.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.886 0.374 . . . . 0.0 110.351 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.771 ' O ' HD23 ' A' ' 689' ' ' LEU . 7.2 tt -60.57 -39.53 88.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.155 0.502 . . . . 0.0 109.875 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.631 HD11 HD22 ' A' ' 717' ' ' LEU . 9.0 tt -59.84 -41.54 91.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.648 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.58 -40.49 91.9 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.501 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -57.18 -46.03 83.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.311 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.55 -49.78 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.848 HH11 HE22 ' A' ' 720' ' ' GLN . 54.0 ttt85 -69.05 -27.34 65.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.582 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . 0.661 ' O ' ' CD2' ' A' ' 696' ' ' HIS . 31.1 tp10 -62.93 -34.56 77.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.814 -178.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.661 ' CD2' ' O ' ' A' ' 695' ' ' GLU . 6.8 p80 . . . . . 0 N--CA 1.472 0.661 0 O-C-N 123.246 0.341 . . . . 0.0 111.876 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.491 1.369 0 CA-C-O 120.982 0.326 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -41.31 168.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 123.263 2.642 . . . . 0.0 112.633 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.727 ' N ' HD12 ' A' ' 704' ' ' LEU . 5.6 mp -76.93 142.76 39.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.064 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.3 t -126.61 135.25 64.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.207 0.527 . . . . 0.0 111.656 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.769 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 50.8 mt -110.33 132.94 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.304 178.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.12 126.68 55.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.924 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.744 ' CD2' HD12 ' A' ' 725' ' ' LEU . 49.2 mt -95.7 150.68 20.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.536 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 94.58 -134.88 12.19 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.71 156.77 44.69 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.951 0.405 . . . . 0.0 111.053 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.57 148.47 26.13 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 123.045 2.497 . . . . 0.0 112.326 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.592 ' HD2' HD13 ' A' ' 724' ' ' ILE . 28.9 Cg_endo -65.35 151.12 86.15 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 122.604 2.203 . . . . 0.0 111.458 179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 43.0 t -77.94 -42.88 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.942 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -72.99 140.65 80.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -75.96 -12.21 19.69 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.622 2.214 . . . . 0.0 112.61 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.765 HD21 ' NH1' ' A' ' 694' ' ' ARG . 38.6 tp -69.5 -35.87 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.926 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.631 HD22 HD11 ' A' ' 690' ' ' LEU . 66.8 mt -75.21 -34.49 61.49 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 27.1 m -63.66 -42.05 98.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.093 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.16 -39.22 93.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.094 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.848 HE22 HH11 ' A' ' 694' ' ' ARG . 93.1 mt-30 -77.58 -19.96 54.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.175 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -74.46 132.94 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.868 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.4 p -85.73 -27.04 25.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.834 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.769 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -172.72 112.62 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.917 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.592 HD13 ' HD2' ' A' ' 712' ' ' PRO . 64.6 mt -91.1 133.51 32.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.346 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.744 HD12 ' CD2' ' A' ' 708' ' ' LEU . 35.5 mt -106.93 147.04 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.974 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 725' ' ' LEU . 2.9 m -168.78 5.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.379 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -134.56 78.87 55.25 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.474 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.28 137.7 76.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.917 1.744 . . . . 0.0 112.198 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' A' ' 730' ' ' ASP . 30.6 tp -179.23 112.87 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.541 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 732' ' ' GLN . 5.5 m-20 51.32 100.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.2 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . 0.402 ' HB3' ' SD ' ' A' ' 646' ' ' MET . 76.8 Cg_exo -46.51 -7.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.53 0 C-N-CA 122.692 2.261 . . . . 0.0 112.257 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 730' ' ' ASP . 92.1 mt-30 -71.75 -28.28 63.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.002 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 35.6 tp -66.7 -44.58 81.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.781 ' C ' HD23 ' A' ' 734' ' ' LEU . 7.0 tt -57.78 -47.06 83.61 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.256 0.551 . . . . 0.0 109.591 178.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.94 -37.84 88.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.569 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.2 m -58.06 -39.34 78.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.487 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.0 m -59.97 -41.94 93.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.587 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.42 -35.22 80.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.232 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.462 ' C ' ' N ' ' A' ' 741' ' ' LEU . 47.8 tt0 -62.1 -34.43 76.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.52 -13.01 0.22 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.462 ' N ' ' C ' ' A' ' 739' ' ' GLN . 14.1 tp . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.58 0.229 . . . . 0.0 110.487 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.639 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.1 m80 -89.74 133.51 34.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.595 ' C ' HD22 ' A' ' 631' ' ' LEU . 67.5 mt -113.99 135.78 52.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.627 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.595 HD22 ' C ' ' A' ' 630' ' ' ILE . 2.4 mm? -110.53 137.25 48.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.629 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 17.6 tp -126.58 125.81 42.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.582 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.752 HD23 ' SG ' ' A' ' 686' ' ' CYS . 24.8 tp -110.81 115.53 29.69 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.617 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 85.7 tt0 -159.59 161.2 35.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.804 -179.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 92.5 mt-10 -112.99 158.84 19.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 74.23 119.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.208 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.555 ' O ' ' OG1' ' A' ' 641' ' ' THR . 93.3 m-20 -57.5 -36.72 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.422 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.781 ' O ' HG23 ' A' ' 642' ' ' VAL . 84.0 tt0 -63.69 -43.62 96.08 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.677 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.589 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -77.46 -45.42 25.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.517 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.5 -43.18 90.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.959 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.555 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 61.3 m -63.85 -42.91 97.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.215 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 638' ' ' GLU . 51.2 t -55.59 -53.27 38.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.034 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.94 -42.57 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.431 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.545 ' SG ' HG13 ' A' ' 654' ' ' VAL . 3.3 t -60.93 -41.77 96.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.579 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.02 -38.44 88.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.621 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . 0.483 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 61.2 ttp -70.09 -52.1 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 83.6 mt -64.73 -44.9 88.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.039 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.1 m -56.66 -40.99 76.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.075 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.06 -29.41 70.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.935 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -65.27 -5.22 6.59 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.892 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.61 -8.12 71.29 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -95.41 147.93 23.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.666 0.269 . . . . 0.0 110.424 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -91.71 129.63 37.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.991 0.424 . . . . 0.0 110.604 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.545 HG13 ' SG ' ' A' ' 644' ' ' CYS . 11.3 p -127.91 140.19 49.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.404 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 66.5 mt -108.65 133.4 53.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.129 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.618 ' C ' HD22 ' A' ' 657' ' ' LEU . 18.2 t90 -91.82 126.01 36.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.947 0.403 . . . . 0.0 110.835 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.1 mm? -112.24 145.62 39.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.463 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.553 HG12 ' CZ2' ' A' ' 656' ' ' TRP . 19.2 m -106.74 -3.97 10.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.753 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -151.59 132.36 14.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.693 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.25 -40.74 97.76 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . 0.421 ' N ' ' OG ' ' A' ' 685' ' ' SER . 81.5 p -62.08 -39.96 94.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 54.8 m -64.44 -37.65 88.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.089 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.605 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -61.96 -41.09 97.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.327 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.678 HD21 ' HG ' ' A' ' 689' ' ' LEU . 86.0 mt -59.43 -41.62 89.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -63.25 -43.04 99.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.324 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -89.89 -52.15 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.175 0.512 . . . . 0.0 111.197 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.605 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.9 tt -48.24 -33.83 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.056 -178.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.62 ' OD1' ' N ' ' A' ' 669' ' ' LEU . 46.4 p-10 -57.88 -38.77 76.37 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.34 -0.544 . . . . 0.0 110.46 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.62 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 63.3 mt -79.75 -24.46 41.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.967 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 631' ' ' LEU . 23.4 mt -71.9 -38.66 69.92 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.858 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.429 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 74.6 mm-40 48.9 62.67 11.78 Favored Pre-proline 0 C--N 1.329 -0.326 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.429 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 60.6 Cg_endo -79.52 159.62 25.52 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 123.36 2.707 . . . . 0.0 112.485 -179.22 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 73.5 mt -94.9 -23.27 5.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.52 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 51.7 t -138.8 133.52 41.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.162 0.506 . . . . 0.0 110.7 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 77.3 mt -128.2 121.22 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.958 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.446 HD12 ' N ' ' A' ' 676' ' ' LEU . 4.9 mp -105.29 128.92 53.7 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.832 ' SD ' HD13 ' A' ' 689' ' ' LEU . 70.5 mtm -142.02 142.8 32.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.552 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.621 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -65.78 152.57 44.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.883 178.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.752 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 72.5 t-105 -106.07 -23.79 0.19 Allowed Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.357 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.752 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.3 Cg_endo -100.32 29.29 0.12 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 123.219 2.613 . . . . 0.0 114.6 178.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.546 ' CD ' ' C ' ' A' ' 679' ' ' TRP . 63.4 Cg_endo -77.22 143.88 22.83 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.513 1.475 . . . . 0.0 111.903 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -66.97 -20.69 50.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.486 2.124 . . . . 0.0 112.12 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.404 ' C ' ' H ' ' A' ' 685' ' ' SER . 84.9 m-20 -87.27 117.38 25.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.109 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -65.65 -1.42 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.299 179.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . 0.421 ' OG ' ' N ' ' A' ' 661' ' ' SER . 23.7 t -59.85 -34.44 73.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.437 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.752 ' SG ' HD23 ' A' ' 633' ' ' LEU . 0.6 OUTLIER -59.96 -41.89 92.9 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.168 0.509 . . . . 0.0 109.782 179.511 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.37 -32.72 74.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.675 179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 84.0 mt -67.82 -37.39 81.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.015 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.832 HD13 ' SD ' ' A' ' 677' ' ' MET . 8.0 tt -57.92 -45.33 86.72 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -62.04 -39.72 93.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.878 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -62.98 -46.07 89.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.252 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -55.84 -55.03 37.32 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.33 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 51.1 mt -55.8 -38.81 70.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.776 179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 694' ' ' ARG . 39.9 ttm180 -62.62 -35.75 80.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.275 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -65.68 -35.76 81.71 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.123 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.406 ' H ' ' CD2' ' A' ' 696' ' ' HIS . 0.7 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.037 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo . . . . . 0 N--CA 1.489 1.259 0 CA-C-O 120.697 0.207 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.47 162.63 17.03 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.953 2.436 . . . . 0.0 112.087 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 61.4 mt -77.41 133.9 38.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.324 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.469 ' O ' ' N ' ' A' ' 722' ' ' SER . 52.8 t -125.47 132.51 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.956 0.408 . . . . 0.0 111.428 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.519 HD22 HD11 ' A' ' 734' ' ' LEU . 5.2 mp -116.92 134.28 54.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.188 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -110.99 127.47 55.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.93 0.395 . . . . 0.0 110.984 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . 0.82 ' N ' HD12 ' A' ' 708' ' ' LEU . 4.5 mp -96.74 145.54 25.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.522 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 105.3 -129.37 9.78 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.62 164.09 27.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.831 0.348 . . . . 0.0 110.507 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -72.93 160.83 45.1 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.865 2.377 . . . . 0.0 112.444 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.505 ' CD ' HD13 ' A' ' 724' ' ' ILE . 18.4 Cg_endo -62.7 156.11 55.09 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 123.019 2.48 . . . . 0.0 112.28 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.603 HG12 ' O ' ' A' ' 713' ' ' VAL . 22.0 t -83.42 10.3 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -161.76 140.43 7.19 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.324 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.07 -9.53 23.74 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.766 2.311 . . . . 0.0 112.753 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.7 tp -68.5 -35.2 77.17 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.351 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.582 ' O ' ' N ' ' A' ' 721' ' ' ALA . 81.7 mt -76.06 -31.85 59.0 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 97.4 m -61.82 -43.21 99.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.853 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.99 -40.86 95.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -74.74 -31.66 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.604 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -72.62 142.45 48.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 705' ' ' VAL . 65.2 p -85.36 -23.73 27.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.278 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.05 163.3 4.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.436 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.505 HD13 ' CD ' ' A' ' 712' ' ' PRO . 72.4 mt -143.09 124.35 11.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.691 ' N ' HD12 ' A' ' 725' ' ' LEU . 5.7 mp -104.51 153.6 20.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.615 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.43 18.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.433 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -139.3 88.47 12.9 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.447 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.658 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.3 Cg_exo -48.49 144.73 13.26 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.52 2.146 . . . . 0.0 111.894 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.658 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 13.5 tp 103.46 156.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.685 0.616 . . . . 0.0 110.246 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.474 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 1.4 t70 61.74 63.48 2.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.952 0.406 . . . . 0.0 111.062 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . 0.494 ' O ' HD23 ' A' ' 735' ' ' LEU . 33.4 Cg_endo -67.11 -4.59 11.86 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.961 2.441 . . . . 0.0 111.817 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -69.24 -29.29 67.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.908 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.1 -44.68 88.04 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.681 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.519 HD11 HD22 ' A' ' 706' ' ' LEU . 42.1 tp -59.43 -42.16 91.21 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.94 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . 0.494 HD23 ' O ' ' A' ' 731' ' ' PRO . 2.7 mm? -62.34 -41.05 98.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.192 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 36.1 m -59.23 -38.84 80.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.084 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.1 m -61.8 -43.03 99.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.796 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.94 -40.96 97.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.983 0.421 . . . . 0.0 110.129 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -64.99 -24.93 67.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.171 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.8 -20.36 0.42 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.55 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.402 ' N ' HD12 ' A' ' 741' ' ' LEU . 5.8 mp . . . . . 0 C--N 1.329 -0.296 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.418 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.649 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . 0.52 ' CE1' ' HB3' ' A' ' 670' ' ' LEU . 13.9 p80 -84.53 164.43 18.76 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.723 ' HB ' HG22 ' A' ' 654' ' ' VAL . 64.1 mt -113.79 141.01 31.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.976 0.417 . . . . 0.0 111.522 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.666 HD23 HG23 ' A' ' 675' ' ' ILE . 9.9 tp -107.32 135.31 49.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.086 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 33.2 tp -133.93 118.98 18.52 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.227 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.461 HD23 ' C ' ' A' ' 633' ' ' LEU . 8.2 tt -112.07 117.44 32.66 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.511 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.1 tt0 -159.78 162.97 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.045 -179.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.511 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 95.3 mt-10 -97.35 167.9 10.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.897 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 61.55 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 110.038 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.433 ' O ' ' OG1' ' A' ' 641' ' ' THR . 52.5 t0 -57.93 -36.95 73.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.919 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.503 ' O ' HG23 ' A' ' 642' ' ' VAL . 54.7 mp0 -65.16 -43.78 90.64 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.737 -178.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.65 -44.17 62.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.618 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.09 93.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.078 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 50.9 m -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.711 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 638' ' ' GLU . 55.8 t -55.58 -51.91 53.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.142 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.6 t -60.68 -46.67 95.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.514 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.55 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.5 OUTLIER -66.42 -33.93 76.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.672 -179.905 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . 0.462 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 85.2 tt0 -60.37 -39.53 87.58 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.319 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 7.3 tpp -65.0 -50.59 65.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.103 0.478 . . . . 0.0 109.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.693 ' HB2' HG21 ' A' ' 654' ' ' VAL . 85.0 mt -67.36 -45.25 76.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.204 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 28.5 m -56.13 -43.52 78.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.622 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 651' ' ' GLY . . . -69.66 -23.91 63.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -63.92 2.93 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.979 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 649' ' ' ALA . . . 97.12 -15.63 62.14 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . 0.406 ' O ' ' HA ' ' A' ' 648' ' ' THR . 96.7 m-85 -93.79 152.01 19.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -93.3 125.42 37.89 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.319 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.723 HG22 ' HB ' ' A' ' 630' ' ' ILE . 22.9 t -117.83 134.79 60.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.697 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . 0.547 HD12 HD13 ' A' ' 670' ' ' LEU . 44.7 mt -109.06 131.4 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.065 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.467 ' C ' HD12 ' A' ' 657' ' ' LEU . 22.5 t90 -95.53 121.66 37.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.176 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.517 HD12 ' N ' ' A' ' 657' ' ' LEU . 7.1 mp -116.2 146.59 42.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.685 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.581 ' O ' HG22 ' A' ' 658' ' ' VAL . 8.8 p -123.26 21.45 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.625 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 660' ' ' GLY . 48.6 t0 -152.28 163.61 39.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.563 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.415 ' N ' ' OD1' ' A' ' 659' ' ' ASP . . . -100.4 -54.51 1.01 Allowed Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.98 -0.628 . . . . 0.0 111.824 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 33.7 m -57.21 -41.87 80.24 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.602 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 26.5 m -64.4 -35.15 79.96 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.584 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.44 -42.48 99.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.622 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.56 HD22 ' ND1' ' A' ' 692' ' ' HIS . 80.6 mt -59.49 -43.79 93.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.852 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -62.71 -41.94 99.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.484 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.409 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 94.2 mt-30 -89.28 -51.31 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 111.298 -179.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.661 HD12 HD22 ' A' ' 631' ' ' LEU . 3.9 tt -45.81 -37.68 6.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.265 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.511 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 90.7 m-20 -56.14 -38.63 71.1 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.923 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.48 -31.46 53.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.101 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.547 HD13 HD12 ' A' ' 655' ' ' ILE . 11.1 mt -72.48 -38.48 68.19 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.247 -178.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 10.0 mm-40 46.82 65.55 6.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 110.192 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.492 ' HB3' ' CE1' ' A' ' 629' ' ' HIS . 30.5 Cg_endo -68.99 152.81 73.23 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 123.159 2.572 . . . . 0.0 112.952 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.811 HG23 HG23 ' A' ' 674' ' ' VAL . 19.3 tt -95.5 -22.21 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.696 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.811 HG23 HG23 ' A' ' 673' ' ' ILE . 76.1 t -140.1 133.69 35.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.468 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.666 HG23 HD23 ' A' ' 631' ' ' LEU . 78.4 mt -123.31 122.31 64.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.574 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.675 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -106.53 138.97 41.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.538 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.944 ' SD ' HD21 ' A' ' 690' ' ' LEU . 83.8 mtp -139.1 128.15 23.78 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.51 144.04 53.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.567 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.798 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 0.5 OUTLIER -113.68 -29.96 0.11 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.151 179.474 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.798 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 41.0 Cg_exo -50.87 -40.09 57.92 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.293 1.996 . . . . 0.0 113.288 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 23.4 Cg_exo -60.58 166.19 10.22 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.97 1.78 . . . . 0.0 111.961 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.512 ' O ' ' O ' ' A' ' 683' ' ' ASP . 32.1 Cg_exo -52.0 -17.97 6.35 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.532 2.154 . . . . 0.0 112.009 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 682' ' ' PRO . 1.0 OUTLIER 58.24 132.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.988 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -176.8 -78.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.736 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 77.3 p -64.08 -30.65 71.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.969 0.414 . . . . 0.0 109.941 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 2.4 m -62.42 -32.69 73.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.019 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.0 mt -64.58 -31.56 72.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.486 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.7 mt -63.27 -42.67 99.14 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.036 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.437 HD12 HD21 ' A' ' 664' ' ' LEU . 25.4 tp -60.36 -42.83 96.56 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.944 HD21 ' SD ' ' A' ' 677' ' ' MET . 82.1 mt -61.58 -40.64 95.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.778 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.88 -40.29 97.09 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.062 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.56 ' ND1' HD22 ' A' ' 664' ' ' LEU . 12.1 t-80 -57.5 -51.54 69.02 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.456 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 62.5 mt -55.13 -43.15 73.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.345 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -64.44 -35.66 81.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -65.91 -32.25 73.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.121 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 . . . . . 0 C--N 1.33 -0.25 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.454 -179.75 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo . . . . . 0 N--CA 1.489 1.228 0 CA-C-O 120.831 0.263 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -53.38 144.15 51.19 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.583 2.189 . . . . 0.0 111.789 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.552 ' H ' HD12 ' A' ' 704' ' ' LEU . 5.6 mp -79.39 138.42 37.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.359 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.535 ' C ' HD12 ' A' ' 706' ' ' LEU . 36.1 t -118.28 127.0 75.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.875 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.796 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.8 mp -115.63 129.85 56.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.942 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -109.15 128.23 54.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.014 0.435 . . . . 0.0 110.801 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 43.7 mt -95.44 149.97 20.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.561 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 101.34 -137.65 13.41 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -91.45 167.2 16.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.463 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.4 155.35 25.73 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.548 2.166 . . . . 0.0 112.483 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.47 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 22.5 Cg_endo -63.34 161.12 32.14 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 123.26 2.64 . . . . 0.0 112.07 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.1 -71.62 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.5 OUTLIER -70.97 148.07 94.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.663 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.91 -14.19 32.27 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.732 2.288 . . . . 0.0 112.222 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 74.2 mt -70.88 -31.52 68.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.411 ' O ' ' HB2' ' A' ' 721' ' ' ALA . 53.3 mt -77.03 -32.46 57.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 47.7 m -64.9 -43.54 92.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.039 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -66.18 -39.92 90.08 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.02 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -82.52 -11.55 58.38 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.454 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 717' ' ' LEU . . . -75.13 129.36 37.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.46 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.6 m -85.88 -23.0 27.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.057 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -168.44 139.37 2.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.351 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.551 ' C ' HD12 ' A' ' 725' ' ' LEU . 78.9 mt -123.73 126.11 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.656 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.794 ' N ' HD12 ' A' ' 725' ' ' LEU . 5.3 mp -106.82 151.9 24.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.679 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 60.7 p -167.1 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.062 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 74.99 79.38 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.018 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -48.95 125.29 12.82 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.397 2.065 . . . . 0.0 111.858 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.948 ' O ' HD23 ' A' ' 729' ' ' LEU . 0.5 OUTLIER -179.78 134.27 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.488 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.54 ' C ' ' H ' ' A' ' 732' ' ' GLN . 4.1 m-20 56.03 75.1 0.62 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.723 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.59 -7.56 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.625 2.217 . . . . 0.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . 0.54 ' H ' ' C ' ' A' ' 730' ' ' ASP . 14.4 mm100 -70.7 -26.41 63.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.299 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.43 -47.56 75.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.927 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 47.0 tp -58.13 -47.26 83.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.17 0.51 . . . . 0.0 109.662 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.6 tp -63.28 -38.65 91.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.133 179.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . 0.499 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 59.5 m -58.29 -41.56 84.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.51 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . 0.41 HG21 HD21 ' A' ' 706' ' ' LEU . 56.2 m -61.32 -41.21 96.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.922 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 13.6 tp -63.64 -39.04 93.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.364 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.486 ' O ' ' N ' ' A' ' 741' ' ' LEU . 55.0 tp60 -65.29 -32.5 74.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.985 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -46.72 -11.15 0.05 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.983 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.537 HD13 HD13 ' A' ' 673' ' ' ILE . 84.1 mt . . . . . 0 C--N 1.328 -0.327 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.647 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.662 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -87.55 144.18 26.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.716 0.293 . . . . 0.0 110.738 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 67.8 mt -119.21 132.37 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.621 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 51.2 tp -115.3 134.51 55.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.982 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.834 ' C ' HD12 ' A' ' 632' ' ' LEU . 0.2 OUTLIER -136.41 134.39 37.71 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.628 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.809 ' N ' HD12 ' A' ' 632' ' ' LEU . 25.9 tp -108.41 123.2 48.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.543 ' OE2' ' HB1' ' A' ' 639' ' ' ALA . 86.2 tt0 -159.45 155.32 26.35 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.509 -179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.461 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 75.8 mm-40 -95.76 167.01 11.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.492 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 62.48 112.41 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.654 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.9 p30 -64.94 -25.87 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.32 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.654 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.7 mt-10 -63.74 -40.62 97.18 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.37 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . 0.543 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -71.8 -41.65 68.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.292 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.477 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -67.44 -39.87 85.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.09 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 40.8 m -62.35 -44.09 97.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.796 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 638' ' ' GLU . 81.1 t -57.71 -50.47 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.66 -39.86 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.508 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.8 OUTLIER -59.04 -39.56 82.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -63.48 -36.79 84.93 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.782 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 59.8 mtt -68.75 -54.37 16.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.124 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . 0.552 ' N ' HD12 ' A' ' 647' ' ' LEU . 10.5 mp -67.08 -42.74 84.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.284 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 43.8 m -55.42 -42.53 74.27 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.456 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.07 -25.88 62.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.691 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.68 -5.01 40.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.992 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -9.57 70.48 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -98.2 134.13 41.68 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -92.62 127.45 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.121 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.418 HG13 ' SG ' ' A' ' 644' ' ' CYS . 14.4 p -122.84 139.78 48.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.041 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 67.7 mt -107.33 131.0 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.72 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.545 ' CZ2' ' CG1' ' A' ' 658' ' ' VAL . 10.3 t90 -94.78 117.36 30.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.473 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 663' ' ' ALA . 27.8 tp -116.44 149.73 38.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.546 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.545 ' CG1' ' CZ2' ' A' ' 656' ' ' TRP . 23.4 m -110.52 27.46 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.743 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.76 ' O ' HD13 ' A' ' 633' ' ' LEU . 67.9 m-20 -148.82 164.68 33.74 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.976 0.417 . . . . 0.0 111.143 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' A' ' 663' ' ' ALA . . . -109.47 -63.53 0.53 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 46.8 t -58.6 -40.78 84.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.0 110.725 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.6 m -62.64 -35.59 80.09 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 109.561 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.789 ' HB2' HD23 ' A' ' 657' ' ' LEU . . . -60.13 -45.55 92.62 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.418 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.827 ' O ' HD12 ' A' ' 664' ' ' LEU . 0.1 OUTLIER -57.97 -42.72 85.61 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.377 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . 0.508 ' N ' ' HG ' ' A' ' 664' ' ' LEU . 14.5 t70 -57.29 -39.6 76.05 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.158 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -94.56 -25.81 16.66 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.196 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.769 ' O ' HD23 ' A' ' 667' ' ' LEU . 7.5 tt -53.24 -35.22 59.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.022 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.682 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 66.2 m-20 -54.92 -37.66 66.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.386 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 71.2 mt -76.76 -35.8 57.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.089 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.412 ' O ' ' C ' ' A' ' 671' ' ' GLN . 12.8 mt -70.44 -41.31 73.03 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.089 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.682 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 13.3 mt-30 41.35 64.64 5.15 Favored Pre-proline 0 C--N 1.331 -0.201 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -78.4 158.3 29.29 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 123.092 2.528 . . . . 0.0 113.47 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.868 HG23 HG23 ' A' ' 674' ' ' VAL . 5.9 tp -93.77 -21.28 6.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.554 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.868 HG23 HG23 ' A' ' 673' ' ' ILE . 62.1 t -142.19 137.75 29.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.539 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.508 ' C ' HD23 ' A' ' 676' ' ' LEU . 64.7 mt -127.07 120.24 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.645 HD23 ' N ' ' A' ' 676' ' ' LEU . 0.0 OUTLIER -107.37 134.1 50.93 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.156 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.9 mtm -139.13 136.2 34.89 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.404 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -66.59 144.88 56.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.382 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.742 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 4.7 t-105 -113.13 -33.56 0.11 Allowed Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.715 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.742 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 20.1 Cg_exo -56.1 -43.0 60.65 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.013 1.809 . . . . 0.0 112.696 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 84.7 Cg_endo -83.59 165.37 14.05 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.739 2.293 . . . . 0.0 111.684 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.94 -82.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.381 2.054 . . . . 0.0 111.655 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 56.07 43.67 26.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.876 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -57.71 -30.35 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.428 -179.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 94.2 p -64.61 -26.28 68.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.667 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -28.29 67.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.544 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 71.0 mt -62.7 -36.26 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.969 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 90.0 mt -68.42 -37.84 80.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.768 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.488 HD23 ' C ' ' A' ' 689' ' ' LEU . 8.6 tt -56.58 -46.37 80.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.608 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.44 -39.0 91.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.734 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -61.66 -41.04 96.97 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.394 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.612 ' CD2' HD13 ' A' ' 664' ' ' LEU . 32.2 t-80 -59.91 -48.39 81.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.911 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.95 -42.03 68.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.612 -0.435 . . . . 0.0 109.939 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.408 HH22 ' HB3' ' A' ' 716' ' ' LEU . 57.0 ttm-85 -65.73 -28.02 68.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.5 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.32 -39.32 89.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.901 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 2.2 p80 . . . . . 0 N--CA 1.464 0.267 0 C-N-CA 119.844 -0.742 . . . . 0.0 112.342 -179.678 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.489 1.208 0 N-CA-C 112.426 0.125 . . . . 0.0 112.426 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -73.81 163.31 37.44 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 C-N-CA 122.653 2.235 . . . . 0.0 112.015 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.76 ' H ' HD22 ' A' ' 704' ' ' LEU . 1.6 mm? -78.01 140.41 39.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.104 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 31.8 t -121.88 134.5 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.879 0.371 . . . . 0.0 111.127 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.797 HD22 ' HB3' ' A' ' 723' ' ' ALA . 47.4 mt -115.52 132.35 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.012 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -111.96 126.25 54.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.145 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.64 148.32 22.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.387 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 90.38 -128.89 9.48 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.27 163.13 37.94 Favored Pre-proline 0 CA--C 1.532 0.274 0 C-N-CA 121.264 -0.174 . . . . 0.0 110.763 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -68.45 138.9 43.59 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.157 1.904 . . . . 0.0 112.036 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.431 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -47.64 151.96 3.05 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.388 2.059 . . . . 0.0 112.496 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.543 HG13 ' N ' ' A' ' 714' ' ' ASP . 8.1 p -83.78 -46.61 18.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.115 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . 0.543 ' N ' HG13 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.24 147.56 90.58 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.423 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.22 -24.99 16.25 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.913 2.408 . . . . 0.0 113.175 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.408 ' HB3' HH22 ' A' ' 694' ' ' ARG . 77.0 mt -70.22 -29.61 66.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.923 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.707 HD12 ' N ' ' A' ' 717' ' ' LEU . 7.4 mp -77.76 -41.5 37.34 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.892 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 41.6 m -63.91 -42.81 97.31 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.03 90.4 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.969 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 720' ' ' GLN . 7.4 tt0 -83.82 -13.96 52.45 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.979 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -71.43 128.56 36.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.031 0.443 . . . . 0.0 110.809 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 31.9 t -85.5 -24.65 27.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.466 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.797 ' HB3' HD22 ' A' ' 706' ' ' LEU . . . -171.27 159.52 5.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.182 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 70.6 mt -136.39 125.93 38.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.779 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 50.7 mt -107.68 126.89 53.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.937 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 36.5 t -69.6 -87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.912 0.387 . . . . 0.0 110.358 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . 0.917 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 9.8 tttp -134.83 -34.49 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.833 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.917 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 36.9 Cg_exo -57.48 149.62 65.16 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.31 2.007 . . . . 0.0 112.659 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.48 -80.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.83 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 54.07 58.58 12.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.101 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -63.9 -15.77 50.99 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 C-N-CA 122.745 2.297 . . . . 0.0 112.165 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -70.78 -34.69 72.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.319 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.2 tp -68.85 -44.06 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.227 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.466 ' CD2' HD11 ' A' ' 647' ' ' LEU . 62.1 tp -53.19 -45.16 68.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.738 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.65 -40.22 96.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.218 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 58.3 m -58.6 -38.95 79.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.933 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . 0.474 HG21 HD21 ' A' ' 706' ' ' LEU . 88.1 m -60.6 -39.69 89.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.994 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.511 ' CD2' HG21 ' A' ' 674' ' ' VAL . 23.5 mt -63.57 -42.38 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.659 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 741' ' ' LEU . 25.0 mt-30 -65.88 -28.71 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.244 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . 0.553 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -22.7 -45.76 0.01 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.56 ' N ' ' O ' ' A' ' 739' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.242 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.534 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . 0.443 ' HD1' ' HB3' ' A' ' 672' ' ' PRO . 21.7 t-80 -85.76 120.65 27.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.582 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.429 ' CG2' HD13 ' A' ' 676' ' ' LEU . 52.9 mt -117.68 135.48 57.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.755 0.312 . . . . 0.0 111.467 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.455 HD13 HD12 ' A' ' 667' ' ' LEU . 7.6 tt -108.17 127.62 53.99 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.047 0.451 . . . . 0.0 110.316 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.427 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 50.9 tp -110.15 125.05 52.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 9.0 tt -112.2 110.49 20.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.785 ' OE1' ' HB2' ' A' ' 678' ' ' ALA . 75.9 mm-40 -155.72 166.46 33.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.944 -179.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -111.98 165.36 12.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.23 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.3 tp10 65.76 121.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 111.078 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.526 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 81.6 m-20 -58.51 -37.18 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.023 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.55 ' O ' HG23 ' A' ' 642' ' ' VAL . 97.5 mt-10 -66.27 -45.26 81.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.061 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.7 -39.49 70.