data_2bn6_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 2bn6 _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 ' 654' ' ' TYR . . . . . 0.499 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 . . . . . 0 CA--C 1.513 -0.474 0 CA-C-O 120.839 0.352 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.603 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.4 OUTLIER -76.15 19.21 0.24 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.636 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.499 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -104.18 -42.05 5.63 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -58.83 -38.9 79.7 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.497 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -75.57 -35.94 60.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.8 179.086 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.452 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -71.05 -16.04 62.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.567 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.02 -37.97 69.66 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.257 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -62.65 -46.07 89.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.888 0.375 . . . . 0.0 110.753 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.459 ' CD1' ' HB3' ' A' ' 667' ' ' LYS . 10.0 m-85 -54.86 -28.83 53.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.601 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 7.3 mmt85 -63.24 -20.08 65.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.877 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.03 -15.6 9.25 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 20.4 t -91.71 25.83 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.858 0.361 . . . . 0.0 110.341 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.88 65.28 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.72 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.459 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 3.0 mttt -124.36 16.24 9.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.94 0.4 . . . . 0.0 110.825 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.402 HG12 ' HD2' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -46.16 -31.58 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.214 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -60.04 2.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.931 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -22.64 57.3 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 675' ' ' GLU . . . -61.62 -32.27 72.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.352 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -52.44 -36.12 53.87 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.943 0.402 . . . . 0.0 110.489 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.56 -67.95 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.317 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.603 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -59.6 -17.58 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.712 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 671' ' ' ALA . 72.7 tt0 -78.79 -26.13 44.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.368 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -71.6 -19.14 62.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.309 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.44 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -76.21 -23.47 54.61 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.729 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.36 -28.49 67.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.126 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 4.3 tptt . . . . . 0 C--O 1.231 0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.102 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.515 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 120.908 0.385 . . . . 0.0 111.578 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.533 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -77.26 23.46 0.2 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.34 0.591 . . . . 0.0 110.685 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.515 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -108.38 -37.1 6.07 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.875 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.457 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -63.0 -34.32 77.31 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.993 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.469 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . 2.4 m-90 -84.04 -35.43 23.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.46 ' N ' HD13 ' A' ' 674' ' ' ILE . . . -67.16 -18.78 65.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.84 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -70.56 -43.79 68.75 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-O 121.001 0.429 . . . . 0.0 110.749 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.457 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 71.8 m-85 -62.64 -48.89 77.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.453 ' HB3' ' HB1' ' A' ' 671' ' ' ALA . 13.8 m-85 -54.18 -37.61 64.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.675 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.407 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 1.1 mpt_? -68.98 -9.73 53.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.684 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 4.2 m -122.04 -22.86 5.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.408 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 35.6 m -93.44 31.65 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.85 0.357 . . . . 0.0 110.715 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.11 65.41 Favored Glycine 0 CA--C 1.506 -0.505 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.037 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.448 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -120.04 19.64 12.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.201 0.524 . . . . 0.0 110.444 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.407 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 1.4 mp -47.83 -32.01 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.611 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -70.28 -60.75 2.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.308 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.14 -22.19 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.136 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.453 ' HB1' ' HB3' ' A' ' 662' ' ' TYR . . . -61.9 -37.85 86.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.207 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.09 -30.89 7.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.825 0.345 . . . . 0.0 110.476 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.78 -69.81 0.28 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.185 0.517 . . . . 0.0 110.484 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.469 ' CD1' ' HB2' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -62.2 -17.51 18.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.27 179.471 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' A' ' 671' ' ' ALA . 3.9 tt0 -76.2 -28.96 57.45 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 178.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -73.13 -9.97 59.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.147 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.533 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.2 OUTLIER -91.26 -9.51 44.9 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.934 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.435 ' N ' ' HB2' ' A' ' 655' ' ' SER . 3.4 tm? -73.03 -29.91 63.35 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.428 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.7 tptp . . . . . 0 C--N 1.333 -0.137 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.876 179.902 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.536 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.8 p90 . . . . . 0 CA--C 1.512 -0.519 0 CA-C-O 121.011 0.434 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.611 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -75.26 21.22 0.