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.421 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . 0.636 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -68.35 -43.09 78.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.5 ' O ' ' N ' ' A' ' 645' ' ' GLU . 72.3 m -60.91 -43.55 98.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 638' ' ' GLU . 49.4 t -56.13 -54.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.771 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.65 -45.27 94.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.074 0.464 . . . . 0.0 110.112 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.598 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.4 OUTLIER -67.35 -41.0 85.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.893 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 641' ' ' THR . 86.0 tt0 -57.94 -40.6 80.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 80.8 mtp -67.04 -52.05 47.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.926 0.393 . . . . 0.0 110.428 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 80.4 mt -68.9 -43.28 75.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.826 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.598 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 34.5 m -56.24 -40.78 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.245 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.26 -25.85 62.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.684 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.71 -3.51 22.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.56 2.41 65.39 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.096 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -96.45 141.87 29.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 117.386 0.593 . . . . 0.0 110.651 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -87.85 110.89 20.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.215 0.531 . . . . 0.0 109.691 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.427 ' CG1' ' HB2' ' A' ' 632' ' ' LEU . 81.5 t -116.52 136.85 52.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.97 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 63.3 mt -108.9 133.42 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.851 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.636 ' CD1' ' HB1' ' A' ' 640' ' ' ALA . 23.8 t90 -92.96 111.59 23.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.756 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.794 ' CD2' ' HB2' ' A' ' 663' ' ' ALA . 22.7 tp -123.81 135.56 53.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.766 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 634' ' ' GLU . 21.1 m -105.72 -9.34 10.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.278 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.472 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 89.6 m-20 -100.95 152.04 21.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -102.78 -56.7 0.8 Allowed Glycine 0 CA--C 1.531 1.047 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.5 t -58.66 -40.78 84.47 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.888 0.375 . . . . 0.0 110.675 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 28.3 m -61.03 -38.85 87.61 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.794 ' HB2' ' CD2' ' A' ' 657' ' ' LEU . . . -61.55 -40.7 95.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.617 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.833 HD21 HD12 ' A' ' 689' ' ' LEU . 44.5 mt -57.8 -46.42 84.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.808 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.61 -43.49 93.59 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.817 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.401 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 94.0 mt-30 -84.67 -44.87 13.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.952 0.406 . . . . 0.0 111.391 -178.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.713 HD23 ' C ' ' A' ' 667' ' ' LEU . 9.6 tt -50.32 -35.06 25.97 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.5 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 664' ' ' LEU . 89.0 m-20 -55.36 -40.51 71.36 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.179 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 58.0 mt -74.5 -28.99 61.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 179.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 31.4 mt -72.39 -35.17 68.37 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.268 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.537 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 13.4 mm-40 43.4 62.23 9.19 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.537 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 3.6 Cg_exo -72.35 156.59 54.59 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.397 2.732 . . . . 0.0 113.335 -178.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 70.9 mt -98.54 -27.52 3.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.609 HG22 ' HB2' ' A' ' 704' ' ' LEU . 38.8 t -137.04 132.97 47.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.511 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.547 ' C ' HD12 ' A' ' 676' ' ' LEU . 63.7 mt -128.67 125.21 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.227 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.1 mp -103.82 129.69 51.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.898 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.81 ' SD ' HD21 ' A' ' 690' ' ' LEU . 10.6 ptp -143.52 140.1 30.12 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.253 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.785 ' HB2' ' OE1' ' A' ' 634' ' ' GLU . . . -67.04 152.58 45.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.374 178.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.732 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 63.3 t-105 -106.4 -26.69 0.19 Allowed Pre-proline 0 C--O 1.233 0.217 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.362 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.8 Cg_endo -101.55 29.22 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 123.428 2.752 . . . . 0.0 114.6 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 66.1 Cg_endo -77.13 151.18 30.12 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.645 1.564 . . . . 0.0 111.966 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -71.82 -14.16 29.64 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.319 2.013 . . . . 0.0 112.376 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -87.63 112.47 22.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.777 0.323 . . . . 0.0 111.484 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -65.51 -8.98 22.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 87.9 p -64.53 -23.16 67.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -178.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.551 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -62.57 -38.61 90.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.052 0.453 . . . . 0.0 109.839 179.088 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . 0.551 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 76.0 mt -66.16 -35.83 81.51 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.992 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 688' ' ' LEU . 63.3 mt -66.52 -36.39 82.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.685 179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . 0.833 HD12 HD21 ' A' ' 664' ' ' LEU . 14.9 tp -59.56 -40.75 88.34 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . 0.81 HD21 ' SD ' ' A' ' 677' ' ' MET . 46.7 mt -59.61 -39.01 82.82 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.901 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.14 -42.21 94.39 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.62 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.7 ' HE2' ' CE1' ' A' ' 696' ' ' HIS . 4.1 t60 -62.63 -61.09 2.67 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . 0.714 HD21 ' HA ' ' A' ' 690' ' ' LEU . 1.6 pp -54.55 -33.13 59.61 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.868 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . 0.526 ' N ' HD12 ' A' ' 693' ' ' LEU . 23.5 ttt85 -60.82 -42.46 97.73 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.027 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -69.2 -39.79 78.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . 0.7 ' CE1' ' HE2' ' A' ' 692' ' ' HIS . 64.5 m170 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.632 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo . . . . . 0 N--CA 1.49 1.317 0 CA-C-O 120.469 0.112 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.58 140.44 23.92 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 122.303 2.002 . . . . 0.0 112.183 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.708 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER -81.0 142.68 33.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.716 -179.771 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.739 ' C ' HD12 ' A' ' 706' ' ' LEU . 40.5 t -126.05 125.98 68.89 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.041 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.793 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.9 mp -122.4 135.6 54.72 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.067 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -111.23 130.3 55.69 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.132 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 72.4 mt -96.85 146.46 24.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.541 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 88.2 -136.38 13.72 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 710' ' ' GLU . 0.3 OUTLIER -87.31 151.04 50.54 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.082 0.468 . . . . 0.0 110.85 -179.231 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.17 156.14 65.78 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 123.112 2.541 . . . . 0.0 112.945 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.684 ' O ' ' N ' ' A' ' 714' ' ' ASP . 29.4 Cg_endo -67.53 3.68 1.68 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.871 2.38 . . . . 0.0 112.292 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 55.2 t 60.42 -38.84 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.684 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . 0.684 ' N ' ' O ' ' A' ' 712' ' ' PRO . 52.1 m-20 -70.08 133.15 87.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.38 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -73.91 -19.53 20.61 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 122.312 2.008 . . . . 0.0 113.088 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . 0.448 ' H ' HD12 ' A' ' 716' ' ' LEU . 5.3 mp -71.36 -40.82 70.38 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.295 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.56 -37.09 57.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.652 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 31.8 m -63.37 -39.68 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.64 91.96 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.784 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -78.97 -20.23 49.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.548 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . 0.477 ' CB ' HD11 ' A' ' 724' ' ' ILE . . . -71.38 142.79 50.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.53 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.408 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 91.9 p -85.95 -29.02 23.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.33 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -167.2 129.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.477 HD11 ' CB ' ' A' ' 721' ' ' ALA . 18.2 mm -98.19 128.3 49.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.542 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.1 mp -107.68 145.02 33.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.674 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 727' ' ' LYS . 12.3 t -164.86 -16.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.062 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . 0.424 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.1 OUTLIER -129.96 74.81 80.25 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.136 179.711 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -50.36 142.93 28.23 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.845 2.364 . . . . 0.0 112.748 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . 0.422 ' O ' ' O ' ' A' ' 730' ' ' ASP . 39.6 tp -174.43 93.17 0.08 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.402 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 729' ' ' LEU . 25.2 m-20 57.76 147.06 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.47 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -68.98 3.22 2.52 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 123.142 2.561 . . . . 0.0 112.319 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -67.42 -31.61 71.92 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.731 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 24.9 tp -67.69 -53.72 25.35 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.094 -0.642 . . . . 0.0 110.667 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . 0.643 HD11 HD21 ' A' ' 676' ' ' LEU . 9.1 tt -57.15 -41.37 79.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.038 0.447 . . . . 0.0 110.76 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 24.2 tp -60.03 -39.52 86.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 35.4 m -58.33 -39.42 79.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.388 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 52.2 m -60.8 -43.33 98.28 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.901 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . 0.425 ' CD2' HG21 ' A' ' 674' ' ' VAL . 57.6 mt -63.22 -37.01 85.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.108 0.48 . . . . 0.0 110.388 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -64.67 -29.18 70.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.082 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.69 -20.3 3.92 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 741' ' ' LEU . 67.4 mt . . . . . 0 C--N 1.326 -0.422 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.436 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.651 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -89.09 131.27 35.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 110.376 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 630' ' ' ILE . . . . . 0.681 ' HB ' HG12 ' A' ' 654' ' ' VAL . 54.6 mt -114.67 141.54 30.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 631' ' ' LEU . . . . . 0.743 HD21 HD12 ' A' ' 670' ' ' LEU . 83.2 mt -103.9 131.5 51.06 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.209 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 632' ' ' LEU . . . . . 0.474 HD11 HG11 ' A' ' 643' ' ' VAL . 10.6 tp -124.18 117.36 24.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.011 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.469 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 9.4 tt -117.21 120.1 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.386 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 634' ' ' GLU . . . . . 0.469 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 92.4 mt-10 -158.56 170.29 22.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.194 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 635' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 636' ' ' GLU . 96.4 mt-10 -110.06 158.52 18.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.352 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 636' ' ' GLU . . . . . 0.529 ' HG2' ' H ' ' A' ' 638' ' ' GLU . 83.3 tt0 62.16 127.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.925 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 637' ' ' ASP . . . . . 0.706 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 51.6 p30 -61.94 -29.97 70.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 638' ' ' GLU . . . . . 0.859 ' O ' HG23 ' A' ' 642' ' ' VAL . 50.8 tp10 -63.29 -41.11 98.95 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.058 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.62 59.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 110.278 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.97 76.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.064 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 641' ' ' THR . . . . . 0.574 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 67.1 m -62.47 -46.18 89.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.085 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 642' ' ' VAL . . . . . 0.859 HG23 ' O ' ' A' ' 638' ' ' GLU . 89.4 t -56.77 -52.66 51.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.285 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 643' ' ' VAL . . . . . 0.474 HG11 HD11 ' A' ' 632' ' ' LEU . 98.4 t -60.31 -41.9 88.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.803 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 644' ' ' CYS . . . . . 0.505 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.7 OUTLIER -58.58 -42.39 87.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.779 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.1 -39.28 91.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.171 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.0 mtt -66.97 -50.14 63.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.061 0.457 . . . . 0.0 110.109 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 73.1 mt -69.08 -46.03 68.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.293 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 648' ' ' THR . . . . . 0.505 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 61.7 m -56.3 -41.98 76.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.105 0.479 . . . . 0.0 109.858 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.95 -24.97 64.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.649 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.72 -6.24 39.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.905 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.41 -12.76 66.29 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.758 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -96.03 142.35 28.35 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.742 179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -92.77 134.34 35.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.184 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 654' ' ' VAL . . . . . 0.681 HG12 ' HB ' ' A' ' 630' ' ' ILE . 4.0 m -122.99 153.66 28.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.025 0.441 . . . . 0.0 111.099 -179.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 655' ' ' ILE . . . . . 0.446 ' CD1' HD13 ' A' ' 670' ' ' LEU . 69.6 mt -108.96 135.44 47.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.708 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 656' ' ' TRP . . . . . 0.682 ' C ' HD22 ' A' ' 657' ' ' LEU . 18.9 t90 -92.7 126.1 37.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 111.241 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 657' ' ' LEU . . . . . 0.682 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.9 mm? -115.12 143.2 45.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.677 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 658' ' ' VAL . . . . . 0.612 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 82.2 t -98.28 -18.95 6.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.17 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 659' ' ' ASP . . . . . 0.612 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 98.6 m-20 -147.85 150.13 33.58 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.473 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -65.49 -39.68 95.79 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 18.9 t -58.16 -40.34 81.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.759 0.314 . . . . 0.0 110.796 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.6 m -64.64 -38.94 92.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 663' ' ' ALA . . . . . 0.448 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.63 -46.41 85.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.495 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 664' ' ' LEU . . . . . 0.568 HD22 ' ND1' ' A' ' 692' ' ' HIS . 67.5 mt -59.39 -42.19 91.12 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.811 -0.355 . . . . 0.0 111.134 -179.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -62.74 -40.13 96.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.804 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 666' ' ' GLN . . . . . 0.403 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 26.3 mt-30 -84.63 -42.93 14.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.097 0.475 . . . . 0.0 110.66 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 667' ' ' LEU . . . . . 0.776 HD23 ' C ' ' A' ' 667' ' ' LEU . 8.7 tt -45.29 -44.6 11.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.215 -179.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -58.56 -35.02 71.7 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.25 -38.52 56.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.928 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.743 HD12 HD21 ' A' ' 631' ' ' LEU . 0.1 OUTLIER -77.41 -41.7 38.98 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.709 -178.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 671' ' ' GLN . . . . . 0.463 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 8.0 mm-40 58.88 62.71 4.18 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 0.0 109.899 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 672' ' ' PRO . . . . . 0.521 ' HG3' HD11 ' A' ' 631' ' ' LEU . 50.5 Cg_endo -80.35 165.76 20.76 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.365 2.71 . . . . 0.0 112.554 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 673' ' ' ILE . . . . . 0.408 ' CG2' HD22 ' A' ' 741' ' ' LEU . 97.2 mt -94.92 -19.63 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.139 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 674' ' ' VAL . . . . . 0.672 HG13 HG23 ' A' ' 630' ' ' ILE . 14.9 p -141.05 141.92 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.309 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.711 HD12 HD12 ' A' ' 631' ' ' LEU . 12.9 mm -119.93 124.51 72.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.134 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 676' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' A' ' 706' ' ' LEU . 51.1 mt -107.07 126.8 52.82 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 677' ' ' MET . . . . . 0.453 ' SD ' HG13 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -141.9 135.16 29.19 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.931 -0.707 . . . . 0.0 112.383 -178.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 678' ' ' ALA . . . . . 0.586 ' O ' ' SG ' ' A' ' 686' ' ' CYS . . . -68.09 152.55 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.67 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 679' ' ' TRP . . . . . 0.599 ' CG ' ' O ' ' A' ' 679' ' ' TRP . 74.6 t-105 -125.23 49.73 3.63 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.286 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' A' ' 679' ' ' TRP . 95.0 Cg_endo -84.2 135.07 6.18 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.547 2.165 . . . . 0.0 111.319 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 681' ' ' PRO . . . . . 0.608 ' C ' ' H ' ' A' ' 683' ' ' ASP . 16.3 Cg_exo -51.27 -47.42 25.99 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 121.93 1.754 . . . . 0.0 113.305 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 682' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 32.7 Cg_endo -65.91 29.58 0.1 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.69 1.594 . . . . 0.0 111.163 -179.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 683' ' ' ASP . . . . . 0.608 ' H ' ' C ' ' A' ' 681' ' ' PRO . 21.9 t70 -151.27 71.93 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.043 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.53 0.35 0.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.532 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 685' ' ' SER . . . . . 0.45 ' H ' ' C ' ' A' ' 683' ' ' ASP . 20.4 m -61.45 -33.41 73.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.299 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 686' ' ' CYS . . . . . 0.586 ' SG ' ' O ' ' A' ' 678' ' ' ALA . 91.0 m -59.05 -27.34 65.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.919 0.39 . . . . 0.0 110.342 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.68 -33.3 75.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.31 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.56 -39.1 84.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.301 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.53 -42.26 96.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.416 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.5 -44.1 96.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.868 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -61.99 -38.78 89.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.904 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 692' ' ' HIS . . . . . 0.568 ' ND1' HD22 ' A' ' 664' ' ' LEU . 9.9 t-160 -56.86 -50.12 73.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.0 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 61.3 mt -55.07 -42.85 73.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.999 179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -67.68 -33.1 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.172 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -65.81 -32.15 73.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.488 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 . . . . . 0 C--N 1.329 -0.324 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.613 -179.359 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo . . . . . 0 N--CA 1.49 1.287 0 N-CA-C 112.549 0.173 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.97 166.35 29.41 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.687 2.258 . . . . 0.0 111.791 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.65 HD11 HG22 ' A' ' 737' ' ' THR . 6.4 tt -77.26 125.58 29.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.453 HG13 ' SD ' ' A' ' 677' ' ' MET . 61.2 t -122.81 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.121 0.486 . . . . 0.0 111.706 -179.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 706' ' ' LEU . . . . . 0.716 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 19.7 mt -118.35 135.92 54.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.692 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -107.88 121.57 45.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.599 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 40.3 mt -98.94 134.55 41.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.164 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 134.1 -138.01 9.74 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.411 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 710' ' ' GLU . . . . . 0.603 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.9 OUTLIER -93.59 -176.93 0.62 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.674 0.273 . . . . 0.0 111.017 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' A' ' 710' ' ' GLU . 19.4 Cg_exo -61.74 157.49 42.36 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.719 2.28 . . . . 0.0 112.323 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 712' ' ' PRO . . . . . 0.678 ' HB3' HD11 ' A' ' 717' ' ' LEU . 29.1 Cg_endo -65.45 146.07 84.36 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.174 2.583 . . . . 0.0 112.778 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 713' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 713' ' ' VAL . 54.4 t -84.22 -15.65 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.715 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -162.12 150.08 12.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.905 0.383 . . . . 0.0 110.398 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.4 -9.75 21.36 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.913 2.408 . . . . 0.0 112.939 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.4 mt -70.15 -39.88 75.1 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.767 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.759 ' C ' HD12 ' A' ' 717' ' ' LEU . 1.9 pp -80.56 -37.34 31.57 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 718' ' ' THR . . . . . 0.548 ' N ' HD12 ' A' ' 717' ' ' LEU . 30.9 m -63.83 -40.85 97.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.608 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.04 91.43 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-O 121.029 0.442 . . . . 0.0 109.998 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -74.25 -37.72 63.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.378 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.57 48.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.594 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 722' ' ' SER . . . . . 0.413 ' CB ' ' HG ' ' A' ' 704' ' ' LEU . 4.7 m -85.65 -23.15 27.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 723' ' ' ALA . . . . . 0.716 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -170.47 163.99 8.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.371 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 724' ' ' ILE . . . . . 0.408 HD13 HG21 ' A' ' 724' ' ' ILE . 31.6 mt -139.88 128.77 27.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.927 -179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 37.0 mt -106.9 125.41 50.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.131 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 59.0 m -72.1 -90.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.404 -179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 727' ' ' LYS . . . . . 0.891 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 26.9 tttt -130.71 -32.44 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 728' ' ' PRO . . . . . 0.891 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 48.0 Cg_exo -53.78 151.15 26.79 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.26 1.973 . . . . 0.0 112.08 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.54 -51.11 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.673 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 730' ' ' ASP . . . . . 0.477 ' N ' ' HD3' ' A' ' 731' ' ' PRO . 82.2 m-20 40.74 57.22 8.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.966 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 731' ' ' PRO . . . . . 0.477 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 68.1 Cg_endo -82.55 -28.11 1.91 Allowed 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.567 2.178 . . . . 0.0 112.045 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -73.5 -37.39 65.7 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 49.5 tp -67.31 -40.51 86.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.862 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 27.5 tp -55.55 -47.22 76.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.932 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 735' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 735' ' ' LEU . 9.4 tt -64.21 -44.42 91.99 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.271 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 91.3 m -61.2 -38.2 85.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.598 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 737' ' ' THR . . . . . 0.65 HG22 HD11 ' A' ' 704' ' ' LEU . 39.9 m -60.93 -42.54 98.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.202 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.6 -38.78 92.42 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.389 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 739' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 741' ' ' LEU . 97.0 mt-30 -64.49 -34.5 78.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.937 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -60.64 1.68 0.69 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 741' ' ' LEU . . . . . 0.501 ' H ' ' C ' ' A' ' 739' ' ' GLN . 63.1 tp . . . . . 0 C--N 1.328 -0.353 0 CA-C-O 120.797 0.332 . . . . 0.0 110.602 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 179.54 135.26 2.37 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -96.09 135.18 38.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.762 0.315 . . . . 0.0 110.789 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' A' ' 654' ' ' VAL . 57.5 mt -118.87 134.11 63.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.193 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.791 HD21 ' HB1' ' A' ' 663' ' ' ALA . 27.1 tp -107.21 131.67 53.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.097 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.456 HD12 ' HB2' ' A' ' 676' ' ' LEU . 4.6 tp -133.06 127.36 33.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.889 0.376 . . . . 0.0 111.877 -178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 633' ' ' LEU . 7.9 mp -109.68 119.12 38.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.57 ' OE2' ' HB1' ' A' ' 639' ' ' ALA . 83.9 tt0 -159.06 156.97 30.22 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.012 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.65 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 85.3 tt0 -115.59 138.17 51.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.65 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 69.1 tt0 103.56 113.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.47 ' O ' ' OG1' ' A' ' 641' ' ' THR . 62.1 t0 -57.54 -36.04 71.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.333 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.4 -44.47 82.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.664 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.57 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -70.58 -43.2 69.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.832 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.35 87.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 86.9 m -62.22 -44.28 96.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.686 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 56.6 t -57.75 -53.73 40.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.023 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -59.46 -46.26 92.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.149 -179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.566 ' O ' ' OG1' ' A' ' 648' ' ' THR . 73.2 m -61.46 -35.74 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.031 -179.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.1 tp10 -62.48 -40.32 96.3 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.913 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 89.5 mtp -67.36 -51.61 50.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.944 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.678 HD22 HG21 ' A' ' 654' ' ' VAL . 6.6 mp -67.89 -42.68 80.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.675 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.566 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 87.1 m -55.64 -42.08 74.5 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.759 179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.06 -29.57 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.029 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.31 -6.65 47.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.735 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.25 2.4 73.98 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . 0.621 ' CE2' HD22 ' A' ' 735' ' ' LEU . 84.2 m-85 -96.88 145.15 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.806 0.336 . . . . 0.0 111.122 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -93.43 128.92 39.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.689 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.678 HG21 HD22 ' A' ' 647' ' ' LEU . 71.8 t -124.61 138.01 55.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.552 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 53.3 mt -105.66 130.74 56.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.857 0.361 . . . . 0.0 110.495 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.535 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 24.4 t90 -96.66 111.51 23.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.041 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.429 ' CD1' ' HA ' ' A' ' 663' ' ' ALA . 64.6 mt -116.4 141.86 47.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.708 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.532 ' O ' HG12 ' A' ' 658' ' ' VAL . 18.4 t -101.35 2.28 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.936 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -148.42 136.33 20.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 0.0 110.879 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.484 ' H ' ' HB2' ' A' ' 685' ' ' SER . . . -61.48 -37.9 94.9 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.204 -0.759 . . . . 0.0 111.204 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 90.0 p -60.02 -34.98 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.832 0.349 . . . . 0.0 110.229 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 19.2 m -64.75 -39.6 93.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.642 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.791 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -63.87 -43.61 95.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.043 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 80.0 mt -59.72 -39.31 84.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.876 0.37 . . . . 0.0 110.834 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . 0.576 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 23.4 t70 -62.43 -41.52 98.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.949 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.574 ' O ' HD23 ' A' ' 670' ' ' LEU . 42.5 mt-30 -90.08 -45.23 9.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.891 0.377 . . . . 0.0 111.126 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 663' ' ' ALA . 0.9 OUTLIER -44.56 -44.64 8.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.2 -179.132 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.576 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 30.1 p-10 -61.81 -35.74 79.08 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.45 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.482 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 65.3 mt -78.23 -48.16 16.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.933 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.574 HD23 ' O ' ' A' ' 666' ' ' GLN . 0.7 OUTLIER -82.62 -29.32 30.2 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.527 -179.238 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.477 ' N ' ' O ' ' A' ' 667' ' ' LEU . 6.6 mt-30 45.56 81.17 0.26 Allowed Pre-proline 0 C--N 1.329 -0.321 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.115 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -81.69 157.19 18.69 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 123.028 2.485 . . . . 0.0 112.427 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.745 HG13 HG23 ' A' ' 674' ' ' VAL . 26.3 pt -94.02 -10.7 9.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.69 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.745 HG23 HG13 ' A' ' 673' ' ' ILE . 83.4 t -139.7 134.05 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.54 179.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.49 HD11 HD11 ' A' ' 667' ' ' LEU . 62.2 mt -128.93 119.54 49.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.05 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.456 ' HB2' HD12 ' A' ' 632' ' ' LEU . 3.5 mp -107.68 137.68 45.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.071 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.572 ' CE ' ' HG ' ' A' ' 686' ' ' CYS . 74.8 mtm -138.17 133.44 33.31 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.197 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.587 ' O ' ' OD2' ' A' ' 683' ' ' ASP . . . -67.51 145.05 55.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.248 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.767 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 32.9 t-105 -113.21 -15.1 0.11 Allowed Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.767 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 75.4 Cg_exo -46.6 162.79 0.13 Allowed 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 121.711 1.607 . . . . 0.0 112.296 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.537 ' N ' ' HD2' ' A' ' 682' ' ' PRO . 23.8 Cg_exo -50.47 -49.99 14.91 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 C-N-CA 122.678 2.252 . . . . 0.0 114.112 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 10.7 Cg_endo -55.79 -6.12 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.369 0 C-N-CA 121.51 1.474 . . . . 0.0 111.234 -179.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.587 ' OD2' ' O ' ' A' ' 678' ' ' ALA . 27.3 t0 -83.53 155.23 23.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.96 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -179.09 -31.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.508 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . 0.484 ' HB2' ' H ' ' A' ' 660' ' ' GLY . 83.7 p -66.3 -28.31 68.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.592 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.572 ' HG ' ' CE ' ' A' ' 677' ' ' MET . 1.6 t -61.25 -22.25 64.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 687' ' ' LEU . 88.1 mt -64.79 -34.61 78.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.913 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.2 -39.86 86.4 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.968 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.616 ' O ' HD23 ' A' ' 689' ' ' LEU . 7.3 tt -61.85 -40.88 96.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.022 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.46 HD13 HD22 ' A' ' 717' ' ' LEU . 95.4 mt -60.26 -38.56 83.89 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.335 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . 0.476 ' HA ' ' NH1' ' A' ' 694' ' ' ARG . 60.8 tt0 -61.01 -42.14 97.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.978 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 11.4 t-160 -58.36 -49.35 77.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.105 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.62 ' O ' ' N ' ' A' ' 697' ' ' GLN . 64.0 mt -55.53 -38.77 69.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.523 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.476 ' NH1' ' HA ' ' A' ' 691' ' ' GLN . 34.0 ttm105 -65.24 -37.57 87.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -68.41 -37.79 80.66 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.738 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -127.75 41.22 3.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.428 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.62 ' N ' ' O ' ' A' ' 693' ' ' LEU . 63.3 tp60 -57.26 -37.05 71.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.239 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -87.07 113.23 22.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.115 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -168.38 128.96 1.09 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.744 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -44.06 155.09 0.24 Allowed 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 122.355 2.037 . . . . 0.0 111.734 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 56.98 60.36 7.29 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 703' ' ' PRO . 11.8 Cg_endo -57.49 113.5 1.53 Allowed 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.082 2.522 . . . . 0.0 112.4 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . 0.541 ' O ' ' O ' ' A' ' 702' ' ' PRO . 46.5 Cg_exo -51.35 -149.61 0.0 OUTLIER 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.546 2.164 . . . . 0.0 112.253 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 94.8 mt -154.25 123.25 6.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.328 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.524 ' O ' ' OG ' ' A' ' 722' ' ' SER . 21.1 t -107.36 127.17 63.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.17 0.509 . . . . 0.0 111.499 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.622 ' N ' HD12 ' A' ' 706' ' ' LEU . 5.2 mp -121.35 139.37 53.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.363 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -106.78 128.79 54.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.105 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.6 mt -93.71 146.79 23.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.598 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 86.66 -126.04 7.7 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -90.26 159.44 41.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.732 0.301 . . . . 0.0 110.779 -179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.513 ' HB3' HD13 ' A' ' 724' ' ' ILE . 72.6 Cg_endo -79.04 149.05 22.23 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.787 2.324 . . . . 0.0 112.338 -179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -64.92 145.61 86.09 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.71 2.274 . . . . 0.0 112.052 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 79.7 t -80.13 -37.68 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . 0.636 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.3 OUTLIER -71.98 139.57 82.7 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.494 179.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -74.28 -17.01 21.88 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.599 2.199 . . . . 0.0 112.925 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 21.3 tp -70.05 -38.93 75.95 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.829 -0.349 . . . . 0.0 111.015 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.513 ' CD1' ' CH2' ' A' ' 679' ' ' TRP . 48.5 mt -77.06 -34.86 57.03 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 61.0 m -64.98 -41.14 95.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.922 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.71 -40.89 96.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.429 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -82.76 -8.22 59.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.811 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.56 131.66 41.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 705' ' ' VAL . 83.4 p -86.42 -29.18 23.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.667 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.08 131.77 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.572 -0.451 . . . . 0.0 111.27 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.513 HD13 ' HB3' ' A' ' 711' ' ' PRO . 60.9 mt -93.16 128.48 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.119 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 33.8 mt -107.79 148.48 29.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.912 0.387 . . . . 0.0 111.252 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.5 t -167.42 -66.55 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.517 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . 0.441 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 0.7 OUTLIER -135.06 59.74 35.72 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.207 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 63.5 Cg_endo -79.72 141.14 15.19 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.915 2.41 . . . . 0.0 112.295 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.517 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.2 OUTLIER -67.01 109.3 2.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.771 179.698 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.517 ' O ' ' O ' ' A' ' 729' ' ' LEU . 31.1 m-20 54.85 147.84 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.39 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -63.32 0.25 1.89 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 123.083 2.522 . . . . 0.0 111.898 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 730' ' ' ASP . 95.0 mt-30 -68.13 -29.95 68.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.581 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.8 tp -63.71 -42.86 97.89 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 35.7 tp -58.55 -43.65 89.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.193 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . 0.621 HD22 ' CE2' ' A' ' 652' ' ' PHE . 31.4 mt -61.53 -36.9 81.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.168 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.7 m -58.9 -42.26 89.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.331 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.8 m -62.0 -42.78 99.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.609 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.5 tt -64.78 -43.95 91.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.668 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 741' ' ' LEU . 96.9 mm-40 -66.53 -32.33 73.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.889 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.39 -5.93 0.37 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.145 -179.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 739' ' ' GLN . 38.7 tp -77.54 -39.0 47.46 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.783 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 742' ' ' CYS . 39.5 t 52.93 63.18 8.93 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.484 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -81.88 116.75 2.86 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.537 2.158 . . . . 0.0 111.751 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -90.39 131.58 1.72 Allowed 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.77 2.313 . . . . 0.0 112.408 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . 0.539 ' OXT' ' CG ' ' A' ' 745' ' ' ASN . 35.8 p-10 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.745 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 153.99 157.01 7.91 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -93.98 135.64 35.12 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.86 0.362 . . . . 0.0 110.613 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.62 HG23 HG13 ' A' ' 674' ' ' VAL . 59.1 mt -115.82 135.93 54.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.366 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 1.096 HD22 HD12 ' A' ' 667' ' ' LEU . 16.3 tp -111.0 130.41 55.6 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.868 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.458 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 19.0 tp -116.09 125.65 52.68 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.771 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 14.7 tp -118.37 112.93 20.65 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.575 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 84.2 tt0 -160.35 164.96 32.06 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.719 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 77.5 mm-40 -106.07 168.2 9.29 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.409 ' HB3' ' O ' ' A' ' 635' ' ' GLU . 43.3 tp10 67.7 110.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.42 . . . . 0.0 110.48 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.563 ' OD1' ' OG1' ' A' ' 641' ' ' THR . 63.0 t0 -56.99 -36.02 69.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.292 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -62.67 -42.13 99.46 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.353 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.32 -45.99 57.53 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.563 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.474 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -65.1 -36.39 84.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.576 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.563 ' OG1' ' OD1' ' A' ' 637' ' ' ASP . 77.2 m -63.34 -46.55 86.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.646 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 41.7 t -54.69 -50.25 61.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.515 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 98.8 t -58.92 -43.52 88.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.87 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.588 ' O ' ' OG1' ' A' ' 648' ' ' THR . 71.1 m -67.34 -37.51 83.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.796 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -62.25 -39.48 93.01 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.352 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.6 mtm -65.8 -49.75 67.14 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.942 -0.703 . . . . 0.0 109.855 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.719 ' CD1' HG21 ' A' ' 654' ' ' VAL . 42.0 mt -70.52 -43.58 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.663 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 85.0 m -55.83 -42.36 75.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.938 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.91 -33.79 76.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -76.14 -5.46 46.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.43 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.74 14.8 66.91 Favored Glycine 0 CA--C 1.53 1.023 0 N-CA-C 111.236 -0.746 . . . . 0.0 111.236 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . 0.568 ' CZ ' HD11 ' A' ' 735' ' ' LEU . 9.2 m-85 -91.33 143.68 26.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -91.37 114.54 27.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.719 HG21 ' CD1' ' A' ' 647' ' ' LEU . 61.1 t -128.82 134.25 64.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.095 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . 0.459 ' HB ' HD12 ' A' ' 631' ' ' LEU . 53.0 mt -112.49 125.02 69.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.403 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.575 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 22.6 t90 -94.53 119.92 33.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.502 HD12 ' HB2' ' A' ' 663' ' ' ALA . 52.8 mt -119.58 149.31 42.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.992 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.574 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 30.6 m -113.38 10.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.635 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 85.5 m-20 -149.86 121.06 7.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.271 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.92 -42.29 99.62 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 79.9 p -58.93 -37.67 77.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.074 0.464 . . . . 0.0 110.22 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 29.0 m -65.27 -39.69 92.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.103 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.573 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -64.62 -41.78 95.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.184 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 89.8 mt -59.19 -46.12 89.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.785 0.326 . . . . 0.0 111.446 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -61.78 -40.38 94.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.022 -179.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -88.61 -54.79 4.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.476 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 1.096 HD12 HD22 ' A' ' 631' ' ' LEU . 10.3 tt -48.32 -35.19 11.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.484 -178.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -53.55 -40.61 65.68 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.193 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 57.0 mt -79.51 -24.98 41.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.724 179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 32.3 mt -71.57 -35.61 70.63 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.801 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.499 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.2 mm-40 47.23 63.87 9.44 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 5.9 Cg_exo -73.11 160.02 46.38 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 123.178 2.586 . . . . 