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.705 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.536 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -105.93 -42.29 5.17 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.12 -37.3 82.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.469 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -74.55 -36.52 63.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.825 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.466 ' N ' ' CD1' ' A' ' 674' ' ' ILE . . . -71.16 -13.05 61.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.663 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.38 -38.04 63.26 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.956 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -65.38 -50.52 65.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.859 0.361 . . . . 0.0 110.372 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.45 ' HB2' ' CB ' ' A' ' 671' ' ' ALA . 16.3 m-85 -52.87 -32.91 47.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.32 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.48 ' HA ' ' CG2' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -66.29 -12.06 54.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.297 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 5.1 p -134.91 20.04 3.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.826 0.346 . . . . 0.0 111.62 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 22.0 t -128.56 22.81 2.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.808 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.71 24.69 72.79 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.493 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.43 ' HG2' ' CD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -124.15 15.7 9.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.232 0.539 . . . . 0.0 110.643 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.48 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 10.0 pt -45.59 -33.81 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.559 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -67.98 -61.95 1.63 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.307 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -58.37 -22.35 53.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -63.94 -35.73 81.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.476 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.07 -39.55 59.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.837 0.351 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.87 -63.2 1.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.416 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.474 ' O ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -61.8 -13.79 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.805 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 671' ' ' ALA . 2.4 tm-20 -82.35 -27.89 31.9 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 110.486 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -76.74 -10.33 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.611 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -80.2 -25.14 39.81 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.008 178.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.437 ' N ' ' HB2' ' A' ' 655' ' ' SER . 2.4 pp -60.91 -27.95 68.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.717 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.7 tttt . . . . . 0 C--N 1.333 -0.134 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.559 179.733 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.519 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.6 p90 . . . . . 0 CA--C 1.512 -0.487 0 CA-C-O 120.892 0.377 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.547 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -77.75 25.63 0.2 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.543 0.687 . . . . 0.0 110.32 179.297 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -109.19 -36.63 5.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.447 ' NE2' ' CZ3' ' A' ' 658' ' ' TRP . 10.0 tt0 -63.22 -29.81 71.07 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.643 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.572 ' HB2' HD13 ' A' ' 674' ' ' ILE . 2.0 m-90 -87.47 -35.09 18.43 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . . . . . . . . . . . -77.06 -8.63 57.78 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.098 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -88.11 -47.59 8.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.285 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.517 ' CD1' ' O ' ' A' ' 658' ' ' TRP . 3.1 p90 -72.84 -21.95 60.87 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.199 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.452 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 5.2 m-85 -67.44 -32.72 73.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.454 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -67.4 -8.16 30.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.0 m -116.38 -22.73 8.65 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 31.2 m -96.44 35.42 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.982 0.42 . . . . 0.0 110.398 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.03 23.2 56.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.777 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.423 ' HD3' ' CD1' ' A' ' 662' ' ' TYR . 0.6 OUTLIER -111.87 19.0 18.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.001 0.429 . . . . 0.0 110.656 179.636 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.454 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 3.3 mt -49.21 -42.02 14.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.941 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -68.22 -54.74 15.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.471 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -23.25 66.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.433 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 675' ' ' GLU . . . -65.23 -43.04 92.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.426 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -47.87 -35.22 10.03 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.745 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.74 -67.74 0.4 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.317 0.58 . . . . 0.0 110.3 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.572 HD13 ' HB2' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -55.0 -31.52 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.924 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -60.31 -32.69 71.46 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.949 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.16 -23.19 67.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.626 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.418 ' O ' ' CZ ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -80.9 -16.7 52.9 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.386 179.146 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.464 ' N ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -75.12 -23.29 57.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.1 mttp . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 179.448 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.491 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.4 p90 . . . . . 0 CA--C 1.513 -0.448 0 CA-C-O 120.886 0.374 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.512 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.1 OUTLIER -75.96 17.33 0.34 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.938 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.491 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -102.61 -45.24 5.1 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.6 -36.67 79.12 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.476 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.74 -30.58 59.25 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.972 179.164 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.417 ' CB ' HD11 ' A' ' 674' ' ' ILE . . . -80.48 -4.91 55.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.848 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.68 -38.08 26.4 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.771 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -66.86 -26.67 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.754 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.507 ' N ' ' CD1' ' A' ' 661' ' ' TYR . 3.7 m-85 -66.62 -37.35 84.67 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.072 0.463 . . . . 0.0 110.12 179.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.422 ' HG3' ' HA ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -64.57 -11.12 31.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.795 -179.782 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.69 -26.34 11.37 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 19.6 t -96.28 35.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.037 0.446 . . . . 0.0 110.288 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.81 28.32 57.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.536 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.421 ' HD3' ' CD1' ' A' ' 662' ' ' TYR . 12.2 mttm -116.59 18.09 15.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 111.14 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.422 ' HA ' ' HG3' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -49.71 -30.05 5.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.71 -56.76 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.09 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.05 -23.34 65.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.002 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 675' ' ' GLU . . . -61.47 -40.82 95.89 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.174 179.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.52 -33.19 3.86 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.726 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.07 -68.29 0.37 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.481 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.512 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -59.72 -19.1 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.472 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 1.4 tt0 -72.91 -30.02 63.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -23.57 67.48 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.271 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.445 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.22 -15.22 59.57 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.695 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.25 -23.78 54.52 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.875 0.369 . . . . 0.0 111.199 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.978 0.418 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.482 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -127.14 18.08 7.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.495 0.664 . . . . 0.0 110.559 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.03 -35.58 4.05 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.3 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.521 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 1.6 tt0 -76.53 -12.38 60.02 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.279 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.52 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 1.6 m-90 -106.03 -31.88 8.54 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.563 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -79.83 -15.06 58.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.294 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.402 ' HG3' ' CD1' ' A' ' 661' ' ' TYR . 11.4 pt-20 -78.81 -34.18 45.56 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 120.723 0.297 . . . . 0.0 110.857 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.521 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 45.9 m-85 -70.85 -47.05 61.45 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.56 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.483 ' HB2' ' CB ' ' A' ' 671' ' ' ALA . 21.9 m-85 -60.43 -35.33 75.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.194 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.432 ' HA ' ' CG2' ' A' ' 668' ' ' ILE . 0.1 OUTLIER -65.8 -13.8 60.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.342 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 36.3 p -118.86 -20.82 8.04 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 20.2 t -93.83 32.19 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.45 24.43 56.12 Favored Glycine 0 CA--C 1.507 -0.462 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.847 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 2.3 mmpt? -116.67 19.37 14.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.072 0.463 . . . . 0.0 110.346 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.432 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 15.3 pt -44.16 -33.21 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.14 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -67.76 -59.92 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.168 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.33 -25.94 60.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.116 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.483 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -59.33 -38.89 81.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.13 179.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.73 -32.14 5.52 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.445 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -69.73 0.27 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.339 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.563 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -57.06 -23.51 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.029 179.364 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.88 -29.55 70.5 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.1 mtpt -69.41 -15.88 63.38 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.926 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.476 ' HB ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -73.54 -21.02 60.49 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.317 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.442 ' N ' ' CB ' ' A' ' 655' ' ' SER . 0.2 OUTLIER -54.03 -29.54 44.17 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.72 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.4 tttt . . . . . 0 CA--C 1.534 0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.116 179.03 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.414 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 4.5 p90 . . . . . 0 CA--C 1.513 -0.454 0 CA-C-O 121.006 0.432 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.514 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.6 OUTLIER -84.91 23.51 1.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.073 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -112.0 -38.15 4.88 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.097 178.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.436 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.8 tt0 -65.84 -26.9 67.87 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.535 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -90.18 -35.75 15.19 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.448 ' CB ' ' HG2' ' A' ' 675' ' ' GLU . . . -80.51 -2.77 47.45 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.335 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -94.22 -42.59 8.87 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.081 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.535 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 4.1 p90 -76.62 -15.35 59.85 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.393 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.53 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 8.6 m-85 -73.79 -30.2 62.62 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.439 ' HD2' HG13 ' A' ' 668' ' ' ILE . 6.4 mmt85 -69.94 -9.08 53.8 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.575 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 16.2 m -126.46 14.44 7.66 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 26.0 t -132.57 34.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.221 0.534 . . . . 0.0 109.714 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.85 26.03 64.71 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.625 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.42 ' HD3' ' CE1' ' A' ' 662' ' ' TYR . 14.0 mttp -122.42 16.05 10.