0.0 112.857 -178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 81.1 mt -94.53 -23.1 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.992 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.62 HG13 HG23 ' A' ' 630' ' ' ILE . 10.5 p -145.82 141.07 21.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 121.067 0.461 . . . . 0.0 111.13 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 79.0 mt -124.32 119.35 56.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.192 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.439 HD23 ' HB2' ' A' ' 706' ' ' LEU . 70.2 mt -105.5 131.44 52.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.36 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 7.2 ptm -145.83 138.29 25.58 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.99 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.38 149.31 48.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.743 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 28.3 t-105 -110.63 -34.33 0.13 Allowed Pre-proline 0 C--N 1.328 -0.334 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.993 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.743 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 39.0 Cg_exo -52.56 -41.48 67.99 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.23 1.954 . . . . 0.0 112.762 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 24.0 Cg_exo -59.63 134.52 58.32 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.133 1.889 . . . . 0.0 112.094 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -83.35 33.33 0.52 Allowed 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.883 2.389 . . . . 0.0 112.437 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -81.45 111.76 18.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.153 0.502 . . . . 0.0 110.873 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -61.04 -24.94 66.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.68 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 38.6 m -59.95 -36.54 77.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.511 ' O ' ' CD1' ' A' ' 690' ' ' LEU . 73.6 m -59.97 -34.55 73.43 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 64.9 mt -65.58 -34.91 79.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.416 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.773 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -70.48 -35.65 73.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.24 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.489 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 4.9 tp -60.47 -43.71 96.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.71 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.511 ' CD1' ' O ' ' A' ' 686' ' ' CYS . 7.0 mp -61.94 -38.89 90.18 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.857 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -60.13 -41.98 93.84 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.206 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -61.6 -54.63 40.46 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.575 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.609 HD13 ' NE2' ' A' ' 696' ' ' HIS . 1.7 mm? -55.17 -37.66 67.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.124 179.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 49.1 ttm-85 -60.37 -37.16 79.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.263 -179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -68.44 -40.89 80.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.164 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.628 ' C ' ' HD1' ' A' ' 696' ' ' HIS . 0.1 OUTLIER -104.71 13.5 31.32 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.236 -179.697 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.464 ' N ' ' O ' ' A' ' 693' ' ' LEU . 54.8 tt0 -61.86 -29.49 70.22 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -78.1 1.46 21.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.77 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.45 146.39 88.89 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.89 148.24 58.02 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.577 2.185 . . . . 0.0 111.725 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.455 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 2.7 m-70 51.4 55.64 16.05 Favored Pre-proline 0 C--N 1.33 -0.278 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 17.8 Cg_endo -63.26 141.63 82.94 Favored 'Trans proline' 0 C--N 1.306 -1.661 0 C-N-CA 122.87 2.38 . . . . 0.0 112.342 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -69.59 149.16 67.65 Favored 'Trans proline' 0 C--N 1.308 -1.588 0 C-N-CA 122.721 2.281 . . . . 0.0 111.914 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 37.1 mt -78.71 141.35 37.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.559 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.661 ' C ' HD12 ' A' ' 706' ' ' LEU . 59.8 t -121.84 125.96 73.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.309 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.661 HD12 ' C ' ' A' ' 705' ' ' VAL . 5.4 mp -131.2 138.17 49.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.072 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . 0.852 ' CE2' ' HB2' ' A' ' 721' ' ' ALA . 13.0 m-85 -113.37 130.31 56.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.505 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.711 ' N ' HD12 ' A' ' 708' ' ' LEU . 5.4 mp -94.88 148.72 22.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.408 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . 0.581 ' O ' ' O ' ' A' ' 725' ' ' LEU . . . 101.83 -134.93 11.94 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 111.203 -0.759 . . . . 0.0 111.203 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.36 154.09 48.73 Favored Pre-proline 0 CA--C 1.529 0.173 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -81.87 131.83 7.24 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 C-N-CA 122.655 2.236 . . . . 0.0 112.586 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.474 ' HB3' HD23 ' A' ' 717' ' ' LEU . 24.2 Cg_exo -52.17 152.01 15.75 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 122.106 1.871 . . . . 0.0 111.636 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 76.9 t -80.99 -21.9 10.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.868 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -72.53 132.27 83.81 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.678 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -74.45 -30.22 8.41 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.281 1.987 . . . . 0.0 111.886 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.507 ' HG ' ' N ' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -75.69 -32.18 60.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.957 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.507 ' N ' ' HG ' ' A' ' 716' ' ' LEU . 42.3 tp -76.78 -42.91 38.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . 0.409 HG23 ' CD1' ' A' ' 724' ' ' ILE . 30.4 m -64.4 -39.41 93.79 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.72 -32.1 73.46 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.79 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -71.06 -31.43 67.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.853 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . 0.852 ' HB2' ' CE2' ' A' ' 707' ' ' PHE . . . -70.87 150.46 45.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.683 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.498 ' N ' ' O ' ' A' ' 705' ' ' VAL . 74.2 m -84.18 -26.95 28.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.148 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 159.45 5.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.359 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.409 ' CD1' HG23 ' A' ' 718' ' ' THR . 73.9 mt -142.45 131.99 22.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.157 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.581 ' O ' ' O ' ' A' ' 709' ' ' GLY . 5.3 mp -102.93 148.43 25.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.242 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 20.6 p -165.71 6.63 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.128 0.49 . . . . 0.0 110.06 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 4.4 tptt -139.22 64.12 31.53 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.953 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -55.91 126.4 22.3 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.269 1.979 . . . . 0.0 112.477 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.938 ' O ' HD12 ' A' ' 729' ' ' LEU . 0.3 OUTLIER 178.49 -14.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.907 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -143.87 75.23 16.08 Favored Pre-proline 0 CA--C 1.528 0.12 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.378 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -56.52 -9.89 4.34 Favored 'Trans proline' 0 C--N 1.303 -1.836 0 C-N-CA 122.621 2.214 . . . . 0.0 111.408 179.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.671 ' O ' ' NE2' ' A' ' 732' ' ' GLN . 0.0 OUTLIER -72.64 -22.48 60.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.438 -179.462 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.71 -47.63 68.81 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 66.9 tp -59.97 -43.96 94.75 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.676 178.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . 0.568 HD11 ' CZ ' ' A' ' 652' ' ' PHE . 24.4 tp -59.06 -38.46 79.47 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 94.1 m -60.45 -37.1 79.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.505 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 57.7 m -59.85 -47.72 84.61 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.418 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.503 ' O ' HD23 ' A' ' 738' ' ' LEU . 8.2 tt -66.73 -38.77 87.34 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.504 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.612 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.4 mm-40 -64.61 -28.92 69.95 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.916 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -55.11 3.21 0.02 OUTLIER Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.612 ' H ' ' C ' ' A' ' 739' ' ' GLN . 39.6 tp -79.14 -35.25 42.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.805 0.336 . . . . 0.0 110.906 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 57.98 62.49 5.04 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.114 0.483 . . . . 0.0 110.524 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -82.47 116.92 2.68 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 122.334 2.023 . . . . 0.0 110.836 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -84.48 151.41 11.83 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.741 2.294 . . . . 0.0 112.343 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 65.3 t30 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.035 -0.984 . . . . 0.0 110.584 -179.789 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.487 ' C ' ' H ' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -71.25 14.53 1.66 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . 0.487 ' H ' ' C ' ' A' ' 627' ' ' ALA . 3.0 m-70 -88.0 136.21 33.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.968 0.414 . . . . 0.0 110.925 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.836 ' HB ' HG12 ' A' ' 654' ' ' VAL . 78.6 mt -115.69 140.17 38.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.459 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.734 HD23 HD12 ' A' ' 667' ' ' LEU . 63.2 tp -108.76 132.08 54.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.964 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.649 HD23 ' C ' ' A' ' 632' ' ' LEU . 8.4 tt -135.19 123.32 22.88 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.189 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.719 HD22 HD22 ' A' ' 689' ' ' LEU . 9.6 mp -107.59 115.48 30.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.094 179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.481 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.9 tt0 -159.92 157.59 29.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.886 0.374 . . . . 0.0 111.177 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.654 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.1 tt0 -115.37 144.52 43.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.394 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.654 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 42.6 tp10 110.96 109.06 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.504 0 O-C-N 123.724 0.64 . . . . 0.0 110.338 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.702 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.0 p30 -66.62 -34.42 77.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.745 -179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.702 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.8 mt-10 -67.43 -50.7 58.25 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.679 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -68.23 -36.14 79.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.171 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 656' ' ' TRP . . . -68.85 -40.15 79.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.23 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 62.4 m -60.89 -47.63 85.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.023 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 92.0 t -58.11 -53.37 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.08 0.467 . . . . 0.0 110.439 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.96 -46.43 94.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.252 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.527 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.7 t -56.09 -39.96 72.9 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.574 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 40.3 tp10 -61.38 -37.32 82.97 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.529 -0.468 . . . . 0.0 109.95 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.1 mtt -66.12 -54.18 28.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.324 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.05 -43.68 78.13 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.539 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.527 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 29.3 m -55.86 -42.38 75.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.251 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.92 64.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.758 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -68.99 -4.93 18.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.611 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 90.35 -0.85 78.62 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -98.19 137.3 37.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.164 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -93.6 126.91 39.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.866 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.836 HG12 ' HB ' ' A' ' 630' ' ' ILE . 10.5 m -126.04 151.59 32.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.91 0.386 . . . . 0.0 110.986 -179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 19.1 mm -108.91 127.48 65.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.62 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.533 ' CE2' ' HB1' ' A' ' 640' ' ' ALA . 3.6 t-105 -96.16 119.3 34.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.05 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.906 HD23 ' HB2' ' A' ' 663' ' ' ALA . 16.7 tp -132.62 139.08 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.969 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 17.6 m -99.13 -7.81 9.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.143 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.573 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 93.0 m-20 -98.39 155.15 17.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.67 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -97.24 -64.14 0.9 Allowed Glycine 0 CA--C 1.529 0.957 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.95 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.8 t -57.78 -39.9 78.56 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 121.128 -0.229 . . . . 0.0 111.441 -178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 60.2 m -62.78 -37.95 88.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.936 0.398 . . . . 0.0 110.406 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.906 ' HB2' HD23 ' A' ' 657' ' ' LEU . . . -62.6 -41.3 98.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.795 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.528 HD13 ' ND1' ' A' ' 692' ' ' HIS . 61.1 mt -58.82 -47.45 84.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.065 0.459 . . . . 0.0 110.719 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -61.4 -38.82 88.47 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.688 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -83.87 -34.1 24.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.72 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.781 ' O ' HD23 ' A' ' 667' ' ' LEU . 8.1 tt -50.93 -39.25 54.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.659 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -56.06 -35.95 67.52 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 669' ' ' LEU . 74.5 mt -75.81 -30.54 59.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.459 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.58 ' CD1' HD13 ' A' ' 631' ' ' LEU . 28.4 mt -71.79 -37.41 70.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.187 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.483 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 42.2 mm-40 45.36 60.78 13.04 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.647 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 95.6 Cg_endo -89.67 157.93 5.21 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 123.43 2.754 . . . . 0.0 112.552 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.542 HG13 HG23 ' A' ' 674' ' ' VAL . 24.0 pt -97.33 -12.04 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.783 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.646 HG21 ' HG ' ' A' ' 738' ' ' LEU . 41.7 t -142.66 139.52 28.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.915 0.388 . . . . 0.0 110.928 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 73.4 mt -124.73 126.05 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.146 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.431 HD21 HD11 ' A' ' 734' ' ' LEU . 5.1 mp -104.63 137.8 41.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.737 ' SD ' ' N ' ' A' ' 678' ' ' ALA . 0.2 OUTLIER -137.22 121.97 18.67 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.209 -0.596 . . . . 0.0 112.03 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.737 ' N ' ' SD ' ' A' ' 677' ' ' MET . . . -66.63 153.91 41.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.79 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 56.9 t-105 -110.19 66.19 0.44 Allowed Pre-proline 0 C--N 1.328 -0.336 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.564 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.418 ' HD3' ' C ' ' A' ' 678' ' ' ALA . 40.2 Cg_endo -69.54 169.17 19.26 Favored 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.962 2.442 . . . . 0.0 111.454 178.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.453 ' O ' ' C ' ' A' ' 682' ' ' PRO . 2.7 Cg_endo -50.02 172.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.243 1.962 . . . . 0.0 111.225 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.703 ' O ' ' N ' ' A' ' 684' ' ' GLN . 60.3 Cg_exo -25.73 -65.52 0.05 OUTLIER 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.267 2.645 . . . . 0.0 112.989 -179.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.66 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 91.9 m-20 54.11 -70.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.482 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . 0.703 ' N ' ' O ' ' A' ' 682' ' ' PRO . 0.2 OUTLIER 103.37 -29.2 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.592 0.558 . . . . 0.0 111.113 179.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 86.5 p -66.04 -42.05 90.06 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.671 -0.411 . . . . 0.0 110.934 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 90.6 m -65.98 -36.65 83.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 110.578 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.4 mt -64.59 -32.79 74.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.869 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.819 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.95 -36.01 74.94 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.038 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.719 HD22 HD22 ' A' ' 633' ' ' LEU . 6.3 tp -59.51 -47.38 85.75 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.378 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.458 HD13 HD12 ' A' ' 693' ' ' LEU . 4.6 mm? -61.76 -41.58 97.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.388 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -60.36 -42.78 96.5 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.623 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.528 ' ND1' HD13 ' A' ' 664' ' ' LEU . 5.7 t60 -58.07 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.569 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.458 HD12 HD13 ' A' ' 690' ' ' LEU . 88.2 mt -54.56 -42.75 71.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.115 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -65.11 -34.37 78.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.358 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -68.79 -36.54 78.4 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.854 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.487 ' CD2' ' HE2' ' A' ' 692' ' ' HIS . 2.0 m-70 -79.78 -51.25 9.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.423 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.7 ' O ' ' N ' ' A' ' 699' ' ' ASP . 88.3 mt-30 -63.06 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.128 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . 59.04 -46.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.349 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.7 ' N ' ' O ' ' A' ' 697' ' ' GLN . 0.7 OUTLIER -70.62 143.8 90.4 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.089 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.471 ' O ' ' CB ' ' A' ' 701' ' ' HIS . 28.8 Cg_endo -65.13 154.16 74.81 Favored 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.983 2.455 . . . . 0.0 112.374 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.75 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 7.5 t-80 79.09 31.98 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.109 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 19.5 Cg_endo -60.95 162.58 18.64 Favored 'Trans proline' 0 C--N 1.307 -1.641 0 C-N-CA 122.605 2.204 . . . . 0.0 111.849 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . 0.439 ' HG2' ' NE2' ' A' ' 697' ' ' GLN . 2.6 Cg_endo -49.26 155.67 2.97 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.716 2.277 . . . . 0.0 111.596 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 27.0 mt -77.03 138.62 39.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.691 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 24.8 t -121.69 132.59 70.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.923 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.651 HD21 HG21 ' A' ' 737' ' ' THR . 67.9 mt -111.19 137.51 48.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.634 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -113.77 121.83 45.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.259 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.713 ' N ' HD12 ' A' ' 708' ' ' LEU . 4.1 mp -98.72 142.24 30.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.892 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 104.63 -134.3 11.93 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -92.14 157.29 41.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.946 0.403 . . . . 0.0 110.784 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -70.94 145.16 49.64 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 122.747 2.298 . . . . 0.0 111.719 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -67.72 145.81 70.67 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.636 2.224 . . . . 0.0 112.282 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.51 -40.09 19.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.29 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.7 144.53 86.03 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.373 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.38 -14.87 14.42 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 112.292 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.8 mt -70.61 -32.21 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.775 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.652 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 0.9 OUTLIER -76.67 -34.95 58.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.513 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 25.6 m -62.83 -41.88 99.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.782 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.53 -39.82 92.23 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.032 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tp60 -75.95 -28.96 58.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.579 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -73.5 126.53 30.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.949 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 84.8 p -86.61 -24.18 25.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.85 179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.602 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -170.78 126.75 0.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.386 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 54.5 mt -90.19 131.06 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.624 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.4 HD11 HD13 ' A' ' 706' ' ' LEU . 18.6 mt -107.52 155.78 19.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.902 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 2.2 p -166.48 60.86 0.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.921 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . 0.472 ' N ' ' HD3' ' A' ' 728' ' ' PRO . 15.1 tttt 57.65 61.77 5.78 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.308 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.472 ' HD3' ' N ' ' A' ' 727' ' ' LYS . 62.7 Cg_endo -86.42 145.41 8.2 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.535 ' C ' ' CG ' ' A' ' 730' ' ' ASP . 1.6 mp -67.11 151.66 47.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.51 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.679 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.0 OUTLIER 50.88 93.43 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.906 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.13 8.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.847 2.364 . . . . 0.0 111.794 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.679 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -68.02 -25.66 65.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.671 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.03 -46.78 79.89 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.618 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.451 ' C ' HD23 ' A' ' 734' ' ' LEU . 10.1 tt -58.57 -44.78 89.87 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . 0.462 HD23 ' C ' ' A' ' 735' ' ' LEU . 9.7 tt -61.73 -39.56 91.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.577 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 31.8 m -60.09 -36.85 78.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.101 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . 0.651 HG21 HD21 ' A' ' 706' ' ' LEU . 44.6 m -60.56 -46.41 90.31 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.604 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.646 ' HG ' HG21 ' A' ' 674' ' ' VAL . 6.5 mp -65.45 -39.52 92.13 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.364 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.677 ' C ' ' H ' ' A' ' 741' ' ' LEU . 6.2 tp-100 -63.86 -28.02 69.56 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.367 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.68 2.86 0.01 OUTLIER Glycine 0 CA--C 1.526 0.75 0 N-CA-C 111.501 -0.64 . . . . 0.0 111.501 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.677 ' H ' ' C ' ' A' ' 739' ' ' GLN . 20.0 tp -75.09 -36.67 61.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.1 m 54.32 68.8 2.47 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.159 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.27 116.24 3.59 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 122.198 1.932 . . . . 0.0 111.121 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -88.47 153.64 6.5 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.733 2.289 . . . . 0.0 112.282 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 28.4 t30 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 117.915 -1.04 . . . . 0.0 110.572 179.92 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.489 ' N ' ' CE1' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 79.03 40.28 17.21 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . 0.489 ' CE1' ' N ' ' A' ' 627' ' ' ALA . 58.4 m80 -88.37 135.35 33.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.944 0.402 . . . . 0.0 110.64 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.592 HG23 HG13 ' A' ' 674' ' ' VAL . 90.9 mt -112.67 138.51 41.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.286 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 17.3 tp -107.49 127.59 53.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.402 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.55 HD23 ' C ' ' A' ' 632' ' ' LEU . 9.6 tt -131.63 123.41 27.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.664 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.468 ' CD1' HD13 ' A' ' 689' ' ' LEU . 47.9 mt -106.76 124.21 49.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.902 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.521 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.2 tt0 -159.47 163.53 35.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.672 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.521 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 78.5 tt0 -105.4 159.83 15.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.576 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.483 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 84.6 tt0 68.42 117.51 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.23 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.57 ' O ' ' OG1' ' A' ' 641' ' ' THR . 4.2 p30 -63.21 -34.58 77.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.669 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.93 -45.29 82.37 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.675 -0.41 . . . . 0.0 111.214 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.83 77.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.04 0.447 . . . . 0.0 110.127 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.548 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -66.44 -35.64 80.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.595 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.57 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.0 m -62.32 -46.63 87.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.694 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 55.2 t -56.91 -51.94 61.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.552 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.97 -48.1 89.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.667 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 656' ' ' TRP . 71.7 m -67.04 -30.53 70.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.209 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 641' ' ' THR . 51.2 tp10 -61.34 -43.39 98.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.024 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 9.1 mmt -67.28 -43.88 80.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.182 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.69 -45.98 77.07 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.92 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 26.8 m -56.34 -42.83 78.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.465 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.66 -25.66 65.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.449 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.23 -4.99 28.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.365 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.55 -4.98 73.59 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -96.56 139.48 32.59 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 16.6 tttp -94.07 126.94 39.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.959 0.409 . . . . 0.0 110.43 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.2 p -130.54 142.96 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.571 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 18.7 mm -108.19 122.89 63.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.329 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.548 ' CG ' ' HB1' ' A' ' 640' ' ' ALA . 19.5 t90 -95.75 117.07 29.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.766 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 66.0 mt -118.57 147.49 43.64 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 658' ' ' VAL . 3.6 p -110.12 20.64 5.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.265 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -149.44 123.67 9.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.677 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.35 -40.03 96.95 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.544 -0.623 . . . . 0.0 111.544 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 55.5 p -60.26 -38.72 84.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.081 0.467 . . . . 0.0 110.17 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.3 m -65.23 -35.46 81.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.902 179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.78 -45.1 91.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.228 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 44.6 mt -59.75 -41.06 90.14 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.558 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -63.0 -42.72 99.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.145 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.425 ' O ' HD23 ' A' ' 670' ' ' LEU . 96.5 mm-40 -86.25 -42.6 13.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.973 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 663' ' ' ALA . 1.1 tt -45.24 -44.67 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.889 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -61.97 -34.54 76.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.513 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 50.8 mt -78.4 -45.94 21.11 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.4 OUTLIER -83.49 -13.55 54.38 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.183 -0.607 . . . . 0.0 112.07 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.456 ' C ' ' O ' ' A' ' 670' ' ' LEU . 1.5 mt-30 38.24 74.82 0.61 Allowed Pre-proline 0 C--N 1.327 -0.393 0 C-N-CA 120.375 -0.53 . . . . 0.0 109.997 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -76.89 146.39 26.08 Favored 'Trans proline' 0 C--N 1.304 -1.809 0 C-N-CA 122.84 2.36 . . . . 0.0 112.289 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 21.8 pt -92.55 -13.13 8.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.592 HG13 HG23 ' A' ' 630' ' ' ILE . 14.5 p -145.02 139.06 22.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.215 179.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.432 HD11 HE22 ' A' ' 697' ' ' GLN . 63.3 mt -124.16 125.09 70.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.934 0.397 . . . . 0.0 111.204 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.511 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.4 mp -105.26 136.9 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 178.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.431 ' CE ' HD12 ' A' ' 633' ' ' LEU . 92.5 mtp -140.36 117.58 11.29 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.731 -179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.405 ' C ' ' HD3' ' A' ' 680' ' ' PRO . . . -67.59 153.02 44.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.981 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.425 ' NE1' ' HA ' ' A' ' 712' ' ' PRO . 6.2 t-105 -120.98 57.97 6.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.209 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.444 ' O ' ' CB ' ' A' ' 683' ' ' ASP . 72.5 Cg_endo -77.0 152.78 31.97 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.891 2.394 . . . . 0.0 111.591 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.655 ' C ' ' H ' ' A' ' 683' ' ' ASP . 1.7 Cg_endo -51.11 -57.45 2.23 Favored 'Trans proline' 0 C--N 1.303 -1.848 0 C-N-CA 122.292 1.994 . . . . 0.0 112.523 179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.487 ' HD2' ' CD ' ' A' ' 681' ' ' PRO . 10.0 Cg_endo -53.55 6.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.333 2.022 . . . . 0.0 111.987 179.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.655 ' H ' ' C ' ' A' ' 681' ' ' PRO . 56.8 t0 -76.45 148.93 36.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . 0.555 ' N ' ' OD1' ' A' ' 683' ' ' ASP . 10.3 pt20 -175.18 -43.85 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 34.1 t -64.09 -30.14 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.024 0.44 . . . . 0.0 110.382 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 87.6 m -58.84 -23.58 60.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.953 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 75.2 mt -63.68 -37.97 89.36 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.508 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.697 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.8 OUTLIER -71.23 -39.55 71.6 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.249 -0.581 . . . . 0.0 110.941 -179.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.494 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 10.0 tt -60.84 -42.07 97.07 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.621 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 83.5 mt -60.48 -45.9 92.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.184 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -63.15 -40.99 99.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.199 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -60.27 -60.94 3.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.833 0.349 . . . . 0.0 110.884 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.798 ' C ' HD12 ' A' ' 693' ' ' LEU . 0.4 OUTLIER -55.46 -39.87 70.89 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.948 -179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.5 ' N ' ' HG ' ' A' ' 693' ' ' LEU . 79.3 ttt180 -65.02 -33.86 77.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.026 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . 0.475 ' HG2' ' CE1' ' A' ' 696' ' ' HIS . 78.2 tt0 -65.64 -36.66 84.33 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.276 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.475 ' CE1' ' HG2' ' A' ' 695' ' ' GLU . 0.4 OUTLIER 165.81 72.95 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.117 179.363 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.432 HE22 HD11 ' A' ' 675' ' ' ILE . 64.0 tt0 -61.56 -52.07 65.95 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.923 0.392 . . . . 0.0 110.634 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.536 ' C ' ' OD1' ' A' ' 699' ' ' ASP . . . -158.34 -13.84 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.985 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.536 ' OD1' ' C ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER -174.74 160.55 2.5 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -179.672 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.1 -10.07 5.43 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.863 2.376 . . . . 0.0 112.276 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.474 ' ND1' ' N ' ' A' ' 701' ' ' HIS . 3.0 m80 -123.96 75.57 57.96 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.087 0.47 . . . . 0.0 110.818 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -54.25 149.71 35.79 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 123.055 2.503 . . . . 0.0 112.403 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.2 173.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.579 2.186 . . . . 0.0 111.784 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.706 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.3 OUTLIER -77.15 137.36 38.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.461 HG12 ' CE1' ' A' ' 707' ' ' PHE . 44.1 t -122.05 131.18 73.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.067 0.46 . . . . 0.0 111.896 -179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.749 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.8 mp -112.35 134.63 53.77 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.731 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . 0.461 ' CE1' HG12 ' A' ' 705' ' ' VAL . 90.2 m-85 -115.64 129.92 56.67 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.465 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.411 ' O ' ' N ' ' A' ' 679' ' ' TRP . 62.0 mt -106.11 140.49 39.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.884 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 117.32 -142.86 17.65 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -92.52 165.83 18.42 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.027 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.37 154.96 10.35 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.418 2.079 . . . . 0.0 112.022 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.425 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 17.0 Cg_endo -60.06 169.22 5.04 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 123.076 2.518 . . . . 0.0 112.129 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.561 HG12 ' O ' ' A' ' 713' ' ' VAL . 42.7 t -80.53 0.36 3.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.297 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . 0.511 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.0 OUTLIER -161.8 143.05 8.33 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -64.02 -10.98 25.11 Favored 'Trans proline' 0 C--N 1.308 -1.59 0 C-N-CA 122.694 2.263 . . . . 0.0 112.431 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.584 HD22 ' N ' ' A' ' 716' ' ' LEU . 3.5 mm? -69.52 -35.3 75.35 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.313 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.85 -31.43 59.31 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.8 m -60.98 -44.23 97.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.665 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.68 -37.12 85.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.871 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -77.37 -19.97 55.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.669 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.76 137.79 49.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.14 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.433 ' CB ' ' H ' ' A' ' 705' ' ' VAL . 67.3 m -86.26 -29.77 22.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.584 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.88 105.65 0.2 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.063 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 60.1 mt -93.13 129.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.658 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.476 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.4 mp -111.36 97.94 7.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 110.32 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 50.2 p -75.42 0.22 17.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.664 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -126.63 89.4 52.25 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.927 -179.657 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.634 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 49.0 Cg_exo -51.99 154.65 9.86 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 123.016 2.477 . . . . 0.0 112.533 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.634 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 1.5 tp 98.15 -157.41 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.272 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 50.18 62.76 11.22 Favored Pre-proline 0 C--N 1.328 -0.33 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.765 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.86 -19.43 62.02 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.445 2.097 . . . . 0.0 111.714 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.62 -36.31 65.44 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.151 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -70.13 -50.03 44.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.327 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 10.5 tp -58.02 -42.16 84.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.885 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 26.3 tp -62.84 -39.04 93.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.145 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 29.6 m -58.48 -47.62 83.47 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.412 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 56.9 m -65.15 -40.87 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.578 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.539 HD11 HG11 ' A' ' 674' ' ' VAL . 5.7 tt -64.09 -45.72 87.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.657 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.672 ' O ' ' N ' ' A' ' 741' ' ' LEU . 98.1 mt-30 -66.08 -27.7 68.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.103 0.478 . . . . 0.0 109.955 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . 0.505 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -27.75 -33.01 0.01 OUTLIER Glycine 0 CA--C 1.523 0.552 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.432 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.676 ' N ' HD12 ' A' ' 741' ' ' LEU . 6.3 mp -84.89 -73.05 0.45 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.852 0.358 . . . . 0.0 110.163 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.417 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 51.4 t 56.94 62.1 6.21 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.588 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 70.9 Cg_endo -82.92 117.01 2.54 Favored 'Trans proline' 0 C--N 1.303 -1.858 0 C-N-CA 122.569 2.179 . . . . 0.0 111.404 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -88.55 -8.79 5.15 Favored 'Trans proline' 0 C--N 1.309 -1.54 0 C-N-CA 122.639 2.226 . . . . 0.0 112.63 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 31.5 m120 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.527 179.984 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 72.13 124.84 0.07 OUTLIER Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -95.72 134.02 39.14 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 64.7 mt -116.92 136.71 53.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 120.966 0.413 . . . . 0.0 110.461 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.927 HD22 ' CD1' ' A' ' 667' ' ' LEU . 21.1 tp -104.66 129.96 52.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.659 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 8.0 tt -127.47 121.96 32.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.183 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.869 HD12 ' O ' ' A' ' 657' ' ' LEU . 12.2 tp -110.17 121.51 45.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.429 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.541 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 85.9 tt0 -159.47 165.97 31.93 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.195 -0.602 . . . . 0.0 111.345 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.541 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 94.4 mt-10 -107.62 160.65 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.97 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 71.31 108.14 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.403 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 27.1 p-10 -57.19 -37.74 72.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.073 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.596 ' O ' HG23 ' A' ' 642' ' ' VAL . 85.7 tt0 -63.76 -43.15 97.26 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.857 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.6 -36.92 70.98 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.67 179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.483 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.04 -42.64 80.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.023 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 645' ' ' GLU . 31.6 m -63.26 -45.84 89.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.801 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 638' ' ' GLU . 86.5 t -56.62 -53.55 39.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.825 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.05 -47.59 92.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.403 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.525 ' O ' ' OG1' ' A' ' 648' ' ' THR . 70.2 m -65.35 -29.91 70.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.111 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . 0.46 ' N ' ' O ' ' A' ' 641' ' ' THR . 73.8 tt0 -61.55 -45.81 92.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.671 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 92.0 mmm -70.27 -42.86 71.54 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.784 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.616 ' CB ' HG21 ' A' ' 654' ' ' VAL . 73.5 mt -66.73 -43.01 85.36 Favored 'General case' 0 CA--C 1.522 -0.121 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.525 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 83.5 m -55.71 -40.15 72.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.28 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.81 -21.2 61.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.531 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 647' ' ' LEU . . . -65.19 -5.1 6.03 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.809 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 102.45 -19.23 48.81 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.506 -0.638 . . . . 0.0 111.506 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -98.46 152.32 19.65 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.98 129.65 37.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.988 0.423 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.616 HG21 ' CB ' ' A' ' 647' ' ' LEU . 16.2 t -119.85 133.21 67.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 27.1 mm -108.95 135.87 46.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.61 ' C ' HD22 ' A' ' 657' ' ' LEU . 23.3 t90 -89.85 114.02 25.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.514 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.869 ' O ' HD12 ' A' ' 633' ' ' LEU . 4.6 mm? -112.27 136.24 51.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.047 0.451 . . . . 0.0 110.288 179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.61 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 4.4 p -117.42 19.95 6.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.994 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.61 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 89.4 m-20 -150.62 174.27 13.17 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.457 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -105.14 -63.47 0.65 Allowed Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.421 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 23.0 t -57.69 -36.99 72.69 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 51.1 m -62.86 -39.34 94.1 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.552 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.59 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -63.46 -39.67 95.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.585 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.431 ' HA ' HD23 ' A' ' 664' ' ' LEU . 61.9 mt -59.34 -39.42 83.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.003 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -62.78 -47.5 83.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.379 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -89.71 -42.68 11.19 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.731 -0.387 . . . . 0.0 111.683 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.927 ' CD1' HD22 ' A' ' 631' ' ' LEU . 8.6 tt -50.13 -36.78 31.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.041 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -56.22 -36.66 68.7 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.844 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 39.4 mt -77.47 -26.41 51.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.304 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 37.6 mt -73.05 -32.93 65.38 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.687 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.446 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 39.3 mm-40 46.3 58.87 16.15 Favored Pre-proline 0 N--CA 1.464 0.231 0 CA-C-O 121.207 0.527 . . . . 0.0 110.167 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.446 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 50.9 Cg_endo -74.06 150.07 42.48 Favored 'Trans proline' 0 C--N 1.302 -1.921 0 C-N-CA 123.459 2.773 . . . . 0.0 112.83 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.747 HG13 HG23 ' A' ' 674' ' ' VAL . 24.6 pt -100.54 -19.49 5.9 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.747 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.747 HG23 HG13 ' A' ' 673' ' ' ILE . 76.8 t -137.12 137.51 46.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.416 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 631' ' ' LEU . 65.9 mt -127.25 118.65 50.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 8.8 tt -105.1 130.81 53.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.838 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.449 ' HE3' HD22 ' A' ' 689' ' ' LEU . 61.4 mtt -138.53 133.1 32.18 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.481 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -71.0 150.84 45.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.695 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.783 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -116.88 -24.79 0.1 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 C-N-CA 120.274 -0.571 . . . . 0.0 112.302 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.783 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -48.61 -39.71 37.6 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 121.887 1.724 . . . . 0.0 113.14 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 15.0 Cg_exo -65.43 155.29 69.57 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.653 1.568 . . . . 0.0 111.799 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -53.55 -19.41 13.7 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.284 1.989 . . . . 0.0 112.093 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 61.55 161.2 0.07 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.507 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 179.77 -80.43 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.148 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 31.3 m -63.11 -32.87 74.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.573 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 5.9 p -60.94 -24.12 65.81 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.748 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.44 -35.3 80.