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 111.315 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.439 HG13 ' HD2' ' A' ' 663' ' ' ARG . 5.0 tt -51.0 -36.03 15.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -75.76 -45.97 33.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.475 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.73 -25.99 66.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.231 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . . . . . . . . . . . -63.18 -33.22 75.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.331 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -51.96 -35.53 46.5 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.552 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.22 -67.47 0.42 Allowed 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.794 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 658' ' ' TRP . 0.7 OUTLIER -59.8 -19.14 16.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.487 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.448 ' HG2' ' CB ' ' A' ' 659' ' ' ALA . 1.0 OUTLIER -65.31 -33.78 76.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.596 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -17.55 64.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.323 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.514 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.23 -11.37 57.87 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.473 ' N ' ' HB2' ' A' ' 655' ' ' SER . 21.8 tp -65.72 -30.95 71.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.337 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.158 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.548 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.459 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.1 p90 . . . . . 0 CA--C 1.516 -0.362 0 CA-C-O 120.917 0.389 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.42 ' O ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -85.22 20.43 1.96 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.114 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -114.23 -37.44 4.39 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.088 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.469 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.3 tt0 -66.8 -26.58 67.01 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.149 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.53 ' O ' ' CD2' ' A' ' 662' ' ' TYR . 2.0 m-90 -90.53 -31.59 16.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.551 ' CB ' HG13 ' A' ' 674' ' ' ILE . . . -80.61 -6.49 58.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.847 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.25 -37.28 11.61 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.598 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.519 ' CD1' ' HA ' ' A' ' 658' ' ' TRP . 3.7 p90 -79.71 -17.41 53.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.449 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.535 ' CE2' HG22 ' A' ' 674' ' ' ILE . 6.7 m-85 -73.32 -29.45 62.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.979 0.419 . . . . 0.0 109.909 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm-85 -69.32 -9.93 55.56 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.412 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 6.2 t -116.67 -23.43 8.18 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 29.9 m -94.4 33.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.002 0.43 . . . . 0.0 110.353 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 55.48 29.29 53.22 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.608 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.447 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -119.41 17.62 12.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.134 0.492 . . . . 0.0 111.185 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 4.8 tt -50.0 -30.57 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.643 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.43 -61.42 1.79 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.532 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -58.27 -24.49 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.813 0.339 . . . . 0.0 110.124 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.469 ' HA ' ' CG2' ' A' ' 674' ' ' ILE . . . -62.33 -29.15 70.24 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.944 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -51.32 -49.88 60.5 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.04 -65.01 0.67 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.852 0.835 . . . . 0.0 109.838 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.551 HG13 ' CB ' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -50.49 -28.88 5.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.026 -1.443 . . . . 0.0 110.776 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.44 -24.99 62.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.523 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -81.24 -14.98 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.874 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -76.15 -26.65 56.48 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.35 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 12.3 tp -51.57 -29.82 18.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.999 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.1 tttt . . . . . 0 CA--C 1.533 0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.456 179.514 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.462 ' C ' ' H ' ' A' ' 656' ' ' ALA . 7.3 p90 . . . . . 0 CA--C 1.514 -0.442 0 CA-C-O 120.885 0.374 . . . . 0.0 111.621 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.549 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -79.52 22.23 0.46 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.462 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -109.43 -44.36 3.91 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.024 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -61.97 -27.02 68.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.513 ' C ' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -91.2 -22.84 20.43 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.085 179.214 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.464 ' HB1' HD11 ' A' ' 674' ' ' ILE . . . -89.05 -6.09 57.39 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.6 -35.51 27.01 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.895 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.2 OUTLIER -70.99 -30.05 66.19 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.685 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.481 ' N ' ' CD1' ' A' ' 661' ' ' TYR . 3.8 m-85 -63.18 -34.56 77.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.237 0.541 . . . . 0.0 109.969 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.421 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.7 OUTLIER -72.57 -1.95 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.71 -27.03 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.449 HG11 ' HB2' ' A' ' 667' ' ' LYS . 13.2 p -97.95 35.91 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.041 0.448 . . . . 0.0 110.486 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.23 27.05 66.87 Favored Glycine 0 CA--C 1.508 -0.365 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.209 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.449 ' HB2' HG11 ' A' ' 665' ' ' VAL . 3.6 mttt -114.67 20.97 14.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.074 0.464 . . . . 0.0 110.696 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.421 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 5.5 mt -48.26 -32.33 3.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.371 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -39.42 28.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.495 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -25.49 62.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.43 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -63.53 -33.41 75.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.177 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -51.21 -31.68 21.28 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.477 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.91 -69.78 0.27 Allowed 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.437 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.513 HD13 ' C ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -58.77 -21.99 20.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.85 -24.67 65.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -17.6 64.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.298 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.549 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.4 OUTLIER -89.93 -1.7 58.02 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.839 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.437 ' N ' ' HB2' ' A' ' 655' ' ' SER . 6.1 tt -79.72 -30.2 40.89 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.583 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.258 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.281 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.461 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.5 p90 . . . . . 0 CA--C 1.516 -0.345 0 CA-C-O 120.599 0.238 . . . . 0.0 111.545 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -80.07 23.73 0.45 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.119 0.485 . . . . 0.0 110.607 179.317 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.461 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -109.79 -44.52 3.81 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -63.26 -35.94 82.02 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.528 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -77.46 -35.22 54.05 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.52 178.74 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.482 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -71.32 -13.81 62.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.553 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.59 -38.72 54.41 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -64.53 -41.85 96.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.454 ' HB2' ' CB ' ' A' ' 671' ' ' ALA . 15.5 m-85 -57.78 -28.1 63.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -71.44 -8.72 55.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.358 179.666 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 p -121.7 -23.76 5.46 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.411 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 29.7 m -92.78 31.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.831 0.348 . . . . 0.0 110.741 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.76 29.44 67.33 Favored Glycine 0 CA--C 1.506 -0.508 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.092 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 6.4 mmtt -119.82 18.35 12.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.1 0.476 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.416 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 2.2 mt -46.66 -32.75 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.564 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.5 -47.96 18.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.359 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -65.59 -24.12 67.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.165 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.454 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -62.72 -38.03 88.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.451 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -51.01 -32.07 20.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.939 0.4 . . . . 0.0 110.497 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.93 -69.26 0.31 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.542 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.5 HD12 ' HB3' ' A' ' 658' ' ' TRP . 0.6 OUTLIER -57.67 -24.46 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.661 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.473 ' N ' HG13 ' A' ' 674' ' ' ILE . 6.2 mt-10 -63.36 -25.38 68.27 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.699 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -5.45 44.86 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.384 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.408 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -93.25 -15.14 26.19 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.405 ' CD1' ' HB1' ' A' ' 656' ' ' ALA . 19.1 tp -64.64 -31.78 73.14 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.817 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 6.9 mttp . . . . . 0 C--N 1.333 -0.126 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.497 179.463 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.466 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 . . . . . 0 CA--C 1.514 -0.431 0 CA-C-O 121.023 0.44 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.488 ' OG ' ' C ' ' A' ' 677' ' ' THR . 0.3 OUTLIER -80.16 24.69 0.41 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.411 0.624 . . . . 0.0 110.719 179.752 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.466 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -110.78 -39.36 4.87 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.194 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.442 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.2 OUTLIER -68.34 -22.14 64.7 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.771 -179.778 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.561 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.1 m-90 -93.78 -36.41 12.29 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.41 ' HA ' ' HB2' ' A' ' 671' ' ' ALA . . . -77.79 -7.5 56.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.159 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -90.06 -46.3 8.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.15 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.561 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.4 p90 -73.88 -21.77 59.97 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.031 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.52 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 3.9 m-85 -66.88 -32.61 73.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.419 ' HG3' HG13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -71.93 -4.27 27.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.634 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.3 18.54 4.88 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 14.8 p -136.74 32.88 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.043 0.449 . . . . 0.0 109.82 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.73 26.14 66.5 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.542 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.411 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 2.1 tptt -123.71 17.47 9.51 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.112 0.482 . . . . 0.0 111.18 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.419 HG13 ' HG3' ' A' ' 663' ' ' ARG . 4.8 tt -52.25 -35.35 19.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.569 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.5 -48.73 30.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.494 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -24.71 67.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.146 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.41 ' HB2' ' HA ' ' A' ' 659' ' ' ALA . . . -63.26 -37.83 88.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.49 -33.76 32.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.996 0.427 . . . . 0.0 110.534 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.12 -67.58 0.43 Allowed 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.714 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.425 HD13 ' O ' ' A' ' 674' ' ' ILE . 0.6 OUTLIER -58.34 -22.8 20.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.275 179.546 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -34.24 75.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.988 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -74.3 -7.26 52.18 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.659 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.488 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -88.39 -19.91 25.97 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 177.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.462 ' N ' ' HB2' ' A' ' 655' ' ' SER . 3.1 tm? -60.39 -28.95 68.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.564 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.189 0 CA-C-O 121.038 0.447 . . . . 0.0 110.381 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.415 ' C ' ' H ' ' A' ' 656' ' ' ALA . 