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.559 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 1.0 OUTLIER -73.47 -37.77 65.65 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.308 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.559 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 8.4 tt -61.7 -46.94 87.54 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.79 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.402 HD21 ' SD ' ' A' ' 677' ' ' MET . 82.6 mt -63.04 -42.42 99.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.515 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.12 -39.59 93.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.828 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -57.9 -53.55 56.92 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.801 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 697' ' ' GLN . 57.0 mt -55.82 -37.68 69.0 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.531 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.674 ' NE ' ' OE1' ' A' ' 720' ' ' GLN . 0.0 OUTLIER -64.78 -40.28 94.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.096 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -69.52 -39.2 77.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.754 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.413 ' O ' ' HG3' ' A' ' 700' ' ' PRO . 15.9 m170 -100.16 8.07 44.11 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.721 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.428 ' OE1' ' CZ ' ' A' ' 694' ' ' ARG . 24.5 pt20 -52.69 -19.39 2.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.643 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -87.25 118.77 26.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.817 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.643 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 44.6 t0 107.17 -39.99 0.0 OUTLIER Pre-proline 0 N--CA 1.47 0.548 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 178.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.482 ' CD ' ' C ' ' A' ' 698' ' ' ALA . 72.4 Cg_endo -84.13 -158.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.312 -1.379 0 C-N-CA 121.936 1.757 . . . . 0.0 112.072 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -116.23 90.55 29.59 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.642 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -43.95 108.87 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.617 0 C-N-CA 122.966 2.444 . . . . 0.0 112.589 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -74.81 151.14 40.13 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.164 1.91 . . . . 0.0 112.069 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 48.0 mt -74.95 139.97 43.38 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' A' ' 722' ' ' SER . 46.1 t -123.73 129.04 74.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.918 -179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.552 ' C ' HD23 ' A' ' 706' ' ' LEU . 9.2 tt -116.22 133.58 55.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.935 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . 0.515 ' N ' HD23 ' A' ' 706' ' ' LEU . 97.2 m-85 -116.22 137.51 52.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.01 0.434 . . . . 0.0 111.614 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 708' ' ' LEU . 80.6 mt -99.77 154.76 18.06 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.037 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 84.89 -132.9 11.38 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -87.21 151.83 51.96 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.764 0.316 . . . . 0.0 111.076 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -64.21 165.38 19.73 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 123.059 2.506 . . . . 0.0 112.325 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -62.51 160.47 31.75 Favored 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.868 2.378 . . . . 0.0 112.138 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.538 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.1 t -91.06 23.21 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.472 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . 0.538 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 12.7 m-20 -161.3 141.71 8.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.038 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -70.27 -15.62 35.22 Favored 'Trans proline' 0 N--CA 1.495 1.572 0 C-N-CA 122.801 2.334 . . . . 0.0 112.972 -178.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.535 ' H ' HD12 ' A' ' 716' ' ' LEU . 5.9 mp -69.77 -35.28 74.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.024 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 89.1 mt -75.46 -31.53 60.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 45.4 m -64.22 -43.91 93.52 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.14 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.12 -40.11 95.49 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.088 0.47 . . . . 0.0 109.956 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.674 ' OE1' ' NE ' ' A' ' 694' ' ' ARG . 31.8 tt0 -73.62 -29.28 62.26 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.813 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -68.59 140.45 55.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.94 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 705' ' ' VAL . 34.5 t -87.28 -28.13 22.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.292 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.68 168.54 6.21 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.186 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 53.2 mt -151.17 113.01 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.086 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.624 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.6 mp -105.89 136.53 45.37 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.132 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.0 t -69.17 -81.01 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -103.39 128.36 27.68 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -68.64 142.29 52.75 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 121.997 1.798 . . . . 0.0 112.006 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 20.2 tp -176.38 138.8 0.32 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.404 -179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 732' ' ' GLN . 0.4 OUTLIER 57.72 74.13 0.68 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.763 -179.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.92 -5.19 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 122.492 2.128 . . . . 0.0 111.691 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.568 ' H ' ' C ' ' A' ' 730' ' ' ASP . 98.2 mt-30 -69.84 -30.26 67.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.219 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 27.1 tp -66.7 -45.31 79.21 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 25.5 tp -57.26 -41.66 80.09 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 32.2 tp -62.3 -40.37 96.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.208 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 87.9 m -59.28 -40.64 86.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.292 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 26.1 m -61.08 -41.76 97.25 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.154 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.37 -44.29 95.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.012 0.434 . . . . 0.0 110.374 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.519 ' C ' ' H ' ' A' ' 741' ' ' LEU . 98.7 mm-40 -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.568 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -59.0 4.77 0.09 OUTLIER Glycine 0 CA--C 1.529 0.914 0 C-N-CA 121.211 -0.519 . . . . 0.0 111.92 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.519 ' H ' ' C ' ' A' ' 739' ' ' GLN . 27.0 tp -81.76 -29.57 32.76 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 117.0 0.4 . . . . 0.0 110.284 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.48 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 23.5 t 63.55 61.71 1.72 Allowed Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.345 179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.48 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 58.7 Cg_endo -86.65 117.52 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.761 0 C-N-CA 122.714 2.276 . . . . 0.0 110.929 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -85.83 150.02 9.79 Favored 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.514 2.142 . . . . 0.0 112.677 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.92 -1.038 . . . . 0.0 110.416 179.338 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -76.59 148.24 35.1 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.606 -0.998 . . . . 0.0 110.606 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -94.84 139.04 31.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.863 0.363 . . . . 0.0 111.296 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.498 ' CG2' HD13 ' A' ' 676' ' ' LEU . 89.9 mt -114.3 145.56 19.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.289 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.898 HD22 HD12 ' A' ' 667' ' ' LEU . 10.1 tp -107.69 134.5 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.765 0.317 . . . . 0.0 110.69 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' ' 633' ' ' LEU . 0.2 OUTLIER -129.13 116.9 19.93 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 632' ' ' LEU . 6.6 tt -109.41 120.38 42.32 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 178.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.505 ' N ' HD23 ' A' ' 633' ' ' LEU . 85.6 tt0 -159.41 153.96 24.22 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.479 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.658 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 82.6 tt0 -112.68 138.81 48.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.174 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.658 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 81.8 tt0 106.02 115.62 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.69 0.619 . . . . 0.0 110.381 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -60.65 -37.08 80.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.044 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -67.46 -50.1 60.65 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.301 -179.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -66.51 -38.37 87.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.973 0.416 . . . . 0.0 110.526 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.641 ' O ' ' SG ' ' A' ' 644' ' ' CYS . . . -68.54 -38.78 81.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.808 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 53.1 m -62.67 -44.39 96.37 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.782 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 76.9 t -56.85 -54.05 34.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.458 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 55.9 t -60.81 -41.26 87.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.452 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.772 ' SG ' ' CZ3' ' A' ' 656' ' ' TRP . 91.3 m -55.78 -43.47 76.8 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.454 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -61.17 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 90.1 mtp -68.08 -50.73 53.22 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.594 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 650' ' ' ALA . 74.8 mt -68.25 -43.54 77.65 Favored 'General case' 0 C--N 1.333 -0.138 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.143 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 90.5 m -56.43 -42.27 77.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.089 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -65.98 -28.7 69.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.372 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 647' ' ' LEU . . . -63.51 -17.03 62.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 86.5 2.68 84.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -95.04 149.17 21.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.052 0.453 . . . . 0.0 111.002 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -92.22 123.47 35.58 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.848 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.434 HG12 ' HB ' ' A' ' 630' ' ' ILE . 5.4 m -126.34 150.05 31.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.815 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 26.9 mm -108.49 125.45 65.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.772 ' CZ3' ' SG ' ' A' ' 644' ' ' CYS . 0.5 OUTLIER -95.24 125.71 40.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.108 0.48 . . . . 0.0 111.383 -179.073 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 663' ' ' ALA . 86.7 mt -124.45 143.52 50.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.457 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 7.6 m -101.15 2.91 10.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.048 0.452 . . . . 0.0 109.989 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.406 ' OD1' ' C ' ' A' ' 659' ' ' ASP . 57.1 p30 -153.21 173.62 15.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.909 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.415 ' O ' ' HG ' ' A' ' 664' ' ' LEU . . . -102.23 -35.25 3.96 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.144 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 13.3 m -55.8 -44.29 77.68 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.863 0.363 . . . . 0.0 110.959 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 70.2 m -62.69 -36.78 84.03 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.66 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.25 -38.7 92.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.597 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 660' ' ' GLY . 18.3 mt -57.75 -47.68 81.8 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.881 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -63.83 -40.86 97.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.532 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -89.78 -54.56 4.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.947 0.403 . . . . 0.0 111.757 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.898 HD12 HD22 ' A' ' 631' ' ' LEU . 8.1 tt -45.05 -39.17 5.48 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.73 -178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -55.33 -37.28 67.21 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.655 -0.818 . . . . 0.0 109.535 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 40.0 mt -78.17 -30.94 49.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.627 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 13.9 mt -71.91 -38.45 69.91 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.636 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 48.01 66.34 5.81 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -78.36 160.64 29.04 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 C-N-CA 123.133 2.556 . . . . 0.0 113.156 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 74.7 mt -96.25 -23.03 4.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.098 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 40.6 t -143.73 140.12 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 120.872 0.368 . . . . 0.0 111.114 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.864 HG22 ' SD ' ' A' ' 677' ' ' MET . 76.0 mt -126.46 121.89 59.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.032 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 676' ' ' LEU . 2.8 mp -114.75 133.91 55.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.864 ' SD ' HG22 ' A' ' 675' ' ' ILE . 3.5 mpp? -138.87 139.17 38.02 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.54 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.24 146.16 53.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.603 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.776 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 1.1 t-105 -132.1 14.25 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.776 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 6.6 Cg_exo -50.89 -44.17 43.13 Favored 'Trans proline' 0 C--N 1.316 -1.166 0 C-N-CA 121.423 1.415 . . . . 0.0 112.353 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 40.7 Cg_endo -86.88 164.31 8.91 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 123.098 2.532 . . . . 0.0 112.827 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -71.04 -65.1 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.621 0 C-N-CA 122.969 2.446 . . . . 0.0 111.937 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.462 ' OD1' ' O ' ' A' ' 683' ' ' ASP . 50.2 p30 -82.5 156.91 23.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . 0.515 ' O ' HD12 ' A' ' 687' ' ' LEU . 49.5 tt0 -177.48 135.96 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.381 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . 0.428 ' C ' ' N ' ' A' ' 687' ' ' LEU . 37.0 m -61.18 -27.99 68.81 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.856 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.718 ' SG ' ' CZ3' ' A' ' 679' ' ' TRP . 25.8 p -52.84 -14.17 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.01 0.434 . . . . 0.0 109.867 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 684' ' ' GLN . 32.3 mt -64.22 -38.92 92.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.777 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.495 ' HG ' ' N ' ' A' ' 689' ' ' LEU . 2.3 pp -70.46 -35.59 73.4 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.495 ' N ' ' HG ' ' A' ' 688' ' ' LEU . 22.4 tp -57.84 -42.95 85.46 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.308 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.426 HD23 HD12 ' A' ' 693' ' ' LEU . 47.1 mt -62.18 -36.46 81.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.021 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . 0.412 ' HG3' HH21 ' A' ' 694' ' ' ARG . 49.8 tt0 -56.79 -41.75 78.27 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.434 179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 29.3 t-80 -59.96 -48.98 79.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.292 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 697' ' ' GLN . 40.8 mt -54.81 -40.36 69.44 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.718 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.412 HH21 ' HG3' ' A' ' 691' ' ' GLN . 66.2 mtm180 -63.97 -35.45 80.73 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -69.38 -35.94 76.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.012 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.616 ' CG ' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER -104.33 5.28 34.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.216 -179.122 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.488 ' N ' ' O ' ' A' ' 693' ' ' LEU . 48.6 tt0 -58.45 -7.37 0.89 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.031 0.443 . . . . 0.0 110.144 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.416 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . -81.86 1.03 36.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.563 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.22 144.79 95.49 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.037 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -64.74 -8.29 17.23 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 C-N-CA 122.621 2.214 . . . . 0.0 112.836 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -126.8 68.99 71.27 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.825 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -44.99 107.87 0.12 Allowed 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.598 2.199 . . . . 0.0 111.898 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -60.62 135.86 63.28 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.312 2.008 . . . . 0.0 112.45 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.711 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.5 mp -80.87 141.91 34.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.998 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.795 HG23 ' O ' ' A' ' 675' ' ' ILE . 14.6 p -130.57 136.3 58.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.336 0.588 . . . . 0.0 110.998 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.819 HD12 ' O ' ' A' ' 723' ' ' ALA . 12.4 tp -118.45 133.1 56.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.948 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -110.02 130.33 55.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.014 0.435 . . . . 0.0 111.487 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 52.4 mt -99.67 147.0 25.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.414 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 99.05 -131.58 10.62 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.639 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.2 162.92 35.98 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.21 151.93 20.85 Favored 'Trans proline' 0 C--N 1.309 -1.513 0 C-N-CA 122.631 2.22 . . . . 0.0 112.616 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.404 ' CB ' ' HB2' ' A' ' 717' ' ' LEU . 58.5 Cg_exo -45.06 171.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.891 2.394 . . . . 0.0 112.868 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.683 HG12 ' O ' ' A' ' 713' ' ' VAL . 96.9 t -83.63 3.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.118 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . 0.533 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.1 OUTLIER -161.68 152.77 15.3 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.029 0.443 . . . . 0.0 110.817 -179.588 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -69.63 -8.8 24.53 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.941 2.427 . . . . 0.0 112.41 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 46.3 tp -69.45 -34.35 74.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.665 ' N ' ' CD2' ' A' ' 717' ' ' LEU . 1.6 mm? -77.22 -36.04 55.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 37.7 m -62.56 -41.78 99.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.864 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.95 92.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.209 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -75.59 -28.9 59.1 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . 0.419 ' HA ' ' CG1' ' A' ' 705' ' ' VAL . . . -69.67 153.78 42.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.849 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 57.6 p -85.18 -31.61 23.14 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.819 ' O ' HD12 ' A' ' 706' ' ' LEU . . . -174.35 151.1 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.403 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.463 ' C ' HD12 ' A' ' 725' ' ' LEU . 65.6 mt -133.15 127.91 55.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.93 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.797 ' CD1' HD11 ' A' ' 706' ' ' LEU . 8.9 mp -105.09 158.8 16.32 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.86 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.43 9.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.518 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . 0.46 ' CB ' ' HZ3' ' A' ' 727' ' ' LYS . 0.0 OUTLIER -132.85 92.58 25.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.498 179.633 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.52 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 53.2 Cg_exo -47.48 149.18 4.69 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.611 2.208 . . . . 0.0 112.415 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 59.3 mt 98.85 172.99 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.132 0.895 . . . . 0.0 110.148 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.51 ' N ' ' OD1' ' A' ' 730' ' ' ASP . 0.0 OUTLIER 61.77 62.81 2.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.054 179.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -64.36 -8.46 16.92 Favored 'Trans proline' 0 C--N 1.306 -1.683 0 C-N-CA 122.918 2.412 . . . . 0.0 112.272 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -69.4 -29.71 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.209 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 11.4 tp -66.63 -43.01 85.86 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.461 ' CD1' HD22 ' A' ' 706' ' ' LEU . 53.0 tp -57.97 -43.72 86.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.301 179.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.08 -38.6 86.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 75.5 m -57.66 -41.46 81.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.3 m -62.23 -46.46 88.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.497 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 63.1 mt -66.06 -40.12 90.65 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.994 0.426 . . . . 0.0 110.262 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 741' ' ' LEU . 41.9 tt0 -66.21 -21.04 66.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.593 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.1 -2.73 0.01 OUTLIER Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.664 ' N ' ' O ' ' A' ' 739' ' ' GLN . 69.7 mt -84.11 -75.93 0.32 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 6.3 t 56.91 60.73 7.17 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.25 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -79.46 116.8 3.62 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 C-N-CA 122.122 1.881 . . . . 0.0 110.934 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -83.66 144.44 11.21 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.59 2.193 . . . . 0.0 112.705 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 2.3 m120 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.491 -179.911 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 141.35 153.43 5.95 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . 0.433 ' HB2' HD11 ' A' ' 670' ' ' LEU . 72.9 m80 -94.64 136.75 34.58 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.499 ' CD1' HD22 ' A' ' 647' ' ' LEU . 75.6 mt -117.19 135.74 56.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.874 0.369 . . . . 0.0 111.054 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.555 HD13 HD12 ' A' ' 667' ' ' LEU . 8.4 tt -109.03 128.65 55.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.784 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.711 HD23 ' C ' ' A' ' 632' ' ' LEU . 8.6 tt -127.16 127.38 44.46 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.952 0.406 . . . . 0.0 111.913 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.497 ' N ' HD23 ' A' ' 632' ' ' LEU . 44.6 tp -108.74 111.76 23.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.768 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.842 ' OE1' ' HB2' ' A' ' 678' ' ' ALA . 45.9 tp10 -160.28 156.9 27.14 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.933 0.397 . . . . 0.0 111.229 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 634' ' ' GLU . 85.4 tt0 -96.53 156.25 16.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.942 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.475 ' N ' ' HG2' ' A' ' 635' ' ' GLU . 77.6 tt0 71.72 119.57 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.262 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 40.9 p-10 -62.99 -31.91 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.021 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.534 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 96.3 mt-10 -65.0 -40.83 95.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.336 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.84 62.3 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.918 0.389 . . . . 0.0 110.644 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -62.06 -35.28 78.15 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.946 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.41 ' O ' ' N ' ' A' ' 645' ' ' GLU . 86.6 m -62.79 -44.82 95.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.935 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 43.5 t -55.19 -53.12 38.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.448 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 58.4 t -60.77 -43.26 94.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.207 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.556 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.0 OUTLIER -67.39 -30.67 70.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.921 -179.676 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . 0.41 ' N ' ' O ' ' A' ' 641' ' ' THR . 41.6 tp10 -61.4 -45.49 94.11 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.163 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 93.6 mmm -65.3 -44.29 88.39 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.912 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.936 HD21 HD21 ' A' ' 734' ' ' LEU . 34.6 mt -67.71 -43.45 80.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.252 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.556 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.5 m -55.9 -42.04 75.42 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -62.83 -32.34 73.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.329 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.43 -6.34 45.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.827 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 92.46 -0.21 70.82 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.293 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -91.61 148.25 22.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 117.073 0.436 . . . . 0.0 110.829 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -91.05 130.73 36.92 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.68 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.437 HG21 ' HB2' ' A' ' 647' ' ' LEU . 24.6 t -116.86 137.06 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.257 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.42 127.13 66.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.703 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . . . . . . . . . 17.4 t90 -95.49 114.51 26.28 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 111.355 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . . . . . . . . . 53.1 mt -116.46 145.23 43.44 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 2.4 p -116.17 10.86 7.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.183 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -149.64 128.25 12.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.459 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.472 ' HA2' HD23 ' A' ' 689' ' ' LEU . . . -61.49 -38.09 95.22 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 15.0 m -59.2 -38.59 80.24 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.843 -179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 86.4 m -63.91 -40.31 96.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.859 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.562 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.7 -41.88 98.18 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.848 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.511 HD22 ' CE1' ' A' ' 692' ' ' HIS . 54.3 mt -59.2 -43.5 92.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.985 0.421 . . . . 0.0 110.81 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -63.94 -38.75 92.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.376 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' A' ' 670' ' ' LEU . 25.5 mt-30 -89.68 -49.86 6.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.083 0.468 . . . . 0.0 111.037 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.1 tt -46.08 -46.2 16.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.427 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.597 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 52.3 t0 -62.6 -41.08 98.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.154 0.502 . . . . 0.0 110.124 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 72.7 mt -77.2 -36.88 54.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.361 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 1.052 HD12 ' O ' ' A' ' 670' ' ' LEU . 0.1 OUTLIER -82.25 -39.99 22.23 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.137 -179.327 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 3.4 mt-30 54.08 75.38 0.63 Allowed Pre-proline 0 C--N 1.331 -0.211 0 CA-C-O 121.262 0.553 . . . . 0.0 110.236 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.33 165.3 32.13 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 123.684 2.923 . . . . 0.0 112.463 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 75.3 mt -93.25 -26.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.163 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.426 HG13 HG23 ' A' ' 630' ' ' ILE . 10.9 p -142.68 138.62 28.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.069 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 71.9 mt -116.6 129.42 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.179 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.49 HD13 ' O ' ' A' ' 706' ' ' LEU . 0.0 OUTLIER -106.5 130.43 54.28 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 38.9 ttm -141.08 137.59 32.97 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.236 -0.586 . . . . 0.0 112.317 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.842 ' HB2' ' OE1' ' A' ' 634' ' ' GLU . . . -67.66 153.06 44.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.495 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.76 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 37.9 t-105 -103.53 -19.82 0.19 Allowed Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.788 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.76 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 85.9 Cg_endo -85.51 121.45 2.24 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.966 1.778 . . . . 0.0 110.937 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -74.94 111.97 3.45 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.422 2.081 . . . . 0.0 112.748 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.8 -18.49 2.96 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.833 2.355 . . . . 0.0 111.061 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.531 ' O ' ' HB2' ' A' ' 684' ' ' GLN . 22.3 t70 -160.31 -11.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.43 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . 0.531 ' HB2' ' O ' ' A' ' 683' ' ' ASP . 90.3 mt-30 100.89 2.03 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 O-C-N 124.092 0.87 . . . . 0.0 110.873 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 21.9 m -65.13 -37.67 88.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.77 0.319 . . . . 0.0 111.158 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 78.8 m -62.13 -34.22 75.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 87.3 mt -64.95 -32.83 74.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.186 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.734 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.2 -37.13 77.95 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.237 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.623 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.2 OUTLIER -62.16 -41.55 98.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.245 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.799 HD13 ' C ' ' A' ' 690' ' ' LEU . 3.0 tm? -59.82 -40.63 89.1 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.384 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.47 -42.63 96.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.781 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.511 ' CE1' HD22 ' A' ' 664' ' ' LEU . 24.0 t-80 -57.73 -50.18 74.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.505 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.447 HD13 HG21 ' A' ' 705' ' ' VAL . 79.4 mt -54.95 -39.74 69.21 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.558 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.449 ' HG3' ' NE2' ' A' ' 697' ' ' GLN . 34.1 ttp180 -62.74 -33.55 75.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.646 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -67.5 -35.99 80.21 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.084 -179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -91.13 -3.36 57.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.212 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.449 ' NE2' ' HG3' ' A' ' 694' ' ' ARG . 1.0 OUTLIER -58.92 -11.89 3.87 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.925 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -84.75 0.73 49.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 110.681 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.36 166.36 35.54 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.324 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -56.62 -54.99 3.09 Favored 'Trans proline' 0 C--N 1.308 -1.576 0 C-N-CA 122.214 1.943 . . . . 0.0 111.959 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -135.87 72.9 61.17 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.827 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -48.4 158.23 1.1 Allowed 'Trans proline' 0 C--N 1.306 -1.697 0 C-N-CA 122.637 2.225 . . . . 0.0 111.874 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.19 151.56 43.99 Favored 'Trans proline' 0 C--N 1.304 -1.79 0 C-N-CA 122.816 2.344 . . . . 0.0 112.021 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.8 mp -77.51 140.13 39.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.138 179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.616 ' O ' ' N ' ' A' ' 722' ' ' SER . 44.4 t -120.29 127.73 75.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.113 0.482 . . . . 0.0 111.097 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.624 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 5.5 mp -118.84 134.63 55.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.694 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -110.05 130.93 55.46 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.947 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.668 HD12 ' C ' ' A' ' 708' ' ' LEU . 0.9 OUTLIER -101.05 140.48 35.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . 0.429 ' N ' HD12 ' A' ' 708' ' ' LEU . . . 119.12 -131.77 9.25 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -88.57 158.24 48.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.768 0.318 . . . . 0.0 110.352 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -75.14 116.31 4.52 Favored 'Trans proline' 0 C--N 1.304 -1.778 0 C-N-CA 122.786 2.324 . . . . 0.0 112.127 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.45 ' HD2' HD13 ' A' ' 724' ' ' ILE . 51.5 Cg_exo -49.88 142.59 25.8 Favored 'Trans proline' 0 N--CA 1.493 1.483 0 C-N-CA 122.371 2.048 . . . . 0.0 111.997 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 93.3 t -82.75 -20.09 9.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.811 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.4 128.22 89.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.673 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -73.14 -30.14 10.95 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 122.213 1.942 . . . . 0.0 111.635 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.86 -35.12 69.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.208 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.613 ' CD2' ' CZ3' ' A' ' 679' ' ' TRP . 66.1 tp -73.3 -37.7 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.55 -179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . 0.493 HG23 HD11 ' A' ' 724' ' ' ILE . 33.2 m -63.48 -40.07 96.14 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.527 -0.469 . . . . 0.0 109.857 179.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.09 89.82 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.352 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -74.69 -29.62 61.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.441 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -69.13 139.59 54.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.522 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.616 ' N ' ' O ' ' A' ' 705' ' ' VAL . 80.5 p -85.25 -28.59 25.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.502 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.624 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -173.93 121.51 0.31 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.208 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.493 HD11 HG23 ' A' ' 718' ' ' THR . 54.3 mt -91.65 124.14 44.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.893 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.582 HD11 HD13 ' A' ' 734' ' ' LEU . 59.9 mt -103.14 124.37 48.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.726 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 5.1 m -72.93 -79.96 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.746 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 3.2 mttm -142.84 167.4 16.21 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.176 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -60.99 119.65 6.92 Favored 'Trans proline' 0 C--N 1.31 -1.466 0 C-N-CA 121.81 1.673 . . . . 0.0 111.477 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.691 ' O ' HD23 ' A' ' 729' ' ' LEU . 7.1 tt -178.65 -40.69 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.823 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 730' ' ' ASP . 0.0 OUTLIER -129.82 72.17 81.99 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.955 0.407 . . . . 0.0 110.909 -179.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -71.55 7.49 1.52 Allowed 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.866 2.378 . . . . 0.0 111.9 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.478 ' HG3' ' N ' ' A' ' 733' ' ' LEU . 21.5 pt20 -71.92 -36.22 69.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.455 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . 0.478 ' N ' ' HG3' ' A' ' 732' ' ' GLN . 14.4 tp -66.93 -42.91 84.54 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.078 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.936 HD21 HD21 ' A' ' 647' ' ' LEU . 14.2 tp -56.63 -50.14 72.91 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.42 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 85.6 mt -62.27 -37.12 84.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.147 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 66.1 m -59.0 -40.33 84.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.349 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 86.5 m -61.26 -47.5 85.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.622 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.529 HD12 ' N ' ' A' ' 738' ' ' LEU . 7.0 mp -66.28 -45.08 81.69 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.511 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -66.35 -28.21 68.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.276 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.25 -36.9 16.94 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 111.259 -0.737 . . . . 0.0 111.259 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 78.8 mt -79.78 -37.93 34.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 49.05 63.99 9.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.573 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -81.24 116.49 3.04 Favored 'Trans proline' 0 C--N 1.304 -1.803 0 C-N-CA 122.154 1.903 . . . . 0.0 111.169 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -88.42 -3.41 6.74 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.51 2.14 . . . . 0.0 112.188 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.518 -179.824 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 103.28 68.77 0.79 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -89.81 136.1 33.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.773 0.321 . . . . 0.0 110.525 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.4 mm -112.11 134.78 53.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.661 -179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.689 ' CD2' HD12 ' A' ' 667' ' ' LEU . 56.1 tp -114.11 136.01 53.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.746 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.827 HD23 ' C ' ' A' ' 632' ' ' LEU . 6.8 tt -133.96 125.1 27.51 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.443 -0.503 . . . . 0.0 112.038 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.742 ' N ' HD23 ' A' ' 632' ' ' LEU . 9.3 tt -118.9 127.74 53.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.751 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.796 ' CD ' ' HB2' ' A' ' 640' ' ' ALA . 0.0 OUTLIER -159.06 171.57 19.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.974 0.416 . . . . 0.0 111.028 -179.509 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -107.33 163.2 13.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.28 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 66.75 118.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.402 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -58.21 -37.33 74.61 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.185 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -64.91 -41.82 95.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.083 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -65.45 -39.11 91.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.906 0.384 . . . . 0.0 110.448 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.796 ' HB2' ' CD ' ' A' ' 634' ' ' GLU . . . -66.7 -39.51 88.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.727 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 59.6 m -62.06 -47.05 86.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.006 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.6 t -57.38 -53.67 40.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 111.03 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . 0.665 HG11 HD11 ' A' ' 632' ' ' LEU . 61.1 t -60.53 -42.82 92.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.904 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.656 ' SG ' ' O ' ' A' ' 640' ' ' ALA . 74.9 m -56.89 -36.78 70.52 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -62.35 -40.07 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.293 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 16.3 mmt -65.38 -50.25 66.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.962 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.605 ' N ' HD12 ' A' ' 647' ' ' LEU . 10.0 mp -70.35 -45.55 65.88 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.434 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 48.5 m -55.87 -42.98 76.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.038 179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.06 65.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.581 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.42 -11.3 60.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.18 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.12 -3.88 67.14 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.73 149.24 21.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.647 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 26.0 mttp -93.36 127.73 39.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.019 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 14.5 p -126.52 142.0 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.966 -179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . 0.424 HG22 ' CD2' ' A' ' 657' ' ' LEU . 14.9 mm -103.5 133.67 46.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.726 ' C ' HD22 ' A' ' 657' ' ' LEU . 16.4 t90 -91.42 112.82 24.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.979 0.418 . . . . 0.0 111.509 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.726 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.8 mm? -111.93 138.49 48.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.89 179.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 35.4 m -110.88 8.51 8.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.952 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.465 ' C ' HD11 ' A' ' 633' ' ' LEU . 18.6 t70 -150.48 130.82 13.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.51 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.449 ' CA ' HD23 ' A' ' 689' ' ' LEU . . . -63.63 -45.09 95.42 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.269 -0.491 . . . . 0.0 111.99 -179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 19.8 m -60.84 -44.71 96.6 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 111.117 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.9 m -64.55 -35.15 80.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.076 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -61.04 -43.19 99.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.465 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.906 HD22 ' ND1' ' A' ' 692' ' ' HIS . 90.8 mt -59.73 -47.26 86.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.348 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . 0.554 ' OD1' ' C ' ' A' ' 665' ' ' ASP . 0.5 OUTLIER -64.48 -37.55 87.92 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.97 -179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.544 ' N ' ' OD1' ' A' ' 665' ' ' ASP . 23.8 mt-30 -83.36 -43.77 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.702 HD23 ' C ' ' A' ' 667' ' ' LEU . 9.8 tt -48.57 -36.46 15.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.48 -179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -54.62 -39.83 68.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.022 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 73.6 mt -78.3 -27.65 47.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.357 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 15.7 mt -73.06 -38.82 66.33 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.594 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.437 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 80.4 mm-40 46.35 63.74 9.3 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 74.4 Cg_endo -83.56 152.95 13.54 Favored 'Trans proline' 0 C--N 1.304 -1.781 0 C-N-CA 123.227 2.618 . . . . 0.0 112.61 -178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.77 HG23 HG23 ' A' ' 674' ' ' VAL . 19.5 tt -93.46 -18.75 6.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.272 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.77 HG23 HG23 ' A' ' 673' ' ' ILE . 59.7 t -145.24 137.57 20.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-O 121.01 0.434 . . . . 0.0 110.938 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.428 ' O ' HG23 ' A' ' 705' ' ' VAL . 59.3 mt -126.08 122.49 61.79 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.011 -179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.616 HD12 ' N ' ' A' ' 676' ' ' LEU . 4.5 mp -109.66 133.73 52.78 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 76.1 mtm -144.69 133.79 22.76 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.987 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.401 ' O ' ' HD3' ' A' ' 680' ' ' PRO . . . -66.14 154.13 40.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.786 178.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . . . . . . . . . 6.1 t-105 -117.05 80.45 11.55 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.78 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.409 ' C ' ' HD2' ' A' ' 682' ' ' PRO . 90.1 Cg_endo -94.7 114.61 0.19 Allowed 'Trans proline' 0 C--N 1.31 -1.489 0 C-N-CA 123.426 2.751 . . . . 0.0 112.142 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.55 ' N ' ' CD ' ' A' ' 682' ' ' PRO . 20.3 Cg_exo -53.79 -42.59 65.1 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.207 1.938 . . . . 0.0 112.324 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.599 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 31.9 Cg_exo -52.73 -5.17 0.17 Allowed 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.02 1.813 . . . . 0.0 111.033 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.599 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 83.2 m-20 -150.44 73.67 1.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.874 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -64.16 8.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.629 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . 0.539 ' H ' ' C ' ' A' ' 683' ' ' ASP . 43.8 m -59.75 -27.47 66.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.806 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.421 ' O ' HD23 ' A' ' 690' ' ' LEU . 85.6 m -57.01 -23.19 44.49 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.539 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 82.0 mt -63.76 -32.92 74.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.363 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.655 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.7 OUTLIER -69.68 -36.28 75.85 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.468 -179.676 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.634 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.2 OUTLIER -61.63 -43.24 99.23 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.155 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.514 HD11 ' CZ ' ' A' ' 707' ' ' PHE . 3.8 mm? -60.83 -36.87 80.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.01 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -60.05 -43.55 95.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.906 ' ND1' HD22 ' A' ' 664' ' ' LEU . 15.5 t-80 -59.15 -49.75 76.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.511 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.14 -40.38 70.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.29 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.413 ' NH2' HD21 ' A' ' 717' ' ' LEU . 37.8 ttm180 -61.99 -33.8 74.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.985 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -67.08 -33.78 76.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.416 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.574 ' O ' ' OD1' ' A' ' 699' ' ' ASP . 96.1 m-70 -100.66 5.98 43.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.626 -179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -57.1 -4.47 0.19 Allowed 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.421 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.484 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . -84.52 4.65 30.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.164 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 696' ' ' HIS . 1.0 OUTLIER -70.4 145.66 93.31 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.264 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -67.52 -15.8 45.85 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.653 2.235 . . . . 0.0 113.028 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.494 ' ND1' ' N ' ' A' ' 701' ' ' HIS . 0.0 OUTLIER -127.06 69.01 73.03 Favored Pre-proline 0 C--N 1.329 -0.319 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.386 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -46.14 113.25 0.57 Allowed 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.687 2.258 . . . . 0.0 111.576 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.81 146.2 23.36 Favored 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.798 2.332 . . . . 0.0 113.201 -179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.712 ' N ' HD12 ' A' ' 704' ' ' LEU . 6.4 mp -81.5 143.89 31.73 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.659 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.662 ' C ' HD12 ' A' ' 706' ' ' LEU . 12.3 p -133.25 137.89 52.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.53 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.851 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.3 mp -119.37 135.56 54.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.25 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . 0.514 ' CZ ' HD11 ' A' ' 690' ' ' LEU . 95.3 m-85 -117.88 131.5 56.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.689 -179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 54.6 mt -99.89 142.52 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.805 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 726' ' ' SER . . . 110.71 -140.85 16.16 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -87.09 152.95 53.92 Favored Pre-proline 0 C--N 1.328 -0.326 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.523 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -74.19 153.1 45.85 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.547 2.165 . . . . 