5.6 p90 . . . . . 0 CA--C 1.515 -0.379 0 CA-C-O 120.947 0.403 . . . . 0.0 111.447 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.644 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.8 OUTLIER -82.16 22.13 0.84 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.771 179.854 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.415 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -110.63 -44.33 3.69 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.911 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -62.97 -38.19 90.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.514 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -74.61 -33.01 62.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.397 178.572 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.51 ' CB ' HD13 ' A' ' 674' ' ' ILE . . . -74.58 -9.07 58.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -82.0 -37.56 26.4 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 120.731 0.3 . . . . 0.0 111.011 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -64.52 -40.64 95.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.409 . . . . 0.0 110.703 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.459 ' HB2' ' CB ' ' A' ' 671' ' ' ALA . 14.5 m-85 -57.19 -28.93 63.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.795 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 8.2 mmt85 -73.65 -6.81 49.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.259 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.8 t -133.68 24.23 4.01 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.451 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 32.9 m -140.71 28.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.114 0.483 . . . . 0.0 109.975 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.5 27.01 72.09 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.764 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.422 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 1.2 mptt -125.7 16.02 8.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.984 0.421 . . . . 0.0 110.954 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.418 ' N ' ' O ' ' A' ' 662' ' ' TYR . 10.3 tt -48.19 -30.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.409 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -83.89 -37.05 22.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.129 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.29 -25.64 62.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.083 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.459 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -62.06 -34.12 75.68 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.397 179.272 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -52.26 -35.25 49.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.927 0.394 . . . . 0.0 110.467 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -68.3 0.37 Allowed 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.462 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.51 HD13 ' CB ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -58.02 -22.58 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.718 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.451 ' HG2' ' CB ' ' A' ' 659' ' ' ALA . 2.3 mm-40 -64.58 -24.61 67.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.173 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.39 59.09 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.211 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.644 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -86.54 -15.03 41.22 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.677 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.497 ' N ' ' HB2' ' A' ' 655' ' ' SER . 21.7 tp -61.2 -31.77 71.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.291 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.157 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.449 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.491 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 120.645 0.26 . . . . 0.0 111.672 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.622 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.5 OUTLIER -98.27 26.96 4.95 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.721 0.772 . . . . 0.0 109.753 178.803 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -109.33 -34.34 6.58 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.981 178.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.472 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -65.31 -37.78 88.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.581 ' HB2' HD13 ' A' ' 674' ' ' ILE . 3.2 m-90 -79.89 -38.41 32.68 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.513 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -62.4 -18.97 62.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.222 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -75.32 -35.66 61.18 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 70.3 m-85 -66.49 -42.43 87.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.97 0.414 . . . . 0.0 110.843 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.458 ' HB3' ' O ' ' A' ' 667' ' ' LYS . 22.2 m-85 -57.5 -30.53 65.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.869 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm180 -68.97 -12.59 61.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.274 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -120.84 -24.49 5.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.432 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 25.7 m -91.32 30.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.911 0.386 . . . . 0.0 110.617 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.84 36.6 80.66 Favored Glycine 0 CA--C 1.505 -0.564 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.217 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 12.4 mmtt -128.1 16.48 6.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.02 0.438 . . . . 0.0 111.047 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.447 HG22 HD11 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.84 -30.31 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.418 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.66 -60.96 1.98 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.065 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.87 -22.7 59.68 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.436 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -59.3 -36.38 75.49 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.132 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.58 -36.9 11.33 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.16 -69.15 0.3 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.362 0.601 . . . . 0.0 110.263 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.622 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -55.97 -23.55 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.254 179.444 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.496 ' O ' ' HB2' ' A' ' 678' ' ' LEU . 9.4 tt0 -76.6 -14.86 59.96 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.971 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -81.71 -21.8 37.75 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.907 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.522 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -73.16 -17.76 61.34 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.22 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 675' ' ' GLU . 0.2 OUTLIER -50.67 -37.47 41.11 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.06 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.211 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.917 178.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.443 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.7 p90 . . . . . 0 CA--C 1.515 -0.379 0 CA-C-O 120.838 0.351 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.437 ' HA ' ' CD1' ' A' ' 674' ' ' ILE . 0.1 OUTLIER -84.59 21.11 1.56 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.436 0.636 . . . . 0.0 110.388 179.12 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -112.74 -36.1 5.28 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.234 178.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.443 ' O ' ' CD2' ' A' ' 661' ' ' TYR . 1.4 tt0 -67.75 -34.81 77.56 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.702 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.483 ' HB2' HD13 ' A' ' 674' ' ' ILE . 