0.0 112.482 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -48.38 162.4 0.33 Allowed 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.757 2.305 . . . . 0.0 112.863 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 2.2 t -84.46 16.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.056 179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.63 148.21 11.27 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.983 -179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.83 -10.76 23.46 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.766 2.311 . . . . 0.0 112.958 -178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.672 ' N ' ' CD2' ' A' ' 716' ' ' LEU . 0.9 OUTLIER -70.58 -37.34 73.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.5 -179.63 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.413 HD21 ' NH2' ' A' ' 694' ' ' ARG . 48.1 mt -78.09 -38.8 43.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 86.7 m -63.8 -40.61 97.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.852 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.91 89.22 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.24 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -76.57 -25.36 53.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.357 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.4 146.69 48.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 19.0 t -85.38 -27.36 25.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.669 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -169.84 154.77 5.45 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.165 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 39.0 mt -148.98 120.03 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.063 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 25.4 mt -104.23 115.12 29.84 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.784 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 709' ' ' GLY . 8.8 m -70.08 -36.65 75.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.663 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -134.74 96.38 14.9 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.505 -179.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -48.11 133.53 23.95 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.282 1.988 . . . . 0.0 111.861 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 16.6 tp -176.39 138.53 0.31 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.419 ' C ' ' H ' ' A' ' 732' ' ' GLN . 29.6 m-20 62.06 75.69 0.42 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.734 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -52.54 -9.3 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.715 2.277 . . . . 0.0 111.77 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 730' ' ' ASP . 93.1 mt-30 -69.89 -35.79 74.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 32.6 tp -67.3 -39.75 85.98 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 13.0 tp -57.32 -41.04 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 4.2 tt -63.05 -38.95 93.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.752 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 71.9 m -59.2 -46.83 87.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.968 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 91.8 m -63.43 -41.68 98.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.583 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.688 HD23 ' SG ' ' A' ' 742' ' ' CYS . 9.8 tt -63.32 -37.92 89.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.106 0.479 . . . . 0.0 110.045 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 741' ' ' LEU . 6.7 tt0 -64.84 -30.43 71.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.797 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.42 -5.06 0.01 OUTLIER Glycine 0 CA--C 1.527 0.824 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.16 -178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.674 ' N ' ' O ' ' A' ' 739' ' ' GLN . 19.1 tp -156.93 -41.5 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.361 -0.536 . . . . 0.0 111.194 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.688 ' SG ' HD23 ' A' ' 738' ' ' LEU . 1.4 m 28.82 -84.45 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.314 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.83 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.61 ' N ' ' O ' ' A' ' 741' ' ' LEU . 17.3 Cg_endo -58.14 121.32 9.8 Favored 'Trans proline' 0 N--CA 1.493 1.451 0 CA-C-N 120.276 1.134 . . . . 0.0 111.325 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . 0.405 ' HB3' HD12 ' A' ' 673' ' ' ILE . 98.0 Cg_endo -81.12 -4.19 12.49 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.577 2.185 . . . . 0.0 112.313 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . 0.507 ' OD1' ' O ' ' A' ' 745' ' ' ASN . 10.2 p30 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.366 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -161.37 -174.76 31.63 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 50.7 m170 -88.13 163.59 16.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.754 0.311 . . . . 0.0 110.538 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 65.4 mt -111.58 141.74 26.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.959 -179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.79 HD13 ' C ' ' A' ' 631' ' ' LEU . 2.8 tm? -110.96 123.75 50.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.309 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.778 ' N ' HD13 ' A' ' 631' ' ' LEU . 10.2 tt -123.1 126.66 47.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.993 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 41.8 tp -111.13 117.08 32.29 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.498 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 84.2 tt0 -159.7 159.91 33.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.729 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.599 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 84.7 tt0 -106.91 141.08 38.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.382 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.599 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 28.6 tp10 93.23 115.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.443 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.7 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 57.3 p30 -63.6 -29.66 70.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.7 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 49.5 tp10 -63.81 -47.2 81.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.941 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.37 -43.51 66.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.977 0.418 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.45 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -65.14 -40.49 94.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.128 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 645' ' ' GLU . 90.3 m -61.73 -45.35 94.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.924 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 52.1 t -55.89 -52.0 54.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.237 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.53 -46.7 95.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.726 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . . . . . . . . . 72.6 m -69.36 -32.99 72.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.015 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 641' ' ' THR . 85.0 tt0 -60.23 -43.48 96.01 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.575 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 73.6 mtp -71.25 -40.73 70.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.367 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.44 ' HA ' HD23 ' A' ' 647' ' ' LEU . 83.1 mt -67.84 -45.45 74.6 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.679 -0.408 . . . . 0.0 109.958 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . . . . . . . . . 30.0 m -56.16 -42.59 77.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.72 -31.07 69.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.492 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -75.7 -1.97 27.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.535 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 84.64 10.42 79.42 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -94.92 136.14 35.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.796 0.331 . . . . 0.0 110.439 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -95.82 121.52 37.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.933 0.396 . . . . 0.0 110.847 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 13.0 p -136.6 140.24 43.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.313 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 2.7 mp -109.47 128.69 65.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.45 ' CG ' ' HB1' ' A' ' 640' ' ' ALA . 26.3 t90 -95.38 117.64 30.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.342 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.58 HD11 HE21 ' A' ' 666' ' ' GLN . 69.2 mt -118.69 150.79 39.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.542 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.632 ' O ' HG22 ' A' ' 658' ' ' VAL . 14.5 p -103.91 7.36 9.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.267 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.8 t0 -148.09 119.98 8.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -55.78 -35.85 64.15 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . 0.52 ' HA ' HD12 ' A' ' 664' ' ' LEU . 37.5 m -58.88 -40.42 84.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.881 0.372 . . . . 0.0 110.467 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 53.2 m -63.76 -38.66 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.128 0.49 . . . . 0.0 109.872 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.581 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -62.31 -40.27 95.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.973 179.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.6 HD21 HD12 ' A' ' 689' ' ' LEU . 60.7 mt -59.94 -37.58 79.94 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.636 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -63.04 -44.59 95.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.319 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.58 HE21 HD11 ' A' ' 657' ' ' LEU . 6.2 mt-30 -90.38 -41.68 11.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.155 0.502 . . . . 0.0 110.623 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.581 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.5 tt -47.0 -46.02 21.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.27 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -61.85 -35.19 77.54 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.488 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 45.1 mt -76.97 -44.21 32.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.237 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.41 ' O ' ' C ' ' A' ' 671' ' ' GLN . 0.9 OUTLIER -83.55 -12.83 55.67 Favored 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.629 -178.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.421 HE22 HE22 ' A' ' 697' ' ' GLN . 37.4 mm-40 40.09 74.36 0.72 Allowed Pre-proline 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.35 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.463 ' CD ' ' HG ' ' A' ' 667' ' ' LEU . 56.2 Cg_endo -73.14 150.79 48.54 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.909 2.406 . . . . 0.0 112.448 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.82 HG13 HG23 ' A' ' 674' ' ' VAL . 27.5 pt -95.3 -12.13 8.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.461 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.82 HG23 HG13 ' A' ' 673' ' ' ILE . 88.4 t -140.13 134.77 36.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.304 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.3 mt -128.7 124.91 62.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.982 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.3 mp -103.38 143.59 32.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.932 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.46 ' HE1' ' SG ' ' A' ' 686' ' ' CYS . 80.3 mtp -139.12 116.25 11.03 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.002 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.72 146.19 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.003 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.778 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 20.6 t-105 -118.22 -35.67 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.74 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.778 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 26.0 Cg_exo -54.0 -42.54 65.96 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.252 1.968 . . . . 0.0 113.053 -179.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.511 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 74.1 Cg_endo -84.47 157.26 12.48 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.312 2.008 . . . . 0.0 112.07 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -48.54 -81.01 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.702 2.268 . . . . 0.0 111.528 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 686' ' ' CYS . 85.4 m-20 53.35 57.13 6.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.587 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -53.67 -32.0 49.9 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.891 0.377 . . . . 0.0 110.26 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 17.3 m -67.37 -28.83 68.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.212 179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.46 ' SG ' ' HE1' ' A' ' 677' ' ' MET . 4.5 t -57.19 -29.55 63.79 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.286 -179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 61.5 mt -65.88 -38.16 88.06 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.751 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.756 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.4 OUTLIER -70.45 -37.89 74.4 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.468 -179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.6 HD12 HD21 ' A' ' 664' ' ' LEU . 9.7 tp -60.07 -41.56 92.68 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.831 HD13 ' C ' ' A' ' 690' ' ' LEU . 3.1 tm? -59.72 -42.73 93.73 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.515 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -60.29 -43.33 96.37 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.821 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -59.29 -51.65 69.03 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.085 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 74.2 mt -54.24 -43.33 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.275 0.56 . . . . 0.0 109.822 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -65.31 -30.56 71.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.106 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 696' ' ' HIS . 40.6 tp10 -65.3 -50.96 63.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.441 -178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.511 ' CD2' ' O ' ' A' ' 696' ' ' HIS . 0.6 OUTLIER 173.67 66.76 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.72 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.421 HE22 HE22 ' A' ' 671' ' ' GLN . 3.4 tm0? -57.79 -46.73 84.21 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.174 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.607 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . -160.93 78.51 0.6 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.728 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.607 ' O ' ' O ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER 44.18 179.23 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 120.737 -0.385 . . . . 0.0 109.987 -179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 699' ' ' ASP . 50.9 Cg_exo -50.03 148.17 13.81 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.168 1.912 . . . . 0.0 111.895 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.576 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 11.6 m170 62.7 46.84 0.85 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.637 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 12.2 Cg_endo -59.04 169.23 3.74 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 C-N-CA 122.9 2.4 . . . . 0.0 111.92 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -47.17 155.01 1.13 Allowed 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.938 2.426 . . . . 0.0 111.861 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.433 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 34.0 mt -76.69 146.53 38.01 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.737 ' C ' HD12 ' A' ' 706' ' ' LEU . 13.7 p -123.74 135.72 62.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 121.22 0.533 . . . . 0.0 110.931 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.809 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.3 mp -122.16 138.14 54.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.654 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -107.3 130.08 54.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.908 0.385 . . . . 0.0 110.188 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 1.159 HD12 ' N ' ' A' ' 709' ' ' GLY . 0.1 OUTLIER -94.9 136.88 34.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.392 -179.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . 1.159 ' N ' HD12 ' A' ' 708' ' ' LEU . . . 99.62 -132.74 11.04 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 111.316 -0.714 . . . . 0.0 111.316 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -90.01 149.39 41.56 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 120.886 0.374 . . . . 0.0 110.67 -179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.518 ' HB3' HG21 ' A' ' 724' ' ' ILE . 57.1 Cg_endo -73.75 151.27 45.98 Favored 'Trans proline' 0 C--N 1.307 -1.626 0 C-N-CA 122.866 2.378 . . . . 0.0 112.158 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -61.53 157.39 41.81 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 122.675 2.25 . . . . 0.0 111.789 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 80.5 t -77.98 -38.54 24.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.795 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -72.73 136.27 80.5 Favored Pre-proline 0 C--N 1.33 -0.257 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.562 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -74.76 -12.88 22.09 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 C-N-CA 122.596 2.197 . . . . 0.0 112.495 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 67.4 mt -70.86 -31.44 68.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.07 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 61.4 mt -76.48 -33.71 58.68 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 62.2 m -63.11 -42.48 99.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.885 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.77 91.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.354 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -78.55 -22.63 46.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.729 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.97 138.09 47.77 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.453 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.433 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 22.2 t -85.56 -26.79 25.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.147 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.526 ' HB3' ' HG ' ' A' ' 706' ' ' LEU . . . -169.19 152.43 5.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.518 HG21 ' HB3' ' A' ' 711' ' ' PRO . 69.3 mt -130.11 128.83 65.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.012 0.434 . . . . 0.0 110.642 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.529 ' O ' ' O ' ' A' ' 709' ' ' GLY . 58.1 mt -104.59 149.76 25.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.143 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . 0.428 ' H ' ' H ' ' A' ' 727' ' ' LYS . 55.7 p -165.45 -2.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.81 0.338 . . . . 0.0 110.626 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . 0.428 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.3 OUTLIER -127.07 81.9 69.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.828 179.447 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.654 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.5 Cg_exo -49.67 147.99 12.65 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.061 2.507 . . . . 0.0 112.57 -179.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.654 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 15.9 tp 105.5 154.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.945 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 732' ' ' GLN . 17.3 t0 63.19 62.65 1.71 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 28.6 Cg_exo -57.44 -0.06 0.3 Allowed 'Trans proline' 0 C--N 1.307 -1.647 0 C-N-CA 122.869 2.379 . . . . 0.0 111.868 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 730' ' ' ASP . 12.1 mm100 -69.91 -29.77 67.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.595 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.66 -45.84 81.4 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.555 HD11 HD22 ' A' ' 706' ' ' LEU . 37.6 tp -58.37 -40.87 83.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.573 178.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.6 -38.72 88.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.265 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 28.3 m -57.76 -40.24 79.27 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 82.9 m -60.96 -40.91 95.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.011 179.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.711 HD11 HG21 ' A' ' 674' ' ' VAL . 4.1 mm? -64.63 -38.38 90.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.949 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -63.49 -35.19 79.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -62.2 -11.25 31.92 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . . . . . . . . . 53.3 tp -81.67 -21.21 38.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.992 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.2 m 59.46 69.6 1.27 Allowed Pre-proline 0 CA--C 1.519 -0.224 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -54.39 116.3 2.97 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.72 1.613 . . . . 0.0 109.93 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -87.0 154.33 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.506 2.137 . . . . 0.0 112.794 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 38.8 t30 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.563 -179.793 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 106.99 118.41 4.36 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -90.89 148.99 22.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.076 0.465 . . . . 0.0 111.042 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 22.6 mm -112.18 134.92 53.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.202 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.817 HD13 ' N ' ' A' ' 632' ' ' LEU . 1.0 OUTLIER -107.44 124.61 50.12 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.237 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.817 ' N ' HD13 ' A' ' 631' ' ' LEU . 9.1 tt -131.33 127.05 36.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.648 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.859 HD22 ' SG ' ' A' ' 686' ' ' CYS . 6.7 tt -109.47 116.3 31.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.127 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.499 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 82.9 tt0 -159.97 158.15 30.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.599 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.519 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 22.2 pt-20 -100.5 162.46 12.92 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.519 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.8 tp10 83.56 112.65 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.844 0.354 . . . . 0.0 110.458 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.686 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 93.2 m-20 -63.9 -36.0 82.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.625 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.414 ' CG ' ' N ' ' A' ' 639' ' ' ALA . 5.3 pt-20 -67.21 -37.33 83.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.138 -178.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.414 ' N ' ' CG ' ' A' ' 638' ' ' GLU . . . -71.29 -45.3 63.42 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.388 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.453 ' HB1' ' HB2' ' A' ' 656' ' ' TRP . . . -66.89 -35.68 80.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.749 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 89.5 m -62.29 -48.08 81.49 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.741 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.79 -47.43 82.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.147 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . 0.544 HG11 HD13 ' A' ' 632' ' ' LEU . 57.4 t -61.07 -42.74 94.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.581 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.705 ' SG ' HG13 ' A' ' 654' ' ' VAL . 0.8 OUTLIER -62.43 -45.64 92.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -61.78 -38.38 87.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.905 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 32.2 ttp -64.96 -52.34 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.796 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.408 ' N ' HD12 ' A' ' 647' ' ' LEU . 8.0 mp -68.46 -46.42 69.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.45 . . . . 0.0 109.961 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.577 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.0 m -55.66 -39.86 71.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.773 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.24 -29.36 68.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.776 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -79.33 -3.18 44.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.02 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.71 -10.11 68.61 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . 0.592 ' CG ' HD13 ' A' ' 738' ' ' LEU . 81.9 m-85 -94.46 130.02 40.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 41.7 tptt -94.71 133.33 38.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.402 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.705 HG13 ' SG ' ' A' ' 644' ' ' CYS . 9.0 p -131.0 140.88 47.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.194 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 11.5 mm -103.01 134.02 45.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.686 ' CH2' ' OD1' ' A' ' 637' ' ' ASP . 9.5 t90 -93.21 115.11 27.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.65 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.607 HD11 HD21 ' A' ' 631' ' ' LEU . 54.3 mt -114.84 141.57 47.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.685 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.606 ' CG2' ' CZ2' ' A' ' 656' ' ' TRP . 40.2 t -98.39 -0.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.777 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.571 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 74.4 m-20 -150.76 146.91 26.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.789 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -69.32 -40.62 80.46 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.104 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 95.9 p -59.43 -37.93 79.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.718 0.294 . . . . 0.0 111.215 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 88.5 m -62.17 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.086 0.469 . . . . 0.0 109.787 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.617 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.77 -43.21 97.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.005 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 33.1 mt -56.58 -45.51 81.29 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.831 -179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 88.9 m-20 -64.08 -43.61 94.9 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.836 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.404 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 27.7 mt-30 -86.67 -52.6 5.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.091 0.472 . . . . 0.0 111.226 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.76 ' O ' HD23 ' A' ' 667' ' ' LEU . 8.6 tt -45.08 -37.83 4.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.139 -178.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.559 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 21.4 p-10 -56.26 -40.02 73.53 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.047 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.518 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 33.7 mt -79.3 -26.94 42.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.733 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 10.6 mt -72.23 -41.95 66.27 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.422 -178.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 51.76 67.53 4.04 Favored Pre-proline 0 C--N 1.328 -0.332 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.64 159.13 25.18 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 123.41 2.74 . . . . 0.0 113.369 -178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 61.1 mt -95.1 -23.37 5.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.988 179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 17.3 t -143.54 139.39 26.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.556 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.603 HG23 ' HB3' ' A' ' 631' ' ' LEU . 63.5 mt -124.1 130.89 73.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.982 0.42 . . . . 0.0 111.539 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.735 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -105.06 146.11 29.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.699 178.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.36 119.22 14.22 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.328 -0.549 . . . . 0.0 111.529 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -68.95 144.96 54.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.597 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.786 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 1.8 t-105 -118.16 -32.36 0.07 OUTLIER Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.786 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.1 Cg_exo -49.33 -41.09 43.6 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 C-N-CA 122.001 1.801 . . . . 0.0 112.769 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 11.0 Cg_exo -67.44 159.43 52.44 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 122.287 1.991 . . . . 0.0 111.513 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -55.39 -7.38 1.24 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.518 2.145 . . . . 0.0 111.349 179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.642 ' O ' ' CB ' ' A' ' 684' ' ' GLN . 13.6 t70 56.27 -129.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.458 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . 0.642 ' CB ' ' O ' ' A' ' 683' ' ' ASP . 3.3 tm0? 100.84 -78.31 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.372 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 60.5 p -66.88 -26.75 67.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.965 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.859 ' SG ' HD22 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -61.25 -22.04 64.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.562 179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 81.9 mt -62.72 -34.41 77.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.422 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 77.1 mt -67.76 -38.03 82.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.677 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 49.7 tp -59.17 -47.64 84.57 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.03 0.443 . . . . 0.0 110.215 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.472 HD12 ' H ' ' A' ' 690' ' ' LEU . 6.5 mp -62.16 -32.88 73.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.62 179.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -60.29 -41.53 93.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.658 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.643 ' NE2' ' ND1' ' A' ' 696' ' ' HIS . 19.1 t-160 -56.93 -49.53 75.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.45 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.472 HD21 HD12 ' A' ' 675' ' ' ILE . 97.0 mt -56.32 -41.31 75.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.691 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 -63.18 -39.82 95.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.948 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -69.78 -32.26 70.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.771 -0.371 . . . . 0.0 110.81 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.643 ' ND1' ' NE2' ' A' ' 692' ' ' HIS . 55.1 m170 -107.38 15.49 24.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.315 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.419 ' N ' ' O ' ' A' ' 693' ' ' LEU . 21.9 pt20 -59.62 -22.84 62.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.363 . . . . 0.0 110.422 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -84.55 2.31 41.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.379 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -69.72 140.2 89.11 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.702 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.01 144.64 94.17 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.22 1.947 . . . . 0.0 112.214 -179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.621 ' O ' ' CG ' ' A' ' 701' ' ' HIS . 9.5 t-160 51.31 60.44 14.35 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.023 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.444 ' HD3' ' N ' ' A' ' 701' ' ' HIS . 53.0 Cg_exo -46.74 142.39 10.35 Favored 'Trans proline' 0 C--N 1.303 -1.846 0 C-N-CA 122.998 2.465 . . . . 0.0 112.093 -179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.85 149.08 32.89 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.579 2.186 . . . . 0.0 112.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.617 ' H ' HD12 ' A' ' 704' ' ' LEU . 5.3 mp -78.69 145.98 34.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 109.963 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 58.6 t -121.61 126.39 74.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.017 0.437 . . . . 0.0 111.087 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.917 HD22 ' HB3' ' A' ' 723' ' ' ALA . 44.6 mt -117.66 140.1 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.396 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -111.92 132.16 54.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.443 HD11 HD11 ' A' ' 632' ' ' LEU . 23.9 mt -94.84 148.29 22.46 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.391 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . 0.445 ' O ' ' OG ' ' A' ' 726' ' ' SER . . . 69.63 -119.51 9.21 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -89.4 148.57 40.79 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.854 0.359 . . . . 0.0 110.851 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.804 ' HB3' HD13 ' A' ' 724' ' ' ILE . 73.9 Cg_endo -76.0 161.05 36.3 Favored 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.182 2.588 . . . . 0.0 112.937 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -63.7 154.21 70.61 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 123.252 2.635 . . . . 0.0 111.91 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 92.7 t -79.44 -34.77 16.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.53 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.44 127.61 92.71 Favored Pre-proline 0 CA--C 1.531 0.224 0 C-N-CA 120.894 -0.323 . . . . 0.0 110.24 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -69.63 -25.12 29.53 Favored 'Trans proline' 0 N--CA 1.492 1.411 0 C-N-CA 122.015 1.81 . . . . 0.0 112.324 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.676 HD22 ' N ' ' A' ' 716' ' ' LEU . 3.7 mm? -71.49 -33.89 69.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 85.5 mt -78.13 -36.0 48.34 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 721' ' ' ALA . 91.9 m -64.33 -44.91 90.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.919 178.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.05 -36.77 82.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.366 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -77.78 -6.9 55.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.114 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 718' ' ' THR . . . -73.98 144.27 45.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.245 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.419 ' CB ' ' HB3' ' A' ' 704' ' ' LEU . 38.0 m -85.45 -33.47 21.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.443 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.917 ' HB3' HD22 ' A' ' 706' ' ' LEU . . . -171.5 131.83 0.74 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.143 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.804 HD13 ' HB3' ' A' ' 711' ' ' PRO . 78.0 mt -92.8 123.94 45.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.68 179.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.6 mt -109.52 150.91 27.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.657 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 709' ' ' GLY . 0.7 OUTLIER -168.27 -57.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 179.774 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -103.58 145.31 30.38 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.295 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.3 149.39 88.46 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.722 2.281 . . . . 0.0 111.707 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.512 ' O ' HD23 ' A' ' 729' ' ' LEU . 7.0 tt -177.87 85.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.696 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.619 ' C ' ' H ' ' A' ' 732' ' ' GLN . 39.0 m-20 53.49 86.71 0.16 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.307 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -50.17 -0.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.568 2.179 . . . . 0.0 111.753 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.619 ' H ' ' C ' ' A' ' 730' ' ' ASP . 97.1 mt-30 -68.12 -28.87 67.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.482 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.5 tp -64.46 -44.16 91.97 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.676 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.8 tp -59.37 -43.51 92.87 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 76.9 mt -61.73 -39.58 92.05 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.688 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . 0.459 ' O ' ' N ' ' A' ' 740' ' ' GLY . 58.4 m -60.16 -39.8 87.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.62 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 30.2 m -59.36 -46.15 89.44 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.581 -0.448 . . . . 0.0 109.949 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.592 HD13 ' CG ' ' A' ' 652' ' ' PHE . 87.9 mt -68.03 -50.71 53.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.981 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.405 ' O ' ' N ' ' A' ' 742' ' ' CYS . 25.4 mt-30 -66.94 -27.25 67.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.344 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 736' ' ' THR . . . -49.83 -29.89 14.15 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.731 ' N ' HD12 ' A' ' 741' ' ' LEU . 5.5 mp -83.97 -16.8 42.76 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.456 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.405 ' N ' ' O ' ' A' ' 739' ' ' GLN . 57.1 m 53.43 60.92 11.43 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.404 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 72.5 Cg_endo -82.93 116.22 2.46 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.321 2.014 . . . . 0.0 111.075 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -86.06 145.91 8.77 Favored 'Trans proline' 0 C--N 1.308 -1.554 0 C-N-CA 122.867 2.378 . . . . 0.0 112.945 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . 0.649 HD22 ' C ' ' A' ' 745' ' ' ASN . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.518 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 157.06 -133.15 3.47 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -90.72 136.59 32.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.774 0.321 . . . . 0.0 110.407 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.82 HG23 HG13 ' A' ' 674' ' ' VAL . 74.3 mt -114.93 135.79 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 667' ' ' LEU . 8.1 tt -122.46 125.51 45.96 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.519 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.566 HD12 ' N ' ' A' ' 632' ' ' LEU . 4.5 mp -117.28 135.2 54.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.127 179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.461 ' HB3' ' SG ' ' A' ' 686' ' ' CYS . 5.0 mp -107.96 111.41 23.48 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.65 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.529 ' HA ' HE22 ' A' ' 684' ' ' GLN . 87.2 tt0 -160.05 157.08 28.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.646 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.644 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 94.1 mt-10 -111.07 150.63 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.105 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.644 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 72.8 tt0 103.76 102.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.666 0.604 . . . . 0.0 109.705 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.512 ' O ' ' OG1' ' A' ' 641' ' ' THR . 54.4 t0 -56.19 -36.08 67.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.637 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -64.32 -40.52 96.07 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.706 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.65 -45.49 52.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.937 0.398 . . . . 0.0 110.449 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.514 ' HB2' ' NE1' ' A' ' 656' ' ' TRP . . . -65.2 -38.79 91.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.913 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 58.2 m -62.37 -46.48 88.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.844 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . . . . . . . . . 42.1 t -56.24 -53.51 38.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.777 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . 0.406 HG11 ' HH2' ' A' ' 656' ' ' TRP . 76.2 t -59.22 -42.78 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.724 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.502 ' O ' ' OG1' ' A' ' 648' ' ' THR . 1.3 m -58.17 -40.86 82.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.44 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.16 -38.39 88.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.192 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 12.2 mmm -68.03 -49.14 63.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.279 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.523 HD13 HG11 ' A' ' 654' ' ' VAL . 39.4 mt -68.73 -43.08 76.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.973 179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.502 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 65.6 m -56.05 -41.32 74.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.787 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.21 70.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.55 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.24 -5.39 41.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.781 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 85.73 5.98 83.45 Favored Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -95.47 135.41 37.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.879 0.371 . . . . 0.0 110.867 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . 0.45 ' HZ2' HD11 ' A' ' 655' ' ' ILE . 20.2 tttm -93.78 122.66 36.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.64 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.786 HG12 ' HB ' ' A' ' 630' ' ' ILE . 6.2 m -128.31 150.02 33.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.009 0.433 . . . . 0.0 111.276 -179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . 0.56 HG21 ' NE2' ' A' ' 666' ' ' GLN . 27.4 mm -114.16 129.87 69.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.005 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.791 ' C ' HD22 ' A' ' 657' ' ' LEU . 1.4 t-105 -96.77 133.86 40.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.88 0.371 . . . . 0.0 111.475 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.791 HD22 ' C ' ' A' ' 656' ' ' TRP . 4.3 mm? -120.12 140.94 50.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.589 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . . . . . . . . . 19.3 m -107.53 6.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.957 0.408 . . . . 0.0 109.975 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.486 ' C ' ' OD1' ' A' ' 659' ' ' ASP . 48.6 p30 -153.36 -168.76 3.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.337 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -113.12 -37.24 1.38 Allowed Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 24.4 m -58.84 -45.77 89.29 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . 0.499 HG22 ' OE1' ' A' ' 666' ' ' GLN . 53.7 m -65.01 -36.71 85.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 110.228 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.627 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.13 -45.9 91.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.797 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' A' ' 689' ' ' LEU . 94.4 mt -57.88 -45.08 86.9 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.323 -179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -63.1 -41.16 99.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.004 -179.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.67 ' OE1' HD11 ' A' ' 657' ' ' LEU . 19.8 pt20 -94.46 -45.75 7.3 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.561 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.627 ' N ' ' O ' ' A' ' 663' ' ' ALA . 7.9 tt -48.15 -41.54 27.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.833 -179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -61.58 -35.27 77.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.701 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 90.1 mt -76.5 -44.2 36.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.47 . . . . 0.0 112.194 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' A' ' 667' ' ' LEU . 1.4 pp -81.54 -15.69 54.07 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.866 -178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 670' ' ' LEU . 2.8 mm-40 37.97 77.99 0.38 Allowed Pre-proline 0 C--N 1.33 -0.264 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.385 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -69.35 156.98 62.87 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.555 2.17 . . . . 0.0 112.465 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 10.0 mm -93.16 -24.95 5.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.323 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.82 HG13 HG23 ' A' ' 630' ' ' ILE . 13.2 p -143.57 142.11 25.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.371 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 69.2 mt -127.82 127.27 68.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.101 0.477 . . . . 0.0 111.755 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.36 131.47 55.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.416 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 65.7 ttp -139.92 127.61 21.79 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.1 -0.64 . . . . 0.0 111.675 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -65.3 152.22 44.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.864 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.407 ' CZ3' ' CD2' ' A' ' 687' ' ' LEU . 32.2 t-105 -124.93 72.09 62.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -87.51 144.37 6.65 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 123.118 2.545 . . . . 0.0 112.11 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.73 ' O ' ' N ' ' A' ' 683' ' ' ASP . 5.8 Cg_exo -51.25 -50.39 14.09 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.651 2.234 . . . . 0.0 113.26 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 52.8 Cg_exo -38.35 -11.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 122.538 2.159 . . . . 0.0 112.064 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.73 ' N ' ' O ' ' A' ' 681' ' ' PRO . 13.2 t0 73.72 78.15 0.13 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.611 179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . 0.531 ' O ' HD12 ' A' ' 687' ' ' LEU . 45.4 tt0 -60.35 138.8 57.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.465 -179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . 0.442 ' C ' ' N ' ' A' ' 687' ' ' LEU . 38.1 m -62.27 -29.34 70.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.623 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.461 ' SG ' ' HB3' ' A' ' 633' ' ' LEU . 83.7 m -53.59 -14.05 0.77 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . 0.588 ' CD1' ' OD1' ' A' ' 683' ' ' ASP . 47.2 mt -62.65 -32.38 73.41 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.146 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 56.5 mt -64.26 -39.73 94.53 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.88 HD13 ' C ' ' A' ' 689' ' ' LEU . 2.4 tm? -60.22 -44.11 95.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.182 179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 19.5 tp -59.22 -39.57 83.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.749 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -60.2 -39.21 85.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.91 0.386 . . . . 0.0 110.064 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.412 ' CD2' ' C ' ' A' ' 692' ' ' HIS . 5.3 t60 -57.51 -50.0 74.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.963 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.493 ' O ' ' N ' ' A' ' 697' ' ' GLN . 80.7 mt -55.92 -35.41 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.576 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.512 HH22 ' HA ' ' A' ' 717' ' ' LEU . 24.4 mmt180 -62.04 -36.76 82.59 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.107 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -68.74 -33.86 74.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.467 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -112.93 23.5 13.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.166 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.546 ' O ' ' N ' ' A' ' 699' ' ' ASP . 21.8 pt20 -56.0 -17.47 6.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.81 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.644 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . 62.29 -71.65 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.208 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.644 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 12.5 t0 107.36 -40.13 0.0 OUTLIER Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.557 ' HD2' ' HB1' ' A' ' 698' ' ' ALA . 23.3 Cg_exo -56.87 -55.9 2.34 Favored 'Trans proline' 0 N--CA 1.492 1.398 0 C-N-CA 121.486 1.458 . . . . 0.0 111.922 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -137.31 68.2 54.52 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.677 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.05 144.1 74.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.553 2.169 . . . . 0.0 112.346 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -63.05 161.16 30.9 Favored 'Trans proline' 0 C--N 1.308 -1.582 0 C-N-CA 122.703 2.269 . . . . 0.0 111.722 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.3 tp -76.63 124.9 28.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.975 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.499 ' C ' HD12 ' A' ' 706' ' ' LEU . 61.0 t -122.56 132.26 71.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 121.157 0.503 . . . . 0.0 111.874 -179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.641 ' N ' HD12 ' A' ' 706' ' ' LEU . 5.2 mp -125.01 145.68 49.78 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.438 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -106.25 123.37 47.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.979 0.418 . . . . 0.0 110.585 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.2 mt -96.76 150.83 20.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.575 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -123.7 6.46 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -90.04 156.1 46.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 110.853 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -71.05 156.4 59.98 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 123.099 2.533 . . . . 0.0 112.286 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.521 ' HD2' HD13 ' A' ' 724' ' ' ILE . 36.8 Cg_endo -68.29 -153.64 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.898 2.399 . . . . 0.0 111.771 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 1.5 t -145.12 -52.36 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.498 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.09 145.07 90.83 Favored Pre-proline 0 C--N 1.327 -0.374 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.191 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.53 -17.62 33.96 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.592 2.195 . . . . 0.0 112.437 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 60.7 tp -70.27 -34.98 73.45 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.613 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.512 ' HA ' HH22 ' A' ' 694' ' ' ARG . 71.0 mt -76.38 -37.91 56.5 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 39.7 m -65.66 -43.0 90.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.261 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.62 -41.12 93.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.465 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.503 ' CD ' ' CZ ' ' A' ' 694' ' ' ARG . 42.7 tt0 -78.37 -22.97 47.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.72 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -72.92 139.47 46.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.56 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.468 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 0.0 OUTLIER -86.89 -30.27 21.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.63 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -170.49 124.25 0.69 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.767 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.521 HD13 ' HD2' ' A' ' 712' ' ' PRO . 62.6 mt -91.41 125.56 44.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.82 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.669 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.9 mp -107.2 147.91 29.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.535 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.1 m -166.89 -3.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.431 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 9.4 tptm -133.24 79.63 61.05 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.328 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.07 141.0 31.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.794 2.33 . . . . 0.0 112.087 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' A' ' 730' ' ' ASP . 0.3 OUTLIER -179.09 116.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.864 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.492 ' O ' ' O ' ' A' ' 729' ' ' LEU . 57.3 t0 56.42 121.2 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.721 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -70.2 -11.85 30.99 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.327 2.018 . . . . 