2.4 m-90 -83.09 -40.73 19.44 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.531 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -71.0 -12.49 61.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.939 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -95.37 -30.83 13.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 120.897 0.38 . . . . 0.0 110.234 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.443 ' CD2' ' O ' ' A' ' 657' ' ' GLN . 22.3 m-30 -79.59 -30.88 41.69 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.19 179.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.48 ' HB3' ' O ' ' A' ' 667' ' ' LYS . 15.7 m-85 -65.85 -33.82 76.72 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.684 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 38.3 mmm-85 -68.46 -12.62 61.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.424 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.8 m -124.06 -21.16 5.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.408 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 11.8 m -93.31 28.04 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.878 0.371 . . . . 0.0 110.735 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.25 38.15 95.73 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 121.144 -0.55 . . . . 0.0 112.498 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 6.2 mttp -133.09 18.32 4.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.123 0.487 . . . . 0.0 110.395 178.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.43 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -46.96 -30.15 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.418 179.356 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -77.81 -50.41 12.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.406 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.62 -17.75 65.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.413 ' HA ' HG23 ' A' ' 674' ' ' ILE . . . -64.88 -36.65 85.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.523 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.53 -33.45 31.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.821 0.344 . . . . 0.0 110.479 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.6 -68.66 0.36 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.507 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -54.19 -24.05 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.315 179.625 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.97 73.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -74.45 -21.81 59.42 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.826 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -70.5 -20.98 62.8 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.43 ' N ' ' HB2' ' A' ' 655' ' ' SER . 1.8 tp -50.17 -32.82 17.19 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.648 178.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.213 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.045 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.477 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.2 p90 . . . . . 0 CA--C 1.512 -0.505 0 CA-C-O 120.958 0.408 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.477 ' HB3' ' N ' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -79.31 22.84 0.41 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.422 0.629 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.477 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -108.67 -37.89 5.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.057 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.487 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.1 tt0 -67.41 -22.03 65.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.809 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.553 ' HA ' ' CD1' ' A' ' 661' ' ' TYR . 2.5 m-90 -92.72 -34.17 14.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 109.247 178.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.43 ' CB ' ' CG ' ' A' ' 675' ' ' GLU . . . -80.26 -6.42 57.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.696 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.14 -39.93 10.31 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.326 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.553 ' CD1' ' HA ' ' A' ' 658' ' ' TRP . 3.5 p90 -77.72 -19.32 55.42 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.089 179.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.474 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 5.2 m-85 -68.21 -33.96 75.37 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.425 ' HG3' HG13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -61.3 -14.1 24.18 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.667 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 42.4 p -108.62 -25.27 10.97 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 13.4 p -95.82 34.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.26 30.59 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.911 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.433 ' HD2' ' CD1' ' A' ' 662' ' ' TYR . 13.7 mttt -119.6 16.65 12.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.08 0.467 . . . . 0.0 111.302 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.425 HG13 ' HG3' ' A' ' 663' ' ' ARG . 7.6 tt -49.69 -41.35 16.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.832 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.64 -57.85 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.507 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -22.49 64.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.399 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.402 ' HB1' ' CB ' ' A' ' 662' ' ' TYR . . . -66.21 -39.92 89.98 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.583 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.36 -34.2 32.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.15 -67.36 0.44 Allowed 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.363 0.601 . . . . 0.0 110.54 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.463 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.6 OUTLIER -56.04 -25.31 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.36 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.43 ' CG ' ' CB ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -60.05 -37.46 79.91 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.637 179.087 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.17 -19.09 62.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.876 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.407 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.74 -13.57 47.94 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.209 179.142 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.477 ' N ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -79.12 -22.77 44.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.859 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.906 0.384 . . . . 0.0 110.596 179.687 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.498 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.197 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.48 ' OG ' ' OG1' ' A' ' 677' ' ' THR . 0.4 OUTLIER -97.6 26.44 5.01 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.984 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -111.72 -36.74 5.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.362 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -30.52 70.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.128 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.545 ' HA ' ' CD1' ' A' ' 661' ' ' TYR . 2.2 m-90 -86.4 -34.55 20.15 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.529 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -81.45 -2.91 51.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.431 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -96.7 -42.77 7.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.925 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.545 ' CD1' ' HA ' ' A' ' 658' ' ' TRP . 2.8 p90 -75.51 -23.94 56.78 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.469 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 3.0 m-85 -65.47 -29.69 70.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.947 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.404 ' HD2' ' HA ' ' A' ' 668' ' ' ILE . 