0.0 112.205 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -71.42 -27.45 63.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.443 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 46.8 tp -66.13 -49.75 66.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.364 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.475 ' H ' HD12 ' A' ' 734' ' ' LEU . 4.7 mp -58.84 -42.9 90.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.955 0.407 . . . . 0.0 110.079 179.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 37.0 tp -62.38 -40.73 97.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.319 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 56.1 m -60.53 -39.66 88.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.637 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . 0.532 HG21 HD21 ' A' ' 706' ' ' LEU . 48.9 m -61.5 -44.18 97.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.7 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.489 ' CD2' HG21 ' A' ' 674' ' ' VAL . 39.8 mt -65.59 -37.35 86.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.122 0.486 . . . . 0.0 109.944 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.669 ' O ' ' N ' ' A' ' 741' ' ' LEU . 47.2 tt0 -64.55 -30.47 71.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.558 -0.747 . . . . 0.0 110.4 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -43.96 -6.52 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.478 -0.649 . . . . 0.0 111.478 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.669 ' N ' ' O ' ' A' ' 739' ' ' GLN . 66.1 mt -77.61 -42.21 35.81 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.543 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.498 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 45.3 t 47.64 57.61 17.71 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.182 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.498 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 57.6 Cg_endo -82.29 116.75 2.72 Favored 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.139 1.892 . . . . 0.0 111.279 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -85.06 135.75 5.6 Favored 'Trans proline' 0 C--N 1.307 -1.608 0 C-N-CA 122.62 2.213 . . . . 0.0 112.304 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 10.0 m120 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.569 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 81.18 25.53 54.88 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -90.52 128.92 36.7 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.436 HG23 ' O ' ' A' ' 674' ' ' VAL . 38.7 mt -118.35 142.9 30.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.753 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 1.023 HD21 ' HB1' ' A' ' 663' ' ' ALA . 23.6 tp -106.89 133.06 52.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.572 ' CD1' HG11 ' A' ' 643' ' ' VAL . 9.3 tt -130.41 120.22 23.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.529 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 657' ' ' LEU . 14.3 tp -107.28 119.25 38.87 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.64 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 87.7 tt0 -159.72 158.33 31.12 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.274 -179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.653 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 83.8 tt0 -109.02 133.43 53.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.776 179.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.653 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 75.3 tt0 105.47 113.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 O-C-N 123.653 0.596 . . . . 0.0 109.677 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.678 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.8 p30 -61.94 -33.49 74.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.38 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.678 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.6 mt-10 -65.77 -41.54 91.94 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.792 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.547 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -76.24 -46.04 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.168 -179.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.4 ' HB1' ' CG ' ' A' ' 656' ' ' TRP . . . -62.39 -41.19 98.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.539 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 87.1 m -63.87 -43.27 96.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.306 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 638' ' ' GLU . 41.4 t -54.5 -52.76 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.154 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . 0.572 HG11 ' CD1' ' A' ' 632' ' ' LEU . 87.6 t -58.15 -41.82 81.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.523 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.459 ' HA ' HG11 ' A' ' 654' ' ' VAL . 73.0 m -59.91 -39.09 84.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.6 -36.92 84.29 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.098 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 67.9 mmm -68.69 -48.88 62.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.245 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.477 ' N ' HD12 ' A' ' 647' ' ' LEU . 9.5 mp -69.08 -43.31 74.8 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.499 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 32.1 m -55.58 -41.42 73.32 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -67.34 -29.68 69.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.33 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.28 -5.23 30.7 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.701 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -8.23 70.39 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -97.41 138.34 35.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 15.9 ttmm -92.1 133.11 36.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.947 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.459 HG11 ' HA ' ' A' ' 644' ' ' CYS . 7.1 p -125.6 141.38 45.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.964 0.411 . . . . 0.0 111.195 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . 0.489 HG22 ' CD2' ' A' ' 657' ' ' LEU . 59.6 mt -107.35 129.76 60.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.921 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.64 ' NE1' ' O ' ' A' ' 634' ' ' GLU . 19.9 t90 -93.85 118.96 32.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.82 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.605 ' O ' HD12 ' A' ' 633' ' ' LEU . 2.7 mm? -109.12 143.22 38.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.665 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.69 ' O ' HG12 ' A' ' 658' ' ' VAL . 88.5 t -103.95 4.45 10.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.591 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 97.3 m-20 -145.77 121.27 10.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.06 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.427 ' CA ' HD12 ' A' ' 689' ' ' LEU . . . -57.06 -43.17 93.31 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.271 -0.731 . . . . 0.0 111.271 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 88.5 p -61.34 -40.25 93.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.718 0.294 . . . . 0.0 111.167 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 34.0 m -64.1 -38.28 90.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.122 0.487 . . . . 0.0 110.184 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 1.023 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -63.75 -44.6 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.458 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.08 -44.72 87.74 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.9 0.381 . . . . 0.0 111.161 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 -59.24 -41.04 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.568 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.571 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 97.9 mt-30 -86.73 -23.99 25.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.028 0.442 . . . . 0.0 109.99 179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.566 ' N ' ' O ' ' A' ' 663' ' ' ALA . 2.8 tp -50.44 -45.67 56.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.32 179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -62.59 -30.33 71.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.866 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 29.1 mt -73.88 -47.2 39.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.925 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.571 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.82 -17.75 42.88 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.488 -179.467 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.416 ' C ' ' O ' ' A' ' 670' ' ' LEU . 12.9 mm-40 41.35 64.16 5.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.931 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -72.38 155.52 55.51 Favored 'Trans proline' 0 C--N 1.303 -1.819 0 C-N-CA 123.106 2.537 . . . . 0.0 112.79 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 95.9 mt -93.88 -22.18 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.194 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 630' ' ' ILE . 22.0 t -138.41 136.44 44.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.475 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.69 HG22 ' SD ' ' A' ' 677' ' ' MET . 75.6 mt -120.98 123.31 69.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.579 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.585 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.5 mp -106.9 128.52 54.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.449 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.69 ' SD ' HG22 ' A' ' 675' ' ' ILE . 1.7 mpp? -141.02 141.17 34.36 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.259 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.717 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -65.2 153.91 39.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.749 178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.755 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 57.9 t-105 -99.56 -25.59 0.23 Allowed Pre-proline 0 C--N 1.328 -0.341 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.872 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.755 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 2.8 Cg_exo -70.29 149.18 63.11 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 121.893 1.729 . . . . 0.0 110.316 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.77 110.66 2.95 Favored 'Trans proline' 0 C--N 1.301 -1.938 0 C-N-CA 122.447 2.098 . . . . 0.0 112.444 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.583 ' O ' ' OD1' ' A' ' 683' ' ' ASP . 62.0 Cg_endo -91.76 -33.14 0.07 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.899 2.4 . . . . 0.0 111.487 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.583 ' OD1' ' O ' ' A' ' 682' ' ' PRO . 81.7 m-20 -157.01 -81.05 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 179.72 -25.84 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.768 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 22.7 t -64.18 -33.74 76.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.003 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -59.99 -33.81 72.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.79 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . 0.465 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 80.9 mt -66.76 -39.22 87.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.897 0.379 . . . . 0.0 110.554 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.777 ' C ' HD12 ' A' ' 688' ' ' LEU . 0.3 OUTLIER -69.96 -34.64 73.67 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.489 HD23 ' C ' ' A' ' 689' ' ' LEU . 9.7 tt -58.83 -41.66 87.4 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 49.9 tp -59.68 -43.06 94.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.092 179.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -62.02 -42.96 99.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.796 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -57.91 -48.05 81.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.924 0.392 . . . . 0.0 110.384 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 697' ' ' GLN . 91.8 mt -55.53 -37.77 68.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.969 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -63.19 -40.52 97.75 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.778 -0.369 . . . . 0.0 110.909 -179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -68.72 -33.61 74.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.68 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.467 ' O ' ' OD2' ' A' ' 699' ' ' ASP . 20.5 m-70 -96.79 0.92 50.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.713 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.431 HE22 ' HG2' ' A' ' 720' ' ' GLN . 61.7 tt0 -60.07 -34.79 73.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.919 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -82.34 -0.13 44.36 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.851 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.467 ' OD2' ' O ' ' A' ' 696' ' ' HIS . 0.0 OUTLIER -69.64 146.25 95.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.462 ' O ' ' OD1' ' A' ' 699' ' ' ASP . 10.7 Cg_endo -56.2 144.85 79.61 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.634 2.223 . . . . 0.0 112.54 -179.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.402 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 27.1 m-70 51.63 56.86 16.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.581 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 701' ' ' HIS . 28.7 Cg_endo -65.07 134.26 38.94 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.633 2.222 . . . . 0.0 111.832 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.07 150.39 42.93 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.457 2.105 . . . . 0.0 111.919 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.494 ' CD1' ' O ' ' A' ' 737' ' ' THR . 52.5 mt -78.15 138.72 38.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 29.4 t -115.99 129.33 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.095 0.474 . . . . 0.0 111.323 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.46 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.5 mp -117.07 136.63 52.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.659 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . 0.4 ' CE1' ' HE2' ' A' ' 677' ' ' MET . 94.8 m-85 -110.86 137.08 48.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.125 0.488 . . . . 0.0 111.77 -179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 56.6 mt -96.63 156.4 16.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.452 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 85.4 -140.03 17.9 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -87.72 150.07 47.46 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.965 0.412 . . . . 0.0 110.983 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.76 146.08 33.26 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.966 2.444 . . . . 0.0 112.582 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -50.85 154.26 7.26 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.216 1.944 . . . . 0.0 111.178 178.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 54.2 t -77.7 -42.89 29.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.488 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -72.96 137.76 79.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.21 -13.48 18.94 Favored 'Trans proline' 0 C--N 1.309 -1.519 0 C-N-CA 122.391 2.061 . . . . 0.0 112.322 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 25.4 tp -69.94 -36.53 75.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.802 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 80.1 mt -75.48 -34.23 60.87 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.668 -0.494 . . . . 0.0 109.668 179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 91.6 m -63.79 -43.46 96.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.082 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.24 -37.35 86.96 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.603 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.431 ' HG2' HE22 ' A' ' 697' ' ' GLN . 96.6 mt-30 -73.26 -27.28 61.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.184 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.16 149.29 46.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.396 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 8.1 t -85.65 -31.15 22.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.235 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -172.28 160.52 5.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.476 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.4 HD13 HG21 ' A' ' 724' ' ' ILE . 54.3 mt -147.1 120.99 2.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.707 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 56.5 mt -112.94 129.52 56.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.804 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 14.8 m -68.12 -40.48 82.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.058 0.456 . . . . 0.0 109.947 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.81 145.23 27.08 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.011 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 129.57 30.16 Favored 'Trans proline' 0 C--N 1.305 -1.738 0 C-N-CA 122.243 1.962 . . . . 0.0 111.651 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.458 ' HG ' ' N ' ' A' ' 730' ' ' ASP . 34.8 tp -179.5 149.8 0.4 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.458 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 2.4 m-20 57.66 68.02 2.12 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.761 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -54.31 -15.7 8.73 Favored 'Trans proline' 0 C--N 1.304 -1.785 0 C-N-CA 122.923 2.415 . . . . 0.0 112.052 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -69.86 -33.35 72.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.257 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 25.4 tp -67.05 -42.36 84.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.965 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.447 ' CD1' HD22 ' A' ' 706' ' ' LEU . 43.1 tp -56.45 -43.97 80.03 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.037 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.46 -39.64 94.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.22 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.8 m -59.05 -40.41 85.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.462 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . 0.494 ' O ' ' CD1' ' A' ' 704' ' ' LEU . 73.4 m -63.35 -39.92 95.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.126 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.684 ' C ' HD23 ' A' ' 738' ' ' LEU . 7.3 tt -63.97 -47.78 79.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.357 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.578 ' C ' ' H ' ' A' ' 741' ' ' LEU . 2.8 pt20 -69.14 -22.34 63.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.91 0.15 0.06 OUTLIER Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 1.074 ' O ' HD12 ' A' ' 741' ' ' LEU . 0.3 OUTLIER -85.37 -4.37 59.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.844 0.354 . . . . 0.0 110.486 179.846 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 46.8 t 64.11 65.19 1.17 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.702 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -74.8 117.01 4.78 Favored 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.36 2.04 . . . . 0.0 110.718 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -86.17 1.0 8.02 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 C-N-CA 122.531 2.154 . . . . 0.0 112.355 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.475 179.813 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 93.1 7.14 62.63 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -90.25 133.21 35.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.971 0.415 . . . . 0.0 111.029 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 63.8 mt -118.29 141.96 35.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.914 179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.574 HD21 ' HB1' ' A' ' 663' ' ' ALA . 1.2 tp -106.06 129.09 54.23 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.481 -0.487 . . . . 0.0 110.44 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.433 HD23 ' C ' ' A' ' 632' ' ' LEU . 9.6 tt -134.33 120.58 20.07 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.751 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.55 HD23 ' C ' ' A' ' 633' ' ' LEU . 8.3 tt -108.43 120.09 41.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.913 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.524 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 81.7 tt0 -159.78 161.21 34.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.535 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.601 ' O ' ' CB ' ' A' ' 636' ' ' GLU . 93.9 mt-10 -113.55 155.73 24.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.19 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.601 ' CB ' ' O ' ' A' ' 635' ' ' GLU . 26.4 tp10 91.65 113.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.889 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -58.15 -38.23 76.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.145 -179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.733 ' O ' HG23 ' A' ' 642' ' ' VAL . 76.3 mm-40 -66.88 -41.44 87.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.118 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 636' ' ' GLU . . . -76.23 -45.15 34.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.811 0.339 . . . . 0.0 110.948 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -64.9 -46.2 82.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.05 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 58.4 m -63.63 -44.46 93.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.994 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 638' ' ' GLU . 41.1 t -55.86 -52.88 44.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.802 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . 0.418 HG11 HD11 ' A' ' 632' ' ' LEU . 70.7 t -60.29 -44.42 95.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.798 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 645' ' ' GLU . 0.5 OUTLIER -62.55 -37.32 85.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.745 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . 0.486 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 84.2 tt0 -62.37 -39.46 93.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.688 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 43.0 tpp -67.92 -50.31 56.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.722 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 647' ' ' LEU . 7.9 mp -68.57 -44.74 73.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.551 179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 62.5 m -56.26 -43.46 78.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.021 0.438 . . . . 0.0 109.975 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -69.36 -23.74 63.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.54 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.25 -3.07 21.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.543 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 95.53 -9.81 69.04 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -95.31 138.55 32.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 110.604 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -92.27 129.74 38.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.134 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . . . . . . . . . 9.5 p -129.12 138.7 53.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.997 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 3.1 mp -106.37 131.36 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.921 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.67 ' C ' HD22 ' A' ' 657' ' ' LEU . 16.0 t90 -90.56 122.22 33.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.11 -178.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.67 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.5 mm? -111.06 140.31 45.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.712 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.57 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 1.5 t -109.35 5.71 9.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.319 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.57 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 62.9 m-20 -147.34 137.72 23.3 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.357 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.447 ' O ' HD23 ' A' ' 689' ' ' LEU . . . -65.17 -46.7 86.92 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.638 -0.585 . . . . 0.0 111.638 -179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 21.4 m -60.05 -38.37 82.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.821 0.343 . . . . 0.0 110.956 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 46.4 m -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.502 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.574 ' HB1' HD21 ' A' ' 631' ' ' LEU . . . -62.1 -48.01 82.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.017 -179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.585 HD21 HD21 ' A' ' 689' ' ' LEU . 39.1 mt -59.05 -40.33 84.77 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.901 -179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . 0.582 ' O ' ' OD1' ' A' ' 668' ' ' ASP . 86.3 m-20 -62.37 -42.33 99.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.161 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.569 ' O ' ' CD2' ' A' ' 670' ' ' LEU . 88.4 mt-30 -87.84 -36.23 17.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.931 0.396 . . . . 0.0 110.92 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.494 HD11 HD11 ' A' ' 675' ' ' ILE . 0.8 OUTLIER -48.54 -44.44 36.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.995 -179.614 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.582 ' OD1' ' O ' ' A' ' 665' ' ' ASP . 50.7 p-10 -63.71 -32.02 73.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.383 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.546 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 81.4 mt -72.39 -46.71 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.91 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.569 ' CD2' ' O ' ' A' ' 666' ' ' GLN . 0.0 OUTLIER -82.87 -15.76 50.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.798 -179.121 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.465 ' HA ' HE21 ' A' ' 671' ' ' GLN . 3.5 mm-40 40.72 61.1 7.21 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.1 0.476 . . . . 0.0 110.111 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.06 151.76 61.95 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.352 2.701 . . . . 0.0 112.447 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.586 HG13 HG23 ' A' ' 674' ' ' VAL . 7.0 pt -95.94 -11.54 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.586 HG23 HG13 ' A' ' 673' ' ' ILE . 63.6 t -138.68 135.2 43.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.458 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.494 HD11 HD11 ' A' ' 667' ' ' LEU . 67.0 mt -127.85 124.16 62.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.809 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . . . . . . . . . 4.5 mp -102.74 138.03 40.18 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 74.1 mtp -139.27 134.38 32.56 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.086 -0.646 . . . . 0.0 111.623 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.52 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -67.71 150.84 48.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.594 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.75 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 25.2 t-105 -115.03 -21.03 0.11 Allowed Pre-proline 0 CA--C 1.535 0.39 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.75 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 66.2 Cg_exo -47.74 158.67 0.7 Allowed 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.859 1.706 . . . . 0.0 112.104 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.641 ' C ' ' H ' ' A' ' 683' ' ' ASP . 2.5 Cg_endo -50.2 -54.85 4.77 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 C-N-CA 122.894 2.396 . . . . 0.0 113.402 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 2.1 Cg_endo -49.17 0.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.4 0 C-N-CA 122.059 1.839 . . . . 0.0 111.945 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.641 ' H ' ' C ' ' A' ' 681' ' ' PRO . 84.8 m-20 -82.48 45.5 0.97 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.822 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -58.65 -38.45 78.14 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.103 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . 0.4 ' O ' ' HG ' ' A' ' 688' ' ' LEU . 59.8 p -67.35 -30.09 69.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.104 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 25.2 t -62.06 -25.13 67.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.149 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 77.2 mt -66.19 -39.66 89.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.752 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.697 ' C ' HD12 ' A' ' 688' ' ' LEU . 1.2 pp -72.75 -43.26 63.13 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.717 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.792 HD13 ' O ' ' A' ' 689' ' ' LEU . 0.5 OUTLIER -61.49 -41.23 96.96 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 690' ' ' LEU . 8.9 tt -59.61 -42.16 92.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.601 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -61.51 -40.54 94.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.227 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.664 ' NE2' ' NE2' ' A' ' 696' ' ' HIS . 5.8 t60 -57.83 -47.51 82.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.263 179.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.56 ' O ' ' N ' ' A' ' 697' ' ' GLN . 44.8 mt -54.68 -39.81 68.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -63.34 -34.13 77.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.142 179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.2 -31.46 71.87 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.995 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.664 ' NE2' ' NE2' ' A' ' 692' ' ' HIS . 0.1 OUTLIER -169.9 63.6 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.157 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 693' ' ' LEU . 13.0 pt20 -62.21 5.68 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.15 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.576 ' H ' ' C ' ' A' ' 696' ' ' HIS . . . 66.64 115.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.492 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.555 ' N ' ' CD ' ' A' ' 700' ' ' PRO . 0.3 OUTLIER -68.24 -47.31 38.9 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.603 -179.835 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.614 ' O ' ' C ' ' A' ' 701' ' ' HIS . 23.6 Cg_exo -60.63 136.38 66.58 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 122.592 2.195 . . . . 0.0 111.873 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.614 ' C ' ' O ' ' A' ' 700' ' ' PRO . 38.8 m170 -0.56 69.95 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.665 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.592 ' N ' ' O ' ' A' ' 700' ' ' PRO . 11.4 Cg_endo -58.16 147.72 82.1 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 C-N-CA 122.192 1.928 . . . . 0.0 111.869 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -55.73 152.62 34.01 Favored 'Trans proline' 0 C--N 1.307 -1.629 0 C-N-CA 122.664 2.243 . . . . 0.0 112.197 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.423 ' HB3' ' CB ' ' A' ' 722' ' ' SER . 29.2 mt -76.87 139.09 40.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.286 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.612 ' O ' ' N ' ' A' ' 722' ' ' SER . 16.9 t -122.94 130.98 74.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.12 0.486 . . . . 0.0 111.554 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.742 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.6 mp -119.23 138.96 52.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.751 -0.658 . . . . 0.0 109.996 179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . 0.544 ' CE2' HD21 ' A' ' 717' ' ' LEU . 35.8 m-85 -108.93 126.8 53.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.918 0.39 . . . . 0.0 110.89 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 35.9 mt -97.46 145.91 25.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.308 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 97.77 -127.64 9.29 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.825 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . 0.52 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.1 OUTLIER -87.15 153.99 54.45 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-O 120.993 0.425 . . . . 0.0 111.245 -178.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.02 161.99 24.18 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.916 2.411 . . . . 0.0 112.425 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.673 ' HB3' HD23 ' A' ' 717' ' ' LEU . 26.5 Cg_endo -62.85 151.03 86.38 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 123.39 2.727 . . . . 0.0 112.683 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.544 ' O ' ' OD1' ' A' ' 714' ' ' ASP . 2.7 t -86.91 16.15 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.381 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . 0.544 ' OD1' ' O ' ' A' ' 713' ' ' VAL . 0.5 OUTLIER -161.81 143.24 8.41 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.0 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.41 -20.43 31.8 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.643 2.228 . . . . 0.0 111.881 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' A' ' 716' ' ' LEU . 84.8 mt -70.06 -34.08 72.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.673 HD23 ' HB3' ' A' ' 712' ' ' PRO . 59.6 tp -75.5 -35.18 60.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.692 179.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . 0.409 ' OG1' ' HG2' ' A' ' 712' ' ' PRO . 57.3 m -62.6 -41.55 99.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 178.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.9 92.67 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.094 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -75.11 -28.54 60.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.356 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.14 144.58 51.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.598 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.612 ' N ' ' O ' ' A' ' 705' ' ' VAL . 32.7 t -86.16 -27.28 24.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.443 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -171.23 122.88 0.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.837 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 28.8 mm -89.55 122.83 41.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.53 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 5.0 mp -109.05 146.21 34.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.971 0.415 . . . . 0.0 110.796 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 1.6 p -167.93 -22.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.954 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.67 81.03 64.95 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.665 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -46.22 122.53 5.56 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 C-N-CA 122.751 2.301 . . . . 0.0 112.453 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 24.2 tp 179.2 141.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.094 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.57 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 60.94 68.75 1.2 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.915 0.388 . . . . 0.0 110.718 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -51.91 -1.32 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.955 2.436 . . . . 0.0 112.027 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.57 ' H ' ' C ' ' A' ' 730' ' ' ASP . 1.4 pt20 -72.58 -31.99 65.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.866 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 22.4 tp -64.91 -45.84 84.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.085 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 17.0 tp -57.98 -48.0 81.3 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.42 -41.86 93.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.538 179.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 64.6 m -59.83 -40.51 88.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.621 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 41.7 m -61.08 -45.77 93.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.97 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.9 -41.73 86.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.091 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.6 ' NE2' ' SG ' ' A' ' 742' ' ' CYS . 72.4 tp60 -64.53 -35.92 82.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.317 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -53.76 -11.35 1.98 Allowed Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 739' ' ' GLN . 24.3 tp -152.84 91.6 1.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.88 0.372 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.6 ' SG ' ' NE2' ' A' ' 739' ' ' GLN . 6.3 p -138.6 51.18 3.42 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.666 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 742' ' ' CYS . 67.6 Cg_endo -77.79 117.44 4.23 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.343 2.029 . . . . 0.0 111.029 179.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -84.39 127.02 3.76 Favored 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 122.406 2.07 . . . . 0.0 112.092 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.642 -179.793 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 87.49 178.9 48.16 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -92.94 134.31 35.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.959 0.409 . . . . 0.0 110.707 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.665 ' HB ' HG12 ' A' ' 654' ' ' VAL . 2.4 mp -115.42 139.8 40.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.297 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 1.015 ' C ' HD13 ' A' ' 632' ' ' LEU . 8.4 tt -112.51 129.59 56.29 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.621 -0.431 . . . . 0.0 110.596 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 1.03 HD22 ' H ' ' A' ' 632' ' ' LEU . 0.0 OUTLIER -130.99 122.29 26.58 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.732 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.768 HD22 ' SG ' ' A' ' 686' ' ' CYS . 7.0 tt -108.32 125.28 51.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.963 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.698 ' OE2' HD12 ' A' ' 708' ' ' LEU . 94.0 mt-10 -158.4 170.24 22.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.069 0.461 . . . . 0.0 110.909 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.561 ' OE2' ' O ' ' A' ' 682' ' ' PRO . 95.8 mt-10 -114.76 162.11 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.987 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 69.59 123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.34 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.489 ' O ' ' OG1' ' A' ' 641' ' ' THR . 90.9 m-20 -58.83 -34.4 71.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.185 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.484 ' O ' HG23 ' A' ' 642' ' ' VAL . 44.1 tp10 -63.64 -42.05 98.17 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.064 -179.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.46 51.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.812 0.339 . . . . 0.0 110.888 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.434 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -65.87 -39.68 90.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.049 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.489 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 54.3 m -62.84 -45.07 94.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.064 -179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 638' ' ' GLU . 52.8 t -56.7 -52.56 52.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.896 -179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 57.4 t -60.22 -46.28 94.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.541 ' O ' ' OG1' ' A' ' 648' ' ' THR . 96.1 m -66.99 -36.8 82.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 49.8 tp10 -61.67 -38.28 87.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.477 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 65.3 mtt -68.36 -50.61 51.95 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 78.4 mt -68.29 -43.63 77.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.625 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.541 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 41.1 m -56.17 -41.55 75.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.34 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.1 73.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.738 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -72.74 -1.81 17.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.542 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 82.4 10.63 83.26 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 6.9 m-30 -91.43 140.39 29.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -93.52 120.32 33.66 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.665 HG12 ' HB ' ' A' ' 630' ' ' ILE . 5.7 m -129.0 150.42 34.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.941 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . 0.674 ' O ' HD22 ' A' ' 632' ' ' LEU . 24.1 mm -111.8 127.12 69.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.888 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.618 ' C ' HD22 ' A' ' 657' ' ' LEU . 32.6 t90 -93.76 118.54 31.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.997 0.427 . . . . 0.0 111.285 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 656' ' ' TRP . 4.0 mm? -115.59 144.51 43.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.456 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.542 ' O ' HG22 ' A' ' 658' ' ' VAL . 9.7 p -113.8 12.08 8.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -147.49 123.6 10.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.414 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -61.11 -43.89 98.85 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 17.6 t -59.69 -48.68 80.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 110.931 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.9 m -64.27 -38.02 89.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.325 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.38 98.87 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.946 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 87.1 mt -58.57 -43.4 89.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.712 0.292 . . . . 0.0 111.09 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -61.8 -40.89 96.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.056 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -86.29 -41.99 14.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.137 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.928 HD12 HD13 ' A' ' 631' ' ' LEU . 9.3 tt -47.68 -38.14 14.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.829 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.423 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 62.6 t0 -56.54 -37.09 70.02 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 60.8 mt -77.71 -30.31 51.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.605 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.985 HD12 HD12 ' A' ' 631' ' ' LEU . 16.2 mt -72.04 -36.16 69.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.558 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.464 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 32.7 mm-40 46.68 62.4 11.66 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -178.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 66.3 Cg_endo -81.67 156.03 18.42 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 123.37 2.713 . . . . 0.0 112.957 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.616 ' CG2' HD12 ' A' ' 741' ' ' LEU . 81.0 mt -96.54 -23.97 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.681 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 48.7 t -138.65 139.11 41.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-O 120.903 0.383 . . . . 0.0 110.75 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.549 ' C ' HD12 ' A' ' 676' ' ' LEU . 72.0 mt -128.6 123.44 59.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.588 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.672 HD12 ' N ' ' A' ' 676' ' ' LEU . 7.9 mp -105.67 131.98 52.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 178.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.535 ' SD ' HD22 ' A' ' 689' ' ' LEU . 69.2 mtm -138.06 138.68 39.02 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.527 -179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.538 ' C ' ' OD2' ' A' ' 683' ' ' ASP . . . -65.91 151.1 47.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.64 178.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.736 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 74.5 t-105 -113.43 -21.99 0.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.265 -179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.736 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 92.1 Cg_exo -44.48 159.93 0.11 Allowed 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 121.698 1.599 . . . . 0.0 111.388 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.585 ' C ' ' H ' ' A' ' 683' ' ' ASP . 13.9 Cg_exo -52.24 -45.61 38.17 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.099 1.866 . . . . 0.0 112.677 -178.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.561 ' O ' ' OE2' ' A' ' 635' ' ' GLU . 31.3 Cg_exo -49.3 -8.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.31 -1.497 0 C-N-CA 121.734 1.622 . . . . 0.0 110.626 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.585 ' H ' ' C ' ' A' ' 681' ' ' PRO . 74.7 m-20 -83.42 24.67 0.81 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.831 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -53.35 -40.84 65.24 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.359 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 93.0 p -69.14 -35.41 76.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.458 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.768 ' SG ' HD22 ' A' ' 633' ' ' LEU . 0.1 OUTLIER -62.35 -19.11 63.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.008 179.58 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.14 -32.99 74.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.772 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.701 ' C ' HD12 ' A' ' 688' ' ' LEU . 1.6 pp -70.09 -44.1 69.73 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.725 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.584 ' N ' HD12 ' A' ' 688' ' ' LEU . 8.0 tt -60.68 -41.4 95.04 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 61.1 tp -60.39 -36.1 77.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.156 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -59.98 -45.03 94.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.834 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 9.4 t-80 -57.66 -50.6 72.63 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.448 -0.501 . . . . 0.0 109.949 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 57.8 mt -56.17 -34.92 66.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.379 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -60.57 -40.79 92.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.5 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.28 -31.86 70.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.985 0.421 . . . . 0.0 110.172 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -98.08 10.4 40.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.519 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.568 ' OE1' ' NE2' ' A' ' 720' ' ' GLN . 11.2 tp-100 -54.9 -15.52 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.734 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.583 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -80.97 131.56 35.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 110.231 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.583 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 4.4 t0 87.8 128.88 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.072 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -81.0 -11.96 12.12 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.593 2.195 . . . . 0.0 112.873 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.472 ' N ' ' HD2' ' A' ' 702' ' ' PRO . 0.1 OUTLIER -43.0 -53.31 10.53 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.781 0.324 . . . . 0.0 110.916 -179.429 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 701' ' ' HIS . 65.6 Cg_exo -45.11 156.57 0.27 Allowed 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.874 2.382 . . . . 0.0 112.391 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.92 158.77 36.72 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 123.069 2.512 . . . . 0.0 112.466 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.503 ' H ' HD12 ' A' ' 704' ' ' LEU . 3.6 mp -77.12 149.67 35.66 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.493 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 35.7 t -114.86 129.22 71.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.352 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.834 ' HG ' ' HB3' ' A' ' 723' ' ' ALA . 5.7 mp -121.7 136.49 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.124 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -111.61 127.88 55.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.398 . . . . 0.0 111.186 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.698 HD12 ' OE2' ' A' ' 634' ' ' GLU . 72.7 mt -97.16 148.38 23.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.496 179.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 106.88 -132.36 11.1 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.079 -0.809 . . . . 0.0 111.079 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -89.88 175.18 4.03 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.382 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -82.53 135.71 8.23 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.742 2.295 . . . . 0.0 112.414 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.75 ' HB3' HD23 ' A' ' 717' ' ' LEU . 37.6 Cg_exo -51.31 150.81 14.17 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.114 1.876 . . . . 0.0 111.59 179.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 90.3 t -78.82 -39.22 22.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.687 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 132.14 81.99 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.497 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -72.19 -28.39 15.62 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 C-N-CA 122.267 1.978 . . . . 0.0 111.818 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 72.1 mt -72.05 -28.84 63.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.573 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.75 HD23 ' HB3' ' A' ' 712' ' ' PRO . 40.4 tp -75.19 -42.82 54.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 0.0 109.858 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . 0.601 HG23 HD12 ' A' ' 724' ' ' ILE . 57.3 m -64.6 -45.32 87.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.047 178.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.66 84.2 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.515 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.568 ' NE2' ' OE1' ' A' ' 697' ' ' GLN . 67.4 tp60 -77.73 -17.46 57.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.455 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -70.97 147.71 48.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.425 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 62.9 p -83.19 -25.08 32.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.135 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.834 ' HB3' ' HG ' ' A' ' 706' ' ' LEU . . . -171.8 157.98 4.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.563 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.601 HD12 HG23 ' A' ' 718' ' ' THR . 70.1 mt -148.65 123.33 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.395 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.45 HD11 HD13 ' A' ' 734' ' ' LEU . 46.7 mt -102.59 147.85 26.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.44 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 17.4 p -167.59 -16.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.724 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -132.07 78.26 69.6 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.613 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -54.03 147.81 41.72 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.636 2.224 . . . . 0.0 111.74 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 6.2 tp -178.11 -38.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.159 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.65 ' C ' ' H ' ' A' ' 732' ' ' GLN . 1.3 m-20 -142.98 82.29 12.16 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -50.15 0.91 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 122.856 2.371 . . . . 0.0 111.669 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.65 ' H ' ' C ' ' A' ' 730' ' ' ASP . 90.5 mt-30 -69.56 -29.98 67.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.666 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 34.1 tp -65.93 -46.48 78.07 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.45 HD13 HD11 ' A' ' 725' ' ' LEU . 13.5 tp -57.85 -46.41 84.85 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 88.4 mt -63.98 -40.48 96.48 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.002 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . 0.501 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 28.6 m -59.6 -39.2 83.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.578 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 27.4 m -62.31 -47.63 83.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.016 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.462 ' C ' HD23 ' A' ' 738' ' ' LEU . 8.8 tt -66.18 -41.01 90.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.859 0.362 . . . . 0.0 110.573 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -64.0 -28.08 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.101 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.59 -44.84 12.09 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.616 HD12 ' CG2' ' A' ' 673' ' ' ILE . 58.9 mt -88.0 -94.64 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.978 -0.289 . . . . 0.0 110.222 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 1.8 t 53.86 62.9 8.47 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -80.82 116.37 3.16 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.078 1.852 . . . . 0.0 110.988 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -86.56 154.02 9.03 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.775 2.317 . . . . 0.0 112.464 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 30.3 p-10 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.895 -1.05 . . . . 0.0 110.464 179.856 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -173.27 -179.13 43.75 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -93.57 134.39 35.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.875 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.411 ' CG2' ' CD1' ' A' ' 676' ' ' LEU . 67.1 mt -118.38 138.82 47.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.12 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.871 HD13 ' C ' ' A' ' 631' ' ' LEU . 3.2 tm? -110.06 124.05 50.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.64 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.713 ' N ' HD13 ' A' ' 631' ' ' LEU . 20.3 tp -113.26 122.1 46.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.726 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.458 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 17.6 tp -108.67 117.97 35.57 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.458 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 94.4 mt-10 -158.76 172.2 18.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.531 -178.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 636' ' ' GLU . 48.8 tp10 -106.82 152.44 23.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.127 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.436 ' N ' ' HG3' ' A' ' 635' ' ' GLU . 83.5 tt0 69.29 127.11 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.018 0.437 . . . . 0.0 110.543 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.689 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 55.4 p30 -66.25 -33.66 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.489 -179.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.852 ' O ' HG23 ' A' ' 642' ' ' VAL . 96.7 mt-10 -66.18 -42.24 89.17 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.82 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.63 -45.42 62.1 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.864 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.437 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -64.96 -40.91 95.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.917 -179.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.557 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 32.3 m -62.58 -43.72 98.12 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.631 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.852 HG23 ' O ' ' A' ' 638' ' ' GLU . 84.0 t -53.78 -49.23 59.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.872 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.8 t -58.82 -42.85 86.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.009 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.497 ' O ' ' OG1' ' A' ' 648' ' ' THR . 99.2 m -64.9 -36.61 84.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.369 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -62.06 -38.42 88.73 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.957 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . 0.402 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 64.7 mtt -68.58 -47.89 65.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.32 179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.591 ' CD2' ' N ' ' A' ' 647' ' ' LEU . 1.6 mm? -69.48 -43.99 72.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.119 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 46.8 m -56.09 -40.51 73.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.867 179.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -66.64 -31.8 72.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.555 179.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -73.95 -4.76 37.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.14 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.76 -0.36 60.94 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 111.573 -0.611 . . . . 0.0 111.573 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . 0.41 ' HB3' HD12 ' A' ' 630' ' ' ILE . 88.5 m-85 -93.57 141.7 28.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.738 0.304 . . . . 0.0 110.648 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -91.83 122.06 34.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.282 -0.417 . . . . 0.0 109.96 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.545 HG21 ' HB2' ' A' ' 647' ' ' LEU . 23.1 t -120.11 135.48 60.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.183 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . 0.582 HD12 HD22 ' A' ' 670' ' ' LEU . 63.4 mt -110.67 131.69 61.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.138 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.59 ' O ' HD22 ' A' ' 657' ' ' LEU . 13.8 t90 -95.15 120.17 34.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.381 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 656' ' ' TRP . 3.3 mm? -116.16 135.13 54.2 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.483 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.58 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 0.2 OUTLIER -100.41 2.54 10.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.295 179.629 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.58 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 80.1 m-20 -146.69 162.12 39.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.107 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.401 ' H ' ' HB3' ' A' ' 685' ' ' SER . . . -87.28 -48.75 4.2 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.768 -179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 22.3 t -57.57 -41.25 80.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.741 0.305 . . . . 0.0 111.054 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 50.6 m -62.84 -37.13 85.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.192 179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.554 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.49 -40.09 96.17 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.818 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . . . . . . . . . 39.0 mt -60.01 -43.14 95.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.016 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -63.08 -39.26 94.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -88.43 -49.92 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.391 -179.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' A' ' 663' ' ' ALA . 8.4 tt -46.28 -42.67 14.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.332 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -61.55 -33.38 73.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.758 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 66.6 mt -74.23 -45.06 50.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.731 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.582 HD22 HD12 ' A' ' 655' ' ' ILE . 1.0 OUTLIER -83.19 -18.01 40.81 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 670' ' ' LEU . 76.9 mm-40 40.87 78.49 0.37 Allowed Pre-proline 0 C--N 1.33 -0.278 0 C-N-CA 120.474 -0.49 . . . . 0.0 110.105 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.44 153.36 39.67 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 122.858 2.372 . . . . 0.0 112.774 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 78.4 mt -93.14 -19.11 6.85 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 121.049 0.452 . . . . 0.0 110.001 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 45.1 t -139.46 135.16 40.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.787 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.465 HG22 ' HG3' ' A' ' 677' ' ' MET . 77.8 mt -123.85 121.26 61.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.968 0.413 . . . . 0.0 111.492 -179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.411 ' CD1' ' CG2' ' A' ' 630' ' ' ILE . 4.1 mp -105.39 127.52 53.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.633 ' SD ' HD22 ' A' ' 689' ' ' LEU . 69.0 mtm -140.42 133.95 30.09 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.795 -0.762 . . . . 0.0 111.904 -179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.416 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -67.99 152.62 45.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.286 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.738 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 24.6 t-105 -110.59 -28.27 0.14 Allowed Pre-proline 0 C--N 1.329 -0.313 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.282 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.738 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 34.4 Cg_endo -98.16 26.1 0.2 Allowed 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 123.241 2.627 . . . . 0.0 115.42 179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 71.3 Cg_endo -79.97 154.49 22.74 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.439 1.426 . . . . 0.0 112.116 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -64.26 -35.08 53.45 Favored 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 122.826 2.351 . . . . 0.0 112.243 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.585 ' C ' ' H ' ' A' ' 685' ' ' SER . 65.8 t0 -87.13 112.25 21.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.039 -179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -64.15 12.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.862 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . 0.585 ' H ' ' C ' ' A' ' 683' ' ' ASP . 55.9 m -60.05 -29.82 68.79 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.801 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.506 ' SG ' ' HG3' ' A' ' 681' ' ' PRO . 19.4 m -59.5 -38.28 80.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.64 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 687' ' ' LEU . 62.3 mt -67.47 -34.97 78.26 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.857 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.72 -42.12 82.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.886 0.374 . . . . 0.0 110.351 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.771 ' O ' HD23 ' A' ' 689' ' ' LEU . 7.2 tt -60.57 -39.53 88.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.155 0.502 . . . . 0.0 109.875 179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.631 HD11 HD22 ' A' ' 717' ' ' LEU . 9.0 tt -59.84 -41.54 91.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.648 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.58 -40.49 91.9 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.501 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -57.18 -46.03 83.17 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.311 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 67.1 mt -53.55 -49.78 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.848 HH11 HE22 ' A' ' 720' ' ' GLN . 54.0 ttt85 -69.05 -27.34 65.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.582 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . 0.661 ' O ' ' CD2' ' A' ' 696' ' ' HIS . 31.1 tp10 -62.93 -34.56 77.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.814 -178.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.661 ' CD2' ' O ' ' A' ' 695' ' ' GLU . 6.8 p80 143.97 38.49 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.246 0.341 . . . . 0.0 111.876 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -61.84 -43.73 98.26 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.778 179.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.597 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . -155.56 88.55 1.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.451 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.597 ' O ' ' O ' ' A' ' 698' ' ' ALA . 0.0 OUTLIER 44.74 174.81 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.689 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 699' ' ' ASP . 27.6 Cg_exo -58.83 -9.34 7.37 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.596 2.197 . . . . 0.0 112.289 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -124.07 70.24 50.71 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.825 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.485 ' HA ' ' HB3' ' A' ' 698' ' ' ALA . 29.5 Cg_endo -66.31 165.44 24.62 Favored 'Trans proline' 0 C--N 1.308 -1.555 0 C-N-CA 122.705 2.27 . . . . 0.0 112.521 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -41.31 168.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.631 0 C-N-CA 123.263 2.642 . . . . 0.0 112.633 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.727 ' N ' HD12 ' A' ' 704' ' ' LEU . 5.6 mp -76.93 142.76 39.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.064 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.3 t -126.61 135.25 64.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.207 0.527 . . . . 0.0 111.656 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.769 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 50.8 mt -110.33 132.94 53.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.304 178.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -111.12 126.68 55.09 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.924 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.744 ' CD2' HD12 ' A' ' 725' ' ' LEU . 49.2 mt -95.7 150.68 20.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.536 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 94.58 -134.88 12.19 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.71 156.77 44.69 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.951 0.405 . . . . 0.0 111.053 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -77.57 148.47 26.13 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 123.045 2.497 . . . . 0.0 112.326 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.592 ' HD2' HD13 ' A' ' 724' ' ' ILE . 28.9 Cg_endo -65.35 151.12 86.15 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 C-N-CA 122.604 2.203 . . . . 0.0 111.458 179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 43.0 t -77.94 -42.88 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.942 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -72.99 140.65 80.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -75.96 -12.21 19.69 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.622 2.214 . . . . 0.0 112.61 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.765 HD21 ' NH1' ' A' ' 694' ' ' ARG . 38.6 tp -69.5 -35.87 75.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.926 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.631 HD22 HD11 ' A' ' 690' ' ' LEU . 66.8 mt -75.21 -34.49 61.49 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 27.1 m -63.66 -42.05 98.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.093 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.16 -39.22 93.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.094 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.848 HE22 HH11 ' A' ' 694' ' ' ARG . 93.1 mt-30 -77.58 -19.96 54.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.175 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -74.46 132.94 42.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.868 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.4 p -85.73 -27.04 25.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.834 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.769 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -172.72 112.62 0.25 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.917 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.592 HD13 ' HD2' ' A' ' 712' ' ' PRO . 64.6 mt -91.1 133.51 32.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.346 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.744 HD12 ' CD2' ' A' ' 708' ' ' LEU . 35.5 mt -106.93 147.04 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 110.974 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 725' ' ' LEU . 2.9 m -168.78 5.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.379 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -134.56 78.87 55.25 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.474 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -60.28 137.7 76.51 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.917 1.744 . . . . 0.0 112.198 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' A' ' 730' ' ' ASP . 30.6 tp -179.23 112.87 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.541 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.551 ' O ' ' N ' ' A' ' 732' ' ' GLN . 5.5 m-20 51.32 100.1 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.2 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . 0.402 ' HB3' ' SD ' ' A' ' 646' ' ' MET . 76.8 Cg_exo -46.51 -7.07 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.53 0 C-N-CA 122.692 2.261 . . . . 0.0 112.257 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.551 ' N ' ' O ' ' A' ' 730' ' ' ASP . 92.1 mt-30 -71.75 -28.28 63.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.002 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 35.6 tp -66.7 -44.58 81.32 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.781 ' C ' HD23 ' A' ' 734' ' ' LEU . 7.0 tt -57.78 -47.06 83.61 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.256 0.551 . . . . 0.0 109.591 178.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 7.8 tt -62.94 -37.84 88.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.569 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 55.2 m -58.06 -39.34 78.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.487 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.0 m -59.97 -41.94 93.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.587 179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 44.2 mt -64.42 -35.22 80.21 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.232 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.462 ' C ' ' N ' ' A' ' 741' ' ' LEU . 47.8 tt0 -62.1 -34.43 76.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.413 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -48.52 -13.01 0.22 Allowed Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.544 ' O ' ' N ' ' A' ' 743' ' ' PRO . 14.1 tp -79.01 -25.06 43.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.58 0.229 . . . . 0.0 110.487 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.575 ' CB ' ' CD ' ' A' ' 743' ' ' PRO . 1.9 m 30.08 -85.53 0.0 OUTLIER Pre-proline 0 CA--C 1.532 0.285 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.416 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.575 ' CD ' ' CB ' ' A' ' 742' ' ' CYS . 11.3 Cg_endo -56.44 119.18 6.22 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 120.377 1.171 . . . . 0.0 111.354 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -77.79 -1.36 11.53 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.633 2.222 . . . . 0.0 112.075 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.457 -179.903 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.522 ' N ' ' CE1' ' A' ' 629' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 82.48 22.26 58.81 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . 0.522 ' CE1' ' N ' ' A' ' 627' ' ' ALA . 35.1 m80 -89.74 133.51 34.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.595 ' C ' HD22 ' A' ' 631' ' ' LEU . 67.5 mt -113.99 135.78 52.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.936 0.398 . . . . 0.0 110.627 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.595 HD22 ' C ' ' A' ' 630' ' ' ILE . 2.4 mm? -110.53 137.25 48.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.629 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 17.6 tp -126.58 125.81 42.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.582 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.752 HD23 ' SG ' ' A' ' 686' ' ' CYS . 24.8 tp -110.81 115.53 29.69 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.617 ' O ' ' NE1' ' A' ' 656' ' ' TRP . 85.7 tt0 -159.59 161.2 35.09 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.804 -179.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.476 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 92.5 mt-10 -112.99 158.84 19.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.775 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 74.23 119.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.208 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.555 ' O ' ' OG1' ' A' ' 641' ' ' THR . 93.3 m-20 -57.5 -36.72 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.422 -179.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.781 ' O ' HG23 ' A' ' 642' ' ' VAL . 84.0 tt0 -63.69 -43.62 96.08 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.677 -179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.589 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -77.46 -45.42 25.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.517 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.5 -43.18 90.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.959 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.555 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 61.3 m -63.85 -42.91 97.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.215 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 638' ' ' GLU . 51.2 t -55.59 -53.27 38.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.034 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.94 -42.57 89.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 0.0 110.431 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.545 ' SG ' HG13 ' A' ' 654' ' ' VAL . 3.3 t -60.93 -41.77 96.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.579 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -62.02 -38.44 88.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.621 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . 0.483 ' SD ' ' HB3' ' A' ' 731' ' ' PRO . 61.2 ttp -70.09 -52.1 26.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.956 0.408 . . . . 0.0 110.681 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 83.6 mt -64.73 -44.9 88.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.039 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.512 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 59.1 m -56.66 -40.99 76.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.075 179.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -64.06 -29.41 70.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.935 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -65.27 -5.22 6.59 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.892 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.61 -8.12 71.29 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -95.41 147.93 23.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.666 0.269 . . . . 0.0 110.424 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -91.71 129.63 37.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.991 0.424 . . . . 0.0 110.604 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.545 HG13 ' SG ' ' A' ' 644' ' ' CYS . 11.3 p -127.91 140.19 49.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.404 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 66.5 mt -108.65 133.4 53.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.129 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.618 ' C ' HD22 ' A' ' 657' ' ' LEU . 18.2 t90 -91.82 126.01 36.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.947 0.403 . . . . 0.0 110.835 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.618 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.1 mm? -112.24 145.62 39.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.463 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.553 HG12 ' CZ2' ' A' ' 656' ' ' TRP . 19.2 m -106.74 -3.97 10.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.753 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -151.59 132.36 14.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.693 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -60.25 -40.74 97.76 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . 0.421 ' N ' ' OG ' ' A' ' 685' ' ' SER . 81.5 p -62.08 -39.96 94.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.89 0.376 . . . . 0.0 110.739 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 54.8 m -64.44 -37.65 88.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.089 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.605 ' O ' ' CB ' ' A' ' 667' ' ' LEU . . . -61.96 -41.09 97.59 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.327 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.678 HD21 ' HG ' ' A' ' 689' ' ' LEU . 86.0 mt -59.43 -41.62 89.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -63.25 -43.04 99.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.324 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -89.89 -52.15 5.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.175 0.512 . . . . 0.0 111.197 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.605 ' CB ' ' O ' ' A' ' 663' ' ' ALA . 8.9 tt -48.24 -33.83 9.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.056 -178.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.62 ' OD1' ' N ' ' A' ' 669' ' ' LEU . 46.4 p-10 -57.88 -38.77 76.37 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.34 -0.544 . . . . 0.0 110.46 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.62 ' N ' ' OD1' ' A' ' 668' ' ' ASP . 63.3 mt -79.75 -24.46 41.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.967 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.495 HD12 HD11 ' A' ' 631' ' ' LEU . 23.4 mt -71.9 -38.66 69.92 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.858 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.429 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 74.6 mm-40 48.9 62.67 11.78 Favored Pre-proline 0 C--N 1.329 -0.326 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.429 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 60.6 Cg_endo -79.52 159.62 25.52 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 C-N-CA 123.36 2.707 . . . . 0.0 112.485 -179.22 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 73.5 mt -94.9 -23.27 5.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.52 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . . . . . . . . . 51.7 t -138.8 133.52 41.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.162 0.506 . . . . 0.0 110.7 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 77.3 mt -128.2 121.22 55.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.958 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.446 HD12 ' N ' ' A' ' 676' ' ' LEU . 4.9 mp -105.29 128.92 53.7 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.832 ' SD ' HD13 ' A' ' 689' ' ' LEU . 70.5 mtm -142.02 142.8 32.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.184 -0.606 . . . . 0.0 111.552 -179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.621 ' HB1' ' HD2' ' A' ' 680' ' ' PRO . . . -65.78 152.57 44.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.883 178.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.752 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 72.5 t-105 -106.07 -23.79 0.19 Allowed Pre-proline 0 C--N 1.326 -0.45 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.357 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.752 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.3 Cg_endo -100.32 29.29 0.12 Allowed 'Trans proline' 0 C--N 1.312 -1.373 0 C-N-CA 123.219 2.613 . . . . 0.0 114.6 178.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.546 ' CD ' ' C ' ' A' ' 679' ' ' TRP . 63.4 Cg_endo -77.22 143.88 22.83 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.513 1.475 . . . . 0.0 111.903 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -66.97 -20.69 50.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.486 2.124 . . . . 0.0 112.12 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.404 ' C ' ' H ' ' A' ' 685' ' ' SER . 84.9 m-20 -87.27 117.38 25.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.109 -179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -65.65 -1.42 2.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.299 179.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . 0.421 ' OG ' ' N ' ' A' ' 661' ' ' SER . 23.7 t -59.85 -34.44 73.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.437 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.752 ' SG ' HD23 ' A' ' 633' ' ' LEU . 0.6 OUTLIER -59.96 -41.89 92.9 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.168 0.509 . . . . 0.0 109.782 179.511 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.37 -32.72 74.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.675 179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 84.0 mt -67.82 -37.39 81.89 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.015 179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.832 HD13 ' SD ' ' A' ' 677' ' ' MET . 8.0 tt -57.92 -45.33 86.72 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -62.04 -39.72 93.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.878 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -62.98 -46.07 89.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.252 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -55.84 -55.03 37.32 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.33 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 697' ' ' GLN . 51.1 mt -55.8 -38.81 70.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.776 179.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 694' ' ' ARG . 39.9 ttm180 -62.62 -35.75 80.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.275 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -65.68 -35.76 81.71 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.123 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.532 ' O ' ' CD ' ' A' ' 700' ' ' PRO . 0.7 OUTLIER -133.68 38.33 3.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.037 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.529 ' N ' ' O ' ' A' ' 693' ' ' LEU . 21.2 pt20 -62.82 -26.38 68.71 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 -179.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -86.28 -13.73 45.81 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.415 ' CB ' ' HD3' ' A' ' 700' ' ' PRO . 0.0 OUTLIER -73.96 -55.5 3.13 Favored Pre-proline 0 CA--C 1.534 0.329 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.942 -179.725 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.532 ' CD ' ' O ' ' A' ' 696' ' ' HIS . 85.8 Cg_endo -87.95 -158.53 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 122.862 2.375 . . . . 0.0 112.256 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -105.53 102.6 38.68 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.749 179.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -43.12 109.07 0.12 Allowed 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.509 2.139 . . . . 0.0 112.4 -179.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.47 162.63 17.03 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.953 2.436 . . . . 0.0 112.087 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 61.4 mt -77.41 133.9 38.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.324 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.469 ' O ' ' N ' ' A' ' 722' ' ' SER . 52.8 t -125.47 132.51 70.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.956 0.408 . . . . 0.0 111.428 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.519 HD22 HD11 ' A' ' 734' ' ' LEU . 5.2 mp -116.92 134.28 54.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.188 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -110.99 127.47 55.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.93 0.395 . . . . 0.0 110.984 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . 0.82 ' N ' HD12 ' A' ' 708' ' ' LEU . 4.5 mp -96.74 145.54 25.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.522 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 105.3 -129.37 9.78 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.62 164.09 27.88 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.831 0.348 . . . . 0.0 110.507 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -72.93 160.83 45.1 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.865 2.377 . . . . 0.0 112.444 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.505 ' CD ' HD13 ' A' ' 724' ' ' ILE . 18.4 Cg_endo -62.7 156.11 55.09 Favored 'Trans proline' 0 C--N 1.306 -1.671 0 C-N-CA 123.019 2.48 . . . . 0.0 112.28 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.603 HG12 ' O ' ' A' ' 713' ' ' VAL . 22.0 t -83.42 10.3 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -161.76 140.43 7.19 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.324 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.07 -9.53 23.74 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 122.766 2.311 . . . . 0.0 112.753 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 43.7 tp -68.5 -35.2 77.17 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.351 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.582 ' O ' ' N ' ' A' ' 721' ' ' ALA . 81.7 mt -76.06 -31.85 59.0 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 97.4 m -61.82 -43.21 99.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.853 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.99 -40.86 95.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -74.74 -31.66 61.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.604 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . 0.582 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -72.62 142.45 48.35 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 705' ' ' VAL . 65.2 p -85.36 -23.73 27.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.278 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -173.05 163.3 4.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.436 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.505 HD13 ' CD ' ' A' ' 712' ' ' PRO . 72.4 mt -143.09 124.35 11.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.944 0.402 . . . . 0.0 110.665 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.691 ' N ' HD12 ' A' ' 725' ' ' LEU . 5.7 mp -104.51 153.6 20.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.615 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.43 18.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.433 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 42.4 tttm -139.3 88.47 12.9 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.447 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.658 ' O ' ' CB ' ' A' ' 729' ' ' LEU . 50.3 Cg_exo -48.49 144.73 13.26 Favored 'Trans proline' 0 C--N 1.307 -1.656 0 C-N-CA 122.52 2.146 . . . . 0.0 111.894 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.658 ' CB ' ' O ' ' A' ' 728' ' ' PRO . 13.5 tp 103.46 156.65 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.685 0.616 . . . . 0.0 110.246 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.474 ' N ' ' HG ' ' A' ' 729' ' ' LEU . 1.4 t70 61.74 63.48 2.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.952 0.406 . . . . 0.0 111.062 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . 0.494 ' O ' HD23 ' A' ' 735' ' ' LEU . 33.4 Cg_endo -67.11 -4.59 11.86 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.961 2.441 . . . . 0.0 111.817 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -69.24 -29.29 67.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.908 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.1 -44.68 88.04 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.204 -0.598 . . . . 0.0 109.681 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.519 HD11 HD22 ' A' ' 706' ' ' LEU . 42.1 tp -59.43 -42.16 91.21 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.94 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . 0.494 HD23 ' O ' ' A' ' 731' ' ' PRO . 2.7 mm? -62.34 -41.05 98.25 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.192 179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 36.1 m -59.23 -38.84 80.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.084 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 40.1 m -61.8 -43.03 99.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.796 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.94 -40.96 97.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.983 0.421 . . . . 0.0 110.129 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -64.99 -24.93 67.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.171 179.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -45.8 -20.36 0.42 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.55 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.402 ' N ' HD12 ' A' ' 741' ' ' LEU . 5.8 mp -81.22 -10.58 59.58 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.418 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 742' ' ' CYS . 36.5 t 54.52 62.37 8.43 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.905 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -78.31 116.63 3.92 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.089 1.859 . . . . 0.0 111.04 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -86.9 152.02 8.49 Favored 'Trans proline' 0 C--N 1.308 -1.594 0 C-N-CA 122.703 2.269 . . . . 0.0 112.47 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 25.0 m120 . . . . . 0 C--O 1.22 -0.49 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.687 179.903 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 80.83 62.88 1.96 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . 0.52 ' CE1' ' HB3' ' A' ' 670' ' ' LEU . 13.9 p80 -84.53 164.43 18.76 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.723 ' HB ' HG22 ' A' ' 654' ' ' VAL . 64.1 mt -113.79 141.01 31.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 120.976 0.417 . . . . 0.0 111.522 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.666 HD23 HG23 ' A' ' 675' ' ' ILE . 9.9 tp -107.32 135.31 49.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.086 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . . . . . . . . . 33.2 tp -133.93 118.98 18.52 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.227 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.461 HD23 ' C ' ' A' ' 633' ' ' LEU . 8.2 tt -112.07 117.44 32.66 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.511 ' HG2' ' N ' ' A' ' 635' ' ' GLU . 88.1 tt0 -159.78 162.97 34.93 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.045 -179.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.511 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 95.3 mt-10 -97.35 167.9 10.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.897 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 61.55 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.928 0.394 . . . . 0.0 110.038 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.433 ' O ' ' OG1' ' A' ' 641' ' ' THR . 52.5 t0 -57.93 -36.95 73.22 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.919 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.503 ' O ' HG23 ' A' ' 642' ' ' VAL . 54.7 mp0 -65.16 -43.78 90.64 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.737 -178.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.65 -44.17 62.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.618 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.09 93.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.078 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 50.9 m -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.711 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 638' ' ' GLU . 55.8 t -55.58 -51.91 53.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.142 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 77.6 t -60.68 -46.67 95.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.514 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.55 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.5 OUTLIER -66.42 -33.93 76.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.672 -179.905 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . 0.462 ' N ' ' SG ' ' A' ' 644' ' ' CYS . 85.2 tt0 -60.37 -39.53 87.58 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.319 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 7.3 tpp -65.0 -50.59 65.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.103 0.478 . . . . 0.0 109.899 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.693 ' HB2' HG21 ' A' ' 654' ' ' VAL . 85.0 mt -67.36 -45.25 76.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.204 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.55 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 28.5 m -56.13 -43.52 78.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.622 179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 651' ' ' GLY . . . -69.66 -23.91 63.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -63.92 2.93 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.979 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 649' ' ' ALA . . . 97.12 -15.63 62.14 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.019 -0.832 . . . . 0.0 111.019 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . 0.406 ' O ' ' HA ' ' A' ' 648' ' ' THR . 96.7 m-85 -93.79 152.01 19.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -93.3 125.42 37.89 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.319 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.723 HG22 ' HB ' ' A' ' 630' ' ' ILE . 22.9 t -117.83 134.79 60.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.697 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . 0.547 HD12 HD13 ' A' ' 670' ' ' LEU . 44.7 mt -109.06 131.4 59.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.065 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.467 ' C ' HD12 ' A' ' 657' ' ' LEU . 22.5 t90 -95.53 121.66 37.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.176 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.517 HD12 ' N ' ' A' ' 657' ' ' LEU . 7.1 mp -116.2 146.59 42.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.685 179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.581 ' O ' HG22 ' A' ' 658' ' ' VAL . 8.8 p -123.26 21.45 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.625 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 660' ' ' GLY . 48.6 t0 -152.28 163.61 39.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.563 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.415 ' N ' ' OD1' ' A' ' 659' ' ' ASP . . . -100.4 -54.51 1.01 Allowed Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.98 -0.628 . . . . 0.0 111.824 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 33.7 m -57.21 -41.87 80.24 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.602 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 26.5 m -64.4 -35.15 79.96 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.584 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -62.44 -42.48 99.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.622 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.56 HD22 ' ND1' ' A' ' 692' ' ' HIS . 80.6 mt -59.49 -43.79 93.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.852 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -62.71 -41.94 99.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.484 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.409 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 94.2 mt-30 -89.28 -51.31 5.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.912 0.387 . . . . 0.0 111.298 -179.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.661 HD12 HD22 ' A' ' 631' ' ' LEU . 3.9 tt -45.81 -37.68 6.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.265 -178.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.511 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 90.7 m-20 -56.14 -38.63 71.1 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.935 -0.706 . . . . 0.0 109.923 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.48 -31.46 53.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.101 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.547 HD13 HD12 ' A' ' 655' ' ' ILE . 11.1 mt -72.48 -38.48 68.19 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.247 -178.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 10.0 mm-40 46.82 65.55 6.77 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 110.192 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.492 ' HB3' ' CE1' ' A' ' 629' ' ' HIS . 30.5 Cg_endo -68.99 152.81 73.23 Favored 'Trans proline' 0 C--N 1.306 -1.678 0 C-N-CA 123.159 2.572 . . . . 0.0 112.952 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.811 HG23 HG23 ' A' ' 674' ' ' VAL . 19.3 tt -95.5 -22.21 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.696 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.811 HG23 HG23 ' A' ' 673' ' ' ILE . 76.1 t -140.1 133.69 35.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.468 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.666 HG23 HD23 ' A' ' 631' ' ' LEU . 78.4 mt -123.31 122.31 64.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.574 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.675 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.0 mp -106.53 138.97 41.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.538 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.944 ' SD ' HD21 ' A' ' 690' ' ' LEU . 83.8 mtp -139.1 128.15 23.78 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -69.51 144.04 53.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.567 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.798 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 0.5 OUTLIER -113.68 -29.96 0.11 Allowed Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.151 179.474 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.798 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 41.0 Cg_exo -50.87 -40.09 57.92 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.293 1.996 . . . . 0.0 113.288 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 23.4 Cg_exo -60.58 166.19 10.22 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.97 1.78 . . . . 0.0 111.961 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.512 ' O ' ' O ' ' A' ' 683' ' ' ASP . 32.1 Cg_exo -52.0 -17.97 6.35 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.532 2.154 . . . . 0.0 112.009 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 682' ' ' PRO . 1.0 OUTLIER 58.24 132.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.988 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -176.8 -78.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.736 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 77.3 p -64.08 -30.65 71.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.969 0.414 . . . . 0.0 109.941 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 2.4 m -62.42 -32.69 73.57 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.019 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 79.0 mt -64.58 -31.56 72.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.486 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 82.7 mt -63.27 -42.67 99.14 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.036 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.437 HD12 HD21 ' A' ' 664' ' ' LEU . 25.4 tp -60.36 -42.83 96.56 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.944 HD21 ' SD ' ' A' ' 677' ' ' MET . 82.1 mt -61.58 -40.64 95.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.778 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -62.88 -40.29 97.09 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.874 -0.331 . . . . 0.0 111.062 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.56 ' ND1' HD22 ' A' ' 664' ' ' LEU . 12.1 t-80 -57.5 -51.54 69.02 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.456 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.559 ' O ' ' N ' ' A' ' 697' ' ' GLN . 62.5 mt -55.13 -43.15 73.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.345 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -64.44 -35.66 81.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -65.91 -32.25 73.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.121 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -149.92 49.62 0.92 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.454 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.716 HE21 ' CG ' ' A' ' 702' ' ' PRO . 60.8 tt0 -60.43 -48.83 80.05 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.169 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.543 ' O ' ' O ' ' A' ' 699' ' ' ASP . . . 35.75 -147.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.282 0.563 . . . . 0.0 111.723 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.543 ' O ' ' O ' ' A' ' 698' ' ' ALA . 41.1 t0 38.83 104.73 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.0 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -48.63 147.02 10.04 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 C-N-CA 122.394 2.063 . . . . 0.0 111.348 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.504 ' N ' ' CD ' ' A' ' 702' ' ' PRO . 0.0 OUTLIER 48.46 53.41 14.32 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 -178.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . 0.716 ' CG ' HE21 ' A' ' 697' ' ' GLN . 6.8 Cg_endo -51.44 171.55 0.14 Allowed 'Trans proline' 0 C--N 1.306 -1.685 0 C-N-CA 123.02 2.48 . . . . 0.0 112.176 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -53.38 144.15 51.19 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.583 2.189 . . . . 0.0 111.789 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.552 ' H ' HD12 ' A' ' 704' ' ' LEU . 5.6 mp -79.39 138.42 37.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.359 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.535 ' C ' HD12 ' A' ' 706' ' ' LEU . 36.1 t -118.28 127.0 75.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.875 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.796 ' N ' HD12 ' A' ' 706' ' ' LEU . 3.8 mp -115.63 129.85 56.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.942 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -109.15 128.23 54.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.014 0.435 . . . . 0.0 110.801 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 43.7 mt -95.44 149.97 20.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.561 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 101.34 -137.65 13.41 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -91.45 167.2 16.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.463 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.4 155.35 25.73 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 C-N-CA 122.548 2.166 . . . . 0.0 112.483 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.47 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 22.5 Cg_endo -63.34 161.12 32.14 Favored 'Trans proline' 0 C--N 1.304 -1.768 0 C-N-CA 123.26 2.64 . . . . 0.0 112.07 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 61.2 t -82.1 -71.62 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.511 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 714' ' ' ASP . 0.5 OUTLIER -70.97 148.07 94.29 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.663 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.91 -14.19 32.27 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.732 2.288 . . . . 0.0 112.222 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 74.2 mt -70.88 -31.52 68.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.411 ' O ' ' HB2' ' A' ' 721' ' ' ALA . 53.3 mt -77.03 -32.46 57.02 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 47.7 m -64.9 -43.54 92.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.039 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -66.18 -39.92 90.08 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.02 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -82.52 -11.55 58.38 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.454 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 717' ' ' LEU . . . -75.13 129.36 37.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.46 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 70.6 m -85.88 -23.0 27.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.057 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -168.44 139.37 2.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.351 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.551 ' C ' HD12 ' A' ' 725' ' ' LEU . 78.9 mt -123.73 126.11 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.656 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.794 ' N ' HD12 ' A' ' 725' ' ' LEU . 5.3 mp -106.82 151.9 24.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.679 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 60.7 p -167.1 -2.92 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.062 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 74.99 79.38 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.018 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -48.95 125.29 12.82 Favored 'Trans proline' 0 C--N 1.305 -1.726 0 C-N-CA 122.397 2.065 . . . . 0.0 111.858 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.948 ' O ' HD23 ' A' ' 729' ' ' LEU . 0.5 OUTLIER -179.78 134.27 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.488 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.54 ' C ' ' H ' ' A' ' 732' ' ' GLN . 4.1 m-20 56.03 75.1 0.62 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.723 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.59 -7.56 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.625 2.217 . . . . 0.0 111.719 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . 0.54 ' H ' ' C ' ' A' ' 730' ' ' ASP . 14.4 mm100 -70.7 -26.41 63.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.299 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 42.8 tp -65.43 -47.56 75.79 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.927 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 47.0 tp -58.13 -47.26 83.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.17 0.51 . . . . 0.0 109.662 178.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.6 tp -63.28 -38.65 91.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.133 179.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . 0.499 ' OG1' ' O ' ' A' ' 732' ' ' GLN . 59.5 m -58.29 -41.56 84.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.51 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . 0.41 HG21 HD21 ' A' ' 706' ' ' LEU . 56.2 m -61.32 -41.21 96.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.922 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 13.6 tp -63.64 -39.04 93.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.364 179.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.486 ' O ' ' N ' ' A' ' 741' ' ' LEU . 55.0 tp60 -65.29 -32.5 74.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.985 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -46.72 -11.15 0.05 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.983 -178.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.537 HD13 HD13 ' A' ' 673' ' ' ILE . 84.1 mt -79.86 -49.08 12.46 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.647 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 75.7 m 50.24 60.18 15.42 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.782 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -80.74 116.47 3.19 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.223 1.949 . . . . 0.0 111.247 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -86.19 150.0 9.32 Favored 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.662 2.242 . . . . 0.0 112.385 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . . . . . . . . . 21.1 m120 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.506 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 72.58 52.58 9.79 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -87.55 144.18 26.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.716 0.293 . . . . 0.0 110.738 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . . . . . . . . . 67.8 mt -119.21 132.37 69.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.621 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . . . . . . . . . 51.2 tp -115.3 134.51 55.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.982 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.834 ' C ' HD12 ' A' ' 632' ' ' LEU . 0.2 OUTLIER -136.41 134.39 37.71 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.628 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.809 ' N ' HD12 ' A' ' 632' ' ' LEU . 25.9 tp -108.41 123.2 48.49 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.543 ' OE2' ' HB1' ' A' ' 639' ' ' ALA . 86.2 tt0 -159.45 155.32 26.35 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.051 -0.66 . . . . 0.0 111.509 -179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.461 ' N ' ' HG2' ' A' ' 634' ' ' GLU . 75.8 mm-40 -95.76 167.01 11.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.492 179.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 62.48 112.41 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.654 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 52.9 p30 -64.94 -25.87 68.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.32 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.654 ' N ' ' OD1' ' A' ' 637' ' ' ASP . 97.7 mt-10 -63.74 -40.62 97.18 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.37 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . 0.543 ' HB1' ' OE2' ' A' ' 634' ' ' GLU . . . -71.8 -41.65 68.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.292 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.477 ' CB ' ' CD1' ' A' ' 656' ' ' TRP . . . -67.44 -39.87 85.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.09 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . . . . . . . . . 40.8 m -62.35 -44.09 97.3 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.796 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 638' ' ' GLU . 81.1 t -57.71 -50.47 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.8 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 72.3 t -58.66 -39.86 77.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.508 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.8 OUTLIER -59.04 -39.56 82.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -63.48 -36.79 84.93 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.782 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 59.8 mtt -68.75 -54.37 16.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.124 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . 0.552 ' N ' HD12 ' A' ' 647' ' ' LEU . 10.5 mp -67.08 -42.74 84.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.284 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 43.8 m -55.42 -42.53 74.27 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.456 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.07 -25.88 62.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.691 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -74.68 -5.01 40.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.992 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 94.92 -9.57 70.48 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -98.2 134.13 41.68 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -92.62 127.45 38.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.121 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.418 HG13 ' SG ' ' A' ' 644' ' ' CYS . 14.4 p -122.84 139.78 48.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.041 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 67.7 mt -107.33 131.0 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 110.72 -179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.545 ' CZ2' ' CG1' ' A' ' 658' ' ' VAL . 10.3 t90 -94.78 117.36 30.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.473 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.789 HD23 ' HB2' ' A' ' 663' ' ' ALA . 27.8 tp -116.44 149.73 38.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.546 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.545 ' CG1' ' CZ2' ' A' ' 656' ' ' TRP . 23.4 m -110.52 27.46 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.743 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.76 ' O ' HD13 ' A' ' 633' ' ' LEU . 67.9 m-20 -148.82 164.68 33.74 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.976 0.417 . . . . 0.0 111.143 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' A' ' 663' ' ' ALA . . . -109.47 -63.53 0.53 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 46.8 t -58.6 -40.78 84.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.0 110.725 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 25.6 m -62.64 -35.59 80.09 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 109.561 179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.789 ' HB2' HD23 ' A' ' 657' ' ' LEU . . . -60.13 -45.55 92.62 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.418 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.827 ' O ' HD12 ' A' ' 664' ' ' LEU . 0.1 OUTLIER -57.97 -42.72 85.61 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.097 -179.377 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . 0.508 ' N ' ' HG ' ' A' ' 664' ' ' LEU . 14.5 t70 -57.29 -39.6 76.05 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.158 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -94.56 -25.81 16.66 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.196 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.769 ' O ' HD23 ' A' ' 667' ' ' LEU . 7.5 tt -53.24 -35.22 59.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.022 -179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.682 ' O ' ' NE2' ' A' ' 671' ' ' GLN . 66.2 m-20 -54.92 -37.66 66.65 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.14 -0.624 . . . . 0.0 109.386 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 71.2 mt -76.76 -35.8 57.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.089 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.412 ' O ' ' C ' ' A' ' 671' ' ' GLN . 12.8 mt -70.44 -41.31 73.03 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.089 -178.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.682 ' NE2' ' O ' ' A' ' 668' ' ' ASP . 13.3 mt-30 41.35 64.64 5.15 Favored Pre-proline 0 C--N 1.331 -0.201 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -78.4 158.3 29.29 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 123.092 2.528 . . . . 0.0 113.47 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.868 HG23 HG23 ' A' ' 674' ' ' VAL . 5.9 tp -93.77 -21.28 6.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.554 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.868 HG23 HG23 ' A' ' 673' ' ' ILE . 62.1 t -142.19 137.75 29.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.539 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.508 ' C ' HD23 ' A' ' 676' ' ' LEU . 64.7 mt -127.07 120.24 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 -179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.645 HD23 ' N ' ' A' ' 676' ' ' LEU . 0.0 OUTLIER -107.37 134.1 50.93 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.156 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . . . . . . . . . 69.9 mtm -139.13 136.2 34.89 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.404 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . . . . . . . . . . . -66.59 144.88 56.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.382 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.742 ' H ' ' CD ' ' A' ' 680' ' ' PRO . 4.7 t-105 -113.13 -33.56 0.11 Allowed Pre-proline 0 C--N 1.331 -0.211 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.715 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.742 ' CD ' ' H ' ' A' ' 679' ' ' TRP . 20.1 Cg_exo -56.1 -43.0 60.65 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 C-N-CA 122.013 1.809 . . . . 0.0 112.696 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 84.7 Cg_endo -83.59 165.37 14.05 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 C-N-CA 122.739 2.293 . . . . 0.0 111.684 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -49.94 -82.1 0.02 OUTLIER 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.381 2.054 . . . . 0.0 111.655 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 56.07 43.67 26.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.876 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -57.71 -30.35 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.428 -179.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 94.2 p -64.61 -26.28 68.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.667 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.01 -28.29 67.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.544 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 71.0 mt -62.7 -36.26 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.969 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 90.0 mt -68.42 -37.84 80.68 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.768 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.488 HD23 ' C ' ' A' ' 689' ' ' LEU . 8.6 tt -56.58 -46.37 80.82 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.608 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 51.2 mt -62.44 -39.0 91.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.734 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -61.66 -41.04 96.97 Favored 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.394 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.612 ' CD2' HD13 ' A' ' 664' ' ' LEU . 32.2 t-80 -59.91 -48.39 81.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.911 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . . . . . . . . . 80.6 mt -53.95 -42.03 68.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.612 -0.435 . . . . 0.0 109.939 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.408 HH22 ' HB3' ' A' ' 716' ' ' LEU . 57.0 ttm-85 -65.73 -28.02 68.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.5 179.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.32 -39.32 89.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.901 -178.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.463 ' CG ' ' N ' ' A' ' 697' ' ' GLN . 2.2 p80 -140.88 -38.42 0.43 Allowed 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 119.844 -0.742 . . . . 0.0 112.342 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.463 ' N ' ' CG ' ' A' ' 696' ' ' HIS . 59.2 tp60 -59.66 -24.99 64.35 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.962 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.646 ' O ' ' CB ' ' A' ' 699' ' ' ASP . . . -85.18 144.57 28.08 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.657 0.265 . . . . 0.0 111.531 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.646 ' CB ' ' O ' ' A' ' 698' ' ' ALA . 38.3 t0 107.71 -39.4 0.0 OUTLIER Pre-proline 0 N--CA 1.469 0.486 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.049 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.525 ' CD ' ' C ' ' A' ' 698' ' ' ALA . 79.4 Cg_endo -85.32 -94.76 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 122.294 1.996 . . . . 0.0 111.534 179.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -130.61 76.33 77.56 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.769 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -48.39 128.04 16.87 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.871 2.38 . . . . 0.0 112.426 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -73.81 163.31 37.44 Favored 'Trans proline' 0 N--CA 1.492 1.423 0 C-N-CA 122.653 2.235 . . . . 0.0 112.015 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.76 ' H ' HD22 ' A' ' 704' ' ' LEU . 1.6 mm? -78.01 140.41 39.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.104 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 31.8 t -121.88 134.5 64.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.879 0.371 . . . . 0.0 111.127 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.797 HD22 ' HB3' ' A' ' 723' ' ' ALA . 47.4 mt -115.52 132.35 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.012 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -111.96 126.25 54.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.145 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 45.6 mt -94.64 148.32 22.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.387 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 90.38 -128.89 9.48 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -88.27 163.13 37.94 Favored Pre-proline 0 CA--C 1.532 0.274 0 C-N-CA 121.264 -0.174 . . . . 0.0 110.763 -179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -68.45 138.9 43.59 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.157 1.904 . . . . 0.0 112.036 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.431 ' HA ' ' NE1' ' A' ' 679' ' ' TRP . 53.7 Cg_exo -47.64 151.96 3.05 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.388 2.059 . . . . 0.0 112.496 179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.543 HG13 ' N ' ' A' ' 714' ' ' ASP . 8.1 p -83.78 -46.61 18.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.115 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . 0.543 ' N ' HG13 ' A' ' 713' ' ' VAL . 0.6 OUTLIER -72.24 147.56 90.58 Favored Pre-proline 0 N--CA 1.464 0.232 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.423 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -73.22 -24.99 16.25 Favored 'Trans proline' 0 N--CA 1.494 1.557 0 C-N-CA 122.913 2.408 . . . . 0.0 113.175 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.408 ' HB3' HH22 ' A' ' 694' ' ' ARG . 77.0 mt -70.22 -29.61 66.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.923 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.707 HD12 ' N ' ' A' ' 717' ' ' LEU . 7.4 mp -77.76 -41.5 37.34 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.511 -0.476 . . . . 0.0 109.892 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 41.6 m -63.91 -42.81 97.31 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.03 90.4 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.839 -0.618 . . . . 0.0 109.969 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 720' ' ' GLN . 7.4 tt0 -83.82 -13.96 52.45 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.979 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 717' ' ' LEU . . . -71.43 128.56 36.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.031 0.443 . . . . 0.0 110.809 -179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . . . . . . . . . 31.9 t -85.5 -24.65 27.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.466 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.797 ' HB3' HD22 ' A' ' 706' ' ' LEU . . . -171.27 159.52 5.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.182 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . . . . . . . . . 70.6 mt -136.39 125.93 38.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.779 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 50.7 mt -107.68 126.89 53.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.937 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 36.5 t -69.6 -87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.912 0.387 . . . . 0.0 110.358 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . 0.917 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 9.8 tttp -134.83 -34.49 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.833 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.917 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 36.9 Cg_exo -57.48 149.62 65.16 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.31 2.007 . . . . 0.0 112.659 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.48 -80.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.83 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 54.07 58.58 12.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.101 179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -63.9 -15.77 50.99 Favored 'Trans proline' 0 C--N 1.306 -1.663 0 C-N-CA 122.745 2.297 . . . . 0.0 112.165 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -70.78 -34.69 72.07 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.319 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 26.2 tp -68.85 -44.06 74.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.227 179.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.466 ' CD2' HD11 ' A' ' 647' ' ' LEU . 62.1 tp -53.19 -45.16 68.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.738 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.65 -40.22 96.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.218 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 58.3 m -58.6 -38.95 79.05 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.933 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . 0.474 HG21 HD21 ' A' ' 706' ' ' LEU . 88.1 m -60.6 -39.69 89.06 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.994 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.511 ' CD2' HG21 ' A' ' 674' ' ' VAL . 23.5 mt -63.57 -42.38 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.659 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.56 ' O ' ' N ' ' A' ' 741' ' ' LEU . 25.0 mt-30 -65.88 -28.71 69.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.244 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . 0.553 ' C ' ' O ' ' A' ' 739' ' ' GLN . . . -22.7 -45.76 0.01 OUTLIER Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.56 ' N ' ' O ' ' A' ' 739' ' ' GLN . 0.1 OUTLIER -86.62 -109.89 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.242 179.769 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . . . . . . . . . 86.4 m 58.12 60.95 5.77 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.576 -0.283 . . . . 0.0 111.066 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -81.23 117.04 3.1 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.144 1.896 . . . . 0.0 110.907 179.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . 0.601 ' O ' ' OD1' ' A' ' 745' ' ' ASN . 94.5 Cg_endo -86.0 142.55 7.7 Favored 'Trans proline' 0 C--N 1.309 -1.532 0 C-N-CA 122.619 2.213 . . . . 0.0 112.964 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . 0.601 ' OD1' ' O ' ' A' ' 744' ' ' PRO . 71.0 m-20 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.255 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . -63.8 140.2 43.88 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.764 -0.934 . . . . 0.0 110.764 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . 0.443 ' HD1' ' HB3' ' A' ' 672' ' ' PRO . 21.7 t-80 -85.76 120.65 27.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.582 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.429 ' CG2' HD13 ' A' ' 676' ' ' LEU . 52.9 mt -117.68 135.48 57.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-O 120.755 0.312 . . . . 0.0 111.467 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.455 HD13 HD12 ' A' ' 667' ' ' LEU . 7.6 tt -108.17 127.62 53.99 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.047 0.451 . . . . 0.0 110.316 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.427 ' HB2' ' CG1' ' A' ' 654' ' ' VAL . 50.9 tp -110.15 125.05 52.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.469 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 9.0 tt -112.2 110.49 20.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 178.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.785 ' OE1' ' HB2' ' A' ' 678' ' ' ALA . 75.9 mm-40 -155.72 166.46 33.43 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.944 -179.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -111.98 165.36 12.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.23 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . . . . . . . . . 43.3 tp10 65.76 121.12 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 111.078 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.526 ' OD1' ' CH2' ' A' ' 656' ' ' TRP . 81.6 m-20 -58.51 -37.18 75.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.023 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.55 ' O ' HG23 ' A' ' 642' ' ' VAL . 97.5 mt-10 -66.27 -45.26 81.12 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.061 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -71.7 -39.49 70.16 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.421 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . 0.636 ' HB1' ' CD1' ' A' ' 656' ' ' TRP . . . -68.35 -43.09 78.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.5 ' O ' ' N ' ' A' ' 645' ' ' GLU . 72.3 m -60.91 -43.55 98.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.285 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 638' ' ' GLU . 49.4 t -56.13 -54.18 30.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.771 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.65 -45.27 94.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.074 0.464 . . . . 0.0 110.112 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.598 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.4 OUTLIER -67.35 -41.0 85.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.893 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . 0.5 ' N ' ' O ' ' A' ' 641' ' ' THR . 86.0 tt0 -57.94 -40.6 80.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.923 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 80.8 mtp -67.04 -52.05 47.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.926 0.393 . . . . 0.0 110.428 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 80.4 mt -68.9 -43.28 75.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.826 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.598 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 34.5 m -56.24 -40.78 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.245 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -71.26 -25.85 62.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.684 179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.71 -3.51 22.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 93.56 2.41 65.39 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.096 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -96.45 141.87 29.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 117.386 0.593 . . . . 0.0 110.651 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 34.7 tttm -87.85 110.89 20.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.215 0.531 . . . . 0.0 109.691 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.427 ' CG1' ' HB2' ' A' ' 632' ' ' LEU . 81.5 t -116.52 136.85 52.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.97 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . . . . . . . . . 63.3 mt -108.9 133.42 54.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.851 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.636 ' CD1' ' HB1' ' A' ' 640' ' ' ALA . 23.8 t90 -92.96 111.59 23.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.756 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.794 ' CD2' ' HB2' ' A' ' 663' ' ' ALA . 22.7 tp -123.81 135.56 53.86 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.766 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.43 HG12 ' O ' ' A' ' 634' ' ' GLU . 21.1 m -105.72 -9.34 10.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.278 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.472 ' H ' ' HG ' ' A' ' 657' ' ' LEU . 89.6 m-20 -100.95 152.04 21.03 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -102.78 -56.7 0.8 Allowed Glycine 0 CA--C 1.531 1.047 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 31.5 t -58.66 -40.78 84.47 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.888 0.375 . . . . 0.0 110.675 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 28.3 m -61.03 -38.85 87.61 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.794 ' HB2' ' CD2' ' A' ' 657' ' ' LEU . . . -61.55 -40.7 95.65 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.617 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.833 HD21 HD12 ' A' ' 689' ' ' LEU . 44.5 mt -57.8 -46.42 84.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.808 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.61 -43.49 93.59 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.817 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.401 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 94.0 mt-30 -84.67 -44.87 13.02 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.952 0.406 . . . . 0.0 111.391 -178.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.713 HD23 ' C ' ' A' ' 667' ' ' LEU . 9.6 tt -50.32 -35.06 25.97 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.5 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . 0.439 ' CG ' ' O ' ' A' ' 664' ' ' LEU . 89.0 m-20 -55.36 -40.51 71.36 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.179 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 58.0 mt -74.5 -28.99 61.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.368 179.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 666' ' ' GLN . 31.4 mt -72.39 -35.17 68.37 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.268 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.537 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 13.4 mm-40 43.4 62.23 9.19 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.537 ' HD3' ' N ' ' A' ' 671' ' ' GLN . 3.6 Cg_exo -72.35 156.59 54.59 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.397 2.732 . . . . 0.0 113.335 -178.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . . . . . . . . . 70.9 mt -98.54 -27.52 3.66 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.263 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.609 HG22 ' HB2' ' A' ' 704' ' ' LEU . 38.8 t -137.04 132.97 47.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.511 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.547 ' C ' HD12 ' A' ' 676' ' ' LEU . 63.7 mt -128.67 125.21 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.227 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 676' ' ' LEU . 5.1 mp -103.82 129.69 51.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.898 178.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.81 ' SD ' HD21 ' A' ' 690' ' ' LEU . 10.6 ptp -143.52 140.1 30.12 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.253 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.785 ' HB2' ' OE1' ' A' ' 634' ' ' GLU . . . -67.04 152.58 45.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.374 178.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.732 ' N ' ' CD ' ' A' ' 680' ' ' PRO . 63.3 t-105 -106.4 -26.69 0.19 Allowed Pre-proline 0 C--O 1.233 0.217 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.362 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.732 ' CD ' ' N ' ' A' ' 679' ' ' TRP . 23.8 Cg_endo -101.55 29.22 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 123.428 2.752 . . . . 0.0 114.6 177.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 680' ' ' PRO . 66.1 Cg_endo -77.13 151.18 30.12 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.645 1.564 . . . . 0.0 111.966 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -71.82 -14.16 29.64 Favored 'Trans proline' 0 C--N 1.304 -1.792 0 C-N-CA 122.319 2.013 . . . . 0.0 112.376 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . . . . . . . . . 68.0 m-20 -87.63 112.47 22.36 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.777 0.323 . . . . 0.0 111.484 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -65.51 -8.98 22.26 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.902 179.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . . . . . . . . . 87.9 p -64.53 -23.16 67.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -178.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.551 ' SG ' ' N ' ' A' ' 687' ' ' LEU . 0.5 OUTLIER -62.57 -38.61 90.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.052 0.453 . . . . 0.0 109.839 179.088 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . 0.551 ' N ' ' SG ' ' A' ' 686' ' ' CYS . 76.0 mt -66.16 -35.83 81.51 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.992 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . 0.419 ' HA ' HD23 ' A' ' 688' ' ' LEU . 63.3 mt -66.52 -36.39 82.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.685 179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . 0.833 HD12 HD21 ' A' ' 664' ' ' LEU . 14.9 tp -59.56 -40.75 88.34 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . 0.81 HD21 ' SD ' ' A' ' 677' ' ' MET . 46.7 mt -59.61 -39.01 82.82 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.901 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 94.6 mm-40 -60.14 -42.21 94.39 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.62 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.7 ' HE2' ' CE1' ' A' ' 696' ' ' HIS . 4.1 t60 -62.63 -61.09 2.67 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.714 HD21 ' HA ' ' A' ' 690' ' ' LEU . 1.6 pp -54.55 -33.13 59.61 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.801 0.334 . . . . 0.0 110.868 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.526 ' N ' HD12 ' A' ' 693' ' ' LEU . 23.5 ttt85 -60.82 -42.46 97.73 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.027 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -69.2 -39.79 78.42 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.209 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.7 ' CE1' ' HE2' ' A' ' 692' ' ' HIS . 64.5 m170 -96.11 14.3 24.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.632 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 693' ' ' LEU . 20.1 pt20 -58.07 -29.73 65.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.101 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -83.81 118.63 24.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.922 0.391 . . . . 0.0 111.039 -179.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.585 ' O ' ' N ' ' A' ' 701' ' ' HIS . 20.9 p-10 -172.96 135.57 0.73 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.426 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -43.62 -11.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.253 1.969 . . . . 0.0 111.937 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.585 ' N ' ' O ' ' A' ' 699' ' ' ASP . 0.3 OUTLIER -126.34 71.1 70.88 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.211 179.468 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.93 114.02 0.84 Allowed 'Trans proline' 0 C--N 1.307 -1.622 0 C-N-CA 122.802 2.334 . . . . 0.0 112.126 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.58 140.44 23.92 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 122.303 2.002 . . . . 0.0 112.183 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.708 ' CD2' ' N ' ' A' ' 704' ' ' LEU . 0.5 OUTLIER -81.0 142.68 33.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.716 -179.771 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.739 ' C ' HD12 ' A' ' 706' ' ' LEU . 40.5 t -126.05 125.98 68.89 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.041 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.793 ' N ' HD12 ' A' ' 706' ' ' LEU . 4.9 mp -122.4 135.6 54.72 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.067 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -111.23 130.3 55.69 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.132 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 72.4 mt -96.85 146.46 24.9 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.541 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 88.2 -136.38 13.72 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 710' ' ' GLU . 0.3 OUTLIER -87.31 151.04 50.54 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.082 0.468 . . . . 0.0 110.85 -179.231 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -69.17 156.14 65.78 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 123.112 2.541 . . . . 0.0 112.945 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.684 ' O ' ' N ' ' A' ' 714' ' ' ASP . 29.4 Cg_endo -67.53 3.68 1.68 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.871 2.38 . . . . 0.0 112.292 179.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . . . . . . . . . 55.2 t 60.42 -38.84 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.684 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . 0.684 ' N ' ' O ' ' A' ' 712' ' ' PRO . 52.1 m-20 -70.08 133.15 87.93 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.38 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -73.91 -19.53 20.61 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 122.312 2.008 . . . . 0.0 113.088 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . 0.448 ' H ' HD12 ' A' ' 716' ' ' LEU . 5.3 mp -71.36 -40.82 70.38 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.295 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 43.3 mt -76.56 -37.09 57.14 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.652 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . . . . . . . . . 31.8 m -63.37 -39.68 95.19 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.64 91.96 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.784 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -78.97 -20.23 49.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.548 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . 0.477 ' CB ' HD11 ' A' ' 724' ' ' ILE . . . -71.38 142.79 50.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.53 -179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.408 ' HB3' ' H ' ' A' ' 705' ' ' VAL . 91.9 p -85.95 -29.02 23.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.33 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . . . . . . . . . . . -167.2 129.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.477 HD11 ' CB ' ' A' ' 721' ' ' ALA . 18.2 mm -98.19 128.3 49.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.542 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 725' ' ' LEU . 6.1 mp -107.68 145.02 33.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.674 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 727' ' ' LYS . 12.3 t -164.86 -16.4 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.062 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . 0.424 ' H ' ' H ' ' A' ' 726' ' ' SER . 0.1 OUTLIER -129.96 74.81 80.25 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.136 179.711 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -50.36 142.93 28.23 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.845 2.364 . . . . 0.0 112.748 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . 0.422 ' O ' ' O ' ' A' ' 730' ' ' ASP . 39.6 tp -174.43 93.17 0.08 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.402 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 729' ' ' LEU . 25.2 m-20 57.76 147.06 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.47 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -68.98 3.22 2.52 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 123.142 2.561 . . . . 0.0 112.319 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -67.42 -31.61 71.92 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.731 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 24.9 tp -67.69 -53.72 25.35 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.094 -0.642 . . . . 0.0 110.667 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.643 HD11 HD21 ' A' ' 676' ' ' LEU . 9.1 tt -57.15 -41.37 79.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.038 0.447 . . . . 0.0 110.76 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . . . . . . . . . 24.2 tp -60.03 -39.52 86.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 35.4 m -58.33 -39.42 79.4 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.388 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . . . . . . . . . 52.2 m -60.8 -43.33 98.28 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.901 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.425 ' CD2' HG21 ' A' ' 674' ' ' VAL . 57.6 mt -63.22 -37.01 85.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.108 0.48 . . . . 0.0 110.388 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -64.67 -29.18 70.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.082 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -50.69 -20.3 3.92 Favored Glycine 0 CA--C 1.526 0.748 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 741' ' ' LEU . 67.4 mt -81.66 -74.2 0.35 Allowed 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.436 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.405 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 98.5 m 51.36 59.62 15.35 Favored Pre-proline 0 C--N 1.326 -0.456 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.293 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.405 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 60.6 Cg_endo -77.54 116.5 4.09 Favored 'Trans proline' 0 C--N 1.302 -1.892 0 C-N-CA 122.465 2.11 . . . . 0.0 111.44 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . 0.553 ' HG2' ' H ' ' A' ' 745' ' ' ASN . 90.6 Cg_endo -86.44 -75.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.46 2.107 . . . . 0.0 112.469 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . 0.553 ' H ' ' HG2' ' A' ' 744' ' ' PRO . 25.6 t-20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.824 -1.084 . . . . 0.0 110.046 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 628' ' ' GLY . . . . . . . . . . . . . . . 108.62 78.41 1.07 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 629' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -89.09 131.27 35.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 110.376 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 630' ' ' ILE . . . . . 0.681 ' HB ' HG12 ' A' ' 654' ' ' VAL . 54.6 mt -114.67 141.54 30.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 631' ' ' LEU . . . . . 0.743 HD21 HD12 ' A' ' 670' ' ' LEU . 83.2 mt -103.9 131.5 51.06 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.209 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 632' ' ' LEU . . . . . 0.474 HD11 HG11 ' A' ' 643' ' ' VAL . 10.6 tp -124.18 117.36 24.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.011 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.469 ' O ' ' CG ' ' A' ' 634' ' ' GLU . 9.4 tt -117.21 120.1 37.24 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.386 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 634' ' ' GLU . . . . . 0.469 ' CG ' ' O ' ' A' ' 633' ' ' LEU . 92.4 mt-10 -158.56 170.29 22.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.194 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 635' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 636' ' ' GLU . 96.4 mt-10 -110.06 158.52 18.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.352 179.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 636' ' ' GLU . . . . . 0.529 ' HG2' ' H ' ' A' ' 638' ' ' GLU . 83.3 tt0 62.16 127.7 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.518 -0.473 . . . . 0.0 109.925 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 637' ' ' ASP . . . . . 0.706 ' OD1' ' N ' ' A' ' 638' ' ' GLU . 51.6 p30 -61.94 -29.97 70.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 638' ' ' GLU . . . . . 0.859 ' O ' HG23 ' A' ' 642' ' ' VAL . 50.8 tp10 -63.29 -41.11 98.95 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.058 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 639' ' ' ALA . . . . . . . . . . . . . . . -72.24 -45.62 59.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.946 0.403 . . . . 0.0 110.278 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 640' ' ' ALA . . . . . . . . . . . . . . . -69.58 -40.97 76.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.064 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 641' ' ' THR . . . . . 0.574 ' OG1' ' O ' ' A' ' 637' ' ' ASP . 67.1 m -62.47 -46.18 89.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.085 -179.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 642' ' ' VAL . . . . . 0.859 HG23 ' O ' ' A' ' 638' ' ' GLU . 89.4 t -56.77 -52.66 51.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.285 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 643' ' ' VAL . . . . . 0.474 HG11 HD11 ' A' ' 632' ' ' LEU . 98.4 t -60.31 -41.9 88.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.803 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 644' ' ' CYS . . . . . 0.505 ' O ' ' OG1' ' A' ' 648' ' ' THR . 0.7 OUTLIER -58.58 -42.39 87.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.779 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 645' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -62.1 -39.28 91.95 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.171 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 646' ' ' MET . . . . . . . . . . . . . 60.0 mtt -66.97 -50.14 63.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.061 0.457 . . . . 0.0 110.109 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 647' ' ' LEU . . . . . . . . . . . . . 73.1 mt -69.08 -46.03 68.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.293 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 648' ' ' THR . . . . . 0.505 ' OG1' ' O ' ' A' ' 644' ' ' CYS . 61.7 m -56.3 -41.98 76.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.105 0.479 . . . . 0.0 109.858 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 649' ' ' ALA . . . . . . . . . . . . . . . -68.95 -24.97 64.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.649 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 650' ' ' ALA . . . . . . . . . . . . . . . -71.72 -6.24 39.81 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.905 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . 96.41 -12.76 66.29 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 121.157 -0.544 . . . . 0.0 111.758 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 652' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -96.03 142.35 28.35 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.742 179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 653' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -92.77 134.34 35.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.184 179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 654' ' ' VAL . . . . . 0.681 HG12 ' HB ' ' A' ' 630' ' ' ILE . 4.0 m -122.99 153.66 28.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 121.025 0.441 . . . . 0.0 111.099 -179.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 655' ' ' ILE . . . . . 0.446 ' CD1' HD13 ' A' ' 670' ' ' LEU . 69.6 mt -108.96 135.44 47.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.708 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 656' ' ' TRP . . . . . 0.682 ' C ' HD22 ' A' ' 657' ' ' LEU . 18.9 t90 -92.7 126.1 37.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 111.241 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 657' ' ' LEU . . . . . 0.682 HD22 ' C ' ' A' ' 656' ' ' TRP . 3.9 mm? -115.12 143.2 45.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.677 179.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 658' ' ' VAL . . . . . 0.612 ' O ' ' OD1' ' A' ' 659' ' ' ASP . 82.2 t -98.28 -18.95 6.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.17 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 659' ' ' ASP . . . . . 0.612 ' OD1' ' O ' ' A' ' 658' ' ' VAL . 98.6 m-20 -147.85 150.13 33.58 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.473 179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 660' ' ' GLY . . . . . . . . . . . . . . . -65.49 -39.68 95.79 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 661' ' ' SER . . . . . . . . . . . . . 18.9 t -58.16 -40.34 81.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.759 0.314 . . . . 0.0 110.796 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 662' ' ' THR . . . . . . . . . . . . . 32.6 m -64.64 -38.94 92.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.478 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 663' ' ' ALA . . . . . 0.448 ' O ' ' N ' ' A' ' 667' ' ' LEU . . . -63.63 -46.41 85.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.495 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 664' ' ' LEU . . . . . 0.568 HD22 ' ND1' ' A' ' 692' ' ' HIS . 67.5 mt -59.39 -42.19 91.12 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.811 -0.355 . . . . 0.0 111.134 -179.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 665' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -62.74 -40.13 96.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.804 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 666' ' ' GLN . . . . . 0.403 ' O ' ' HG ' ' A' ' 670' ' ' LEU . 26.3 mt-30 -84.63 -42.93 14.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.097 0.475 . . . . 0.0 110.66 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 667' ' ' LEU . . . . . 0.776 HD23 ' C ' ' A' ' 667' ' ' LEU . 8.7 tt -45.29 -44.6 11.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.215 -179.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -58.56 -35.02 71.7 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 61.9 mt -76.25 -38.52 56.2 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.928 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.743 HD12 HD21 ' A' ' 631' ' ' LEU . 0.1 OUTLIER -77.41 -41.7 38.98 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.709 -178.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 671' ' ' GLN . . . . . 0.463 ' N ' ' HD3' ' A' ' 672' ' ' PRO . 8.0 mm-40 58.88 62.71 4.18 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.077 0.465 . . . . 0.0 109.899 -178.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 672' ' ' PRO . . . . . 0.521 ' HG3' HD11 ' A' ' 631' ' ' LEU . 50.5 Cg_endo -80.35 165.76 20.76 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.365 2.71 . . . . 0.0 112.554 -179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 673' ' ' ILE . . . . . 0.408 ' CG2' HD22 ' A' ' 741' ' ' LEU . 97.2 mt -94.92 -19.63 6.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.139 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 674' ' ' VAL . . . . . 0.672 HG13 HG23 ' A' ' 630' ' ' ILE . 14.9 p -141.05 141.92 30.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.309 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.711 HD12 HD12 ' A' ' 631' ' ' LEU . 12.9 mm -119.93 124.51 72.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.134 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 676' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' A' ' 706' ' ' LEU . 51.1 mt -107.07 126.8 52.82 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 677' ' ' MET . . . . . 0.453 ' SD ' HG13 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -141.9 135.16 29.19 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.931 -0.707 . . . . 0.0 112.383 -178.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 678' ' ' ALA . . . . . 0.586 ' O ' ' SG ' ' A' ' 686' ' ' CYS . . . -68.09 152.55 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.67 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 679' ' ' TRP . . . . . 0.599 ' CG ' ' O ' ' A' ' 679' ' ' TRP . 74.6 t-105 -125.23 49.73 3.63 Favored Pre-proline 0 CA--C 1.531 0.244 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.286 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.518 ' HD3' ' N ' ' A' ' 679' ' ' TRP . 95.0 Cg_endo -84.2 135.07 6.18 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.547 2.165 . . . . 0.0 111.319 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 681' ' ' PRO . . . . . 0.608 ' C ' ' H ' ' A' ' 683' ' ' ASP . 16.3 Cg_exo -51.27 -47.42 25.99 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 C-N-CA 121.93 1.754 . . . . 0.0 113.305 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 682' ' ' PRO . . . . . 0.564 ' HD2' ' N ' ' A' ' 681' ' ' PRO . 32.7 Cg_endo -65.91 29.58 0.1 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.69 1.594 . . . . 0.0 111.163 -179.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 683' ' ' ASP . . . . . 0.608 ' H ' ' C ' ' A' ' 681' ' ' PRO . 21.9 t70 -151.27 71.93 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.043 -179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 684' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -63.53 0.35 0.76 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.532 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 685' ' ' SER . . . . . 0.45 ' H ' ' C ' ' A' ' 683' ' ' ASP . 20.4 m -61.45 -33.41 73.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.299 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 686' ' ' CYS . . . . . 0.586 ' SG ' ' O ' ' A' ' 678' ' ' ALA . 91.0 m -59.05 -27.34 65.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.919 0.39 . . . . 0.0 110.342 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 687' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.68 -33.3 75.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.31 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 688' ' ' LEU . . . . . . . . . . . . . 61.3 mt -67.56 -39.1 84.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.301 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 689' ' ' LEU . . . . . . . . . . . . . 67.6 mt -60.53 -42.26 96.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.416 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 88.0 mt -60.5 -44.1 96.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.868 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 691' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -61.99 -38.78 89.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.904 -179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 692' ' ' HIS . . . . . 0.568 ' ND1' HD22 ' A' ' 664' ' ' LEU . 9.9 t-160 -56.86 -50.12 73.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.0 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 693' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 697' ' ' GLN . 61.3 mt -55.07 -42.85 73.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.999 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 694' ' ' ARG . . . . . 0.753 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 84.2 mtp180 -67.68 -33.1 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.172 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -65.81 -32.15 73.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.488 -178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 696' ' ' HIS . . . . . 0.608 ' C ' ' H ' ' A' ' 698' ' ' ALA . 84.6 m-70 -126.25 -59.42 1.32 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.613 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 697' ' ' GLN . . . . . 0.639 ' N ' ' OE1' ' A' ' 697' ' ' GLN . 1.0 OUTLIER -63.85 19.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.374 -179.372 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.753 ' HB2' ' O ' ' A' ' 694' ' ' ARG . . . -86.02 21.7 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.898 0.38 . . . . 0.0 110.568 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 699' ' ' ASP . . . . . 0.591 ' H ' ' HD2' ' A' ' 700' ' ' PRO . 0.1 OUTLIER -168.73 -51.08 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.578 179.871 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 700' ' ' PRO . . . . . 0.591 ' HD2' ' H ' ' A' ' 699' ' ' ASP . 53.1 Cg_exo -52.41 -135.35 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.578 0 C-N-CA 122.801 2.334 . . . . 0.0 112.054 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 701' ' ' HIS . . . . . 0.484 ' CD2' ' O ' ' A' ' 701' ' ' HIS . 39.6 p-80 -116.64 89.67 28.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.197 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -47.89 130.78 19.99 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.738 2.292 . . . . 0.0 112.549 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 703' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -74.97 166.35 29.41 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 C-N-CA 122.687 2.258 . . . . 0.0 111.791 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.65 HD11 HG22 ' A' ' 737' ' ' THR . 6.4 tt -77.26 125.58 29.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.453 HG13 ' SD ' ' A' ' 677' ' ' MET . 61.2 t -122.81 132.9 70.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 121.121 0.486 . . . . 0.0 111.706 -179.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 706' ' ' LEU . . . . . 0.716 ' CD2' ' HB3' ' A' ' 723' ' ' ALA . 19.7 mt -118.35 135.92 54.04 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.692 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 707' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -107.88 121.57 45.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.599 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 708' ' ' LEU . . . . . . . . . . . . . 40.3 mt -98.94 134.55 41.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.164 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 709' ' ' GLY . . . . . . . . . . . . . . . 134.1 -138.01 9.74 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.411 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 710' ' ' GLU . . . . . 0.603 ' N ' ' CD ' ' A' ' 710' ' ' GLU . 0.9 OUTLIER -93.59 -176.93 0.62 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.674 0.273 . . . . 0.0 111.017 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.558 ' CD ' ' CB ' ' A' ' 710' ' ' GLU . 19.4 Cg_exo -61.74 157.49 42.36 Favored 'Trans proline' 0 N--CA 1.494 1.537 0 C-N-CA 122.719 2.28 . . . . 0.0 112.323 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 712' ' ' PRO . . . . . 0.678 ' HB3' HD11 ' A' ' 717' ' ' LEU . 29.1 Cg_endo -65.45 146.07 84.36 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.174 2.583 . . . . 0.0 112.778 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 713' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 713' ' ' VAL . 54.4 t -84.22 -15.65 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.715 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 714' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -162.12 150.08 12.04 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.905 0.383 . . . . 0.0 110.398 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 715' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -64.4 -9.75 21.36 Favored 'Trans proline' 0 C--N 1.304 -1.774 0 C-N-CA 122.913 2.408 . . . . 0.0 112.939 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 49.4 mt -70.15 -39.88 75.1 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.767 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.759 ' C ' HD12 ' A' ' 717' ' ' LEU . 1.9 pp -80.56 -37.34 31.57 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 718' ' ' THR . . . . . 0.548 ' N ' HD12 ' A' ' 717' ' ' LEU . 30.9 m -63.83 -40.85 97.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.608 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.04 91.43 Favored 'General case' 0 CA--C 1.523 -0.084 0 CA-C-O 121.029 0.442 . . . . 0.0 109.998 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 720' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -74.25 -37.72 63.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.378 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 721' ' ' ALA . . . . . . . . . . . . . . . -71.98 144.57 48.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.594 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 722' ' ' SER . . . . . 0.413 ' CB ' ' HG ' ' A' ' 704' ' ' LEU . 4.7 m -85.65 -23.15 27.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 723' ' ' ALA . . . . . 0.716 ' HB3' ' CD2' ' A' ' 706' ' ' LEU . . . -170.47 163.99 8.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.371 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 724' ' ' ILE . . . . . 0.408 HD13 HG21 ' A' ' 724' ' ' ILE . 31.6 mt -139.88 128.77 27.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.927 -179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 37.0 mt -106.9 125.41 50.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.131 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 726' ' ' SER . . . . . . . . . . . . . 59.0 m -72.1 -90.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.404 -179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 727' ' ' LYS . . . . . 0.891 ' H ' ' CD ' ' A' ' 728' ' ' PRO . 26.9 tttt -130.71 -32.44 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 728' ' ' PRO . . . . . 0.891 ' CD ' ' H ' ' A' ' 727' ' ' LYS . 48.0 Cg_exo -53.78 151.15 26.79 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.26 1.973 . . . . 0.0 112.08 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 71.8 mt -57.54 -51.11 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.673 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 730' ' ' ASP . . . . . 0.477 ' N ' ' HD3' ' A' ' 731' ' ' PRO . 82.2 m-20 40.74 57.22 8.19 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.966 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 731' ' ' PRO . . . . . 0.477 ' HD3' ' N ' ' A' ' 730' ' ' ASP . 68.1 Cg_endo -82.55 -28.11 1.91 Allowed 'Trans proline' 0 C--N 1.307 -1.607 0 C-N-CA 122.567 2.178 . . . . 0.0 112.045 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 732' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -73.5 -37.39 65.7 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 733' ' ' LEU . . . . . . . . . . . . . 49.5 tp -67.31 -40.51 86.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.862 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 27.5 tp -55.55 -47.22 76.69 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.932 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 735' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 735' ' ' LEU . 9.4 tt -64.21 -44.42 91.99 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.271 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 736' ' ' THR . . . . . . . . . . . . . 91.3 m -61.2 -38.2 85.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.598 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 737' ' ' THR . . . . . 0.65 HG22 HD11 ' A' ' 704' ' ' LEU . 39.9 m -60.93 -42.54 98.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.202 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 738' ' ' LEU . . . . . . . . . . . . . 49.3 mt -63.6 -38.78 92.42 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.389 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 739' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' A' ' 741' ' ' LEU . 97.0 mt-30 -64.49 -34.5 78.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.937 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 740' ' ' GLY . . . . . . . . . . . . . . . -60.64 1.68 0.69 Allowed Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.38 -0.688 . . . . 0.0 111.38 -179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 741' ' ' LEU . . . . . 0.501 ' H ' ' C ' ' A' ' 739' ' ' GLN . 63.1 tp -82.84 -15.87 49.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.797 0.332 . . . . 0.0 110.602 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 742' ' ' CYS . . . . . 0.447 ' N ' ' HD3' ' A' ' 743' ' ' PRO . 0.5 OUTLIER 60.22 65.74 2.18 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.015 0.436 . . . . 0.0 110.594 179.832 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 743' ' ' PRO . . . . . 0.447 ' HD3' ' N ' ' A' ' 742' ' ' CYS . 3.0 Cg_exo -70.5 116.34 4.59 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.133 1.889 . . . . 0.0 110.583 179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 744' ' ' PRO . . . . . 0.506 ' HG2' ' H ' ' A' ' 745' ' ' ASN . 94.4 Cg_endo -88.52 -72.86 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.448 2.099 . . . . 0.0 112.611 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 745' ' ' ASN . . . . . 0.506 ' H ' ' HG2' ' A' ' 744' ' ' PRO . 4.5 p30 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.501 -179.864 . . . . . . . . 1 1 . 1 stop_ save_