20.8 mmm-85 -69.32 -9.98 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.563 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -118.67 -22.79 7.31 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 14.6 p -94.35 33.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.04 0.448 . . . . 0.0 110.53 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.77 28.61 63.29 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.923 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -120.17 18.16 12.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 179.673 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.437 HD11 HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -51.52 -32.8 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.722 179.441 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.95 -54.36 8.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.166 179.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -22.66 66.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.083 179.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . . . . . . . . . . . -64.42 -34.26 77.78 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.577 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -53.26 -33.16 51.95 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.874 0.368 . . . . 0.0 110.454 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.75 -69.11 0.33 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.268 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.529 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -56.8 -23.21 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.803 179.197 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 678' ' ' LEU . 43.2 tt0 -66.92 -26.8 67.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.657 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -68.06 -20.81 64.99 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.484 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.48 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.05 -15.09 52.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.648 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 675' ' ' GLU . 10.8 tp -55.22 -37.46 67.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.195 178.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 mptt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.777 178.591 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.463 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.392 0 CA-C-O 121.015 0.436 . . . . 0.0 111.001 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.479 ' HB3' ' CB ' ' A' ' 677' ' ' THR . 0.1 OUTLIER -124.79 19.6 8.55 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.51 0.671 . . . . 0.0 110.715 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.21 -31.55 5.28 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.51 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.489 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -74.87 -24.41 58.56 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.43 -179.599 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.43 ' O ' ' CD2' ' A' ' 662' ' ' TYR . 1.6 m-90 -92.69 -33.15 14.46 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.543 ' CB ' HG13 ' A' ' 674' ' ' ILE . . . -75.48 -13.37 60.37 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.34 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.68 -33.36 47.07 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.43 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.489 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 59.4 m-85 -73.47 -45.44 54.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.676 0.274 . . . . 0.0 111.015 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.561 ' CE2' HG22 ' A' ' 674' ' ' ILE . 13.3 m-85 -64.43 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.946 0.403 . . . . 0.0 110.143 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.401 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.8 OUTLIER -67.51 -11.87 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.197 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 87.1 p -121.36 -24.15 5.51 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.445 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -91.86 30.27 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.772 0.32 . . . . 0.0 110.892 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.86 29.3 70.12 Favored Glycine 0 CA--C 1.505 -0.576 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.133 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.461 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 3.6 mtpp -121.67 19.55 11.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.179 0.514 . . . . 0.0 110.27 178.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.413 ' N ' ' O ' ' A' ' 662' ' ' TYR . 1.5 mp -46.58 -30.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.463 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -65.62 -57.33 8.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.926 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.74 -29.25 69.99 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.494 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -57.14 -29.78 63.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.783 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -48.94 -49.67 39.17 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.618 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.12 -65.67 0.56 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.887 0.851 . . . . 0.0 109.713 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.561 HG22 ' CE2' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -49.35 -35.5 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.841 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.24 -27.27 67.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -76.91 -11.81 59.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.943 179.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.479 ' CB ' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.6 -20.88 53.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.459 ' N ' ' CB ' ' A' ' 655' ' ' SER . 0.3 OUTLIER -52.24 -33.25 40.65 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.741 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.258 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.966 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.193 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.603 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 4.6 m -100.48 27.03 6.07 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.573 0.701 . . . . 0.0 109.644 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.421 ' HB1' ' CD2' ' A' ' 678' ' ' LEU . . . -108.72 -38.66 5.58 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.789 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.44 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.8 OUTLIER -59.15 -29.44 67.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.487 -179.61 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.44 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 2.0 m-90 -88.54 -33.55 17.69 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -67.57 -24.17 65.48 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.493 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -33.09 72.77 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.782 0.325 . . . . 0.0 111.59 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.439 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 62.8 m-85 -66.8 -46.86 73.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.517 ' CD2' HG22 ' A' ' 674' ' ' ILE . 23.9 m-85 -56.8 -30.88 64.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.942 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 10.2 mmm180 -61.38 -22.04 64.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.631 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.5 m -117.2 -16.14 10.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.824 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 18.5 t -92.53 27.41 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.814 0.34 . . . . 0.0 110.297 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.19 29.34 62.65 Favored Glycine 0 CA--C 1.505 -0.571 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.794 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.4 ' C ' ' HB3' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -124.48 14.94 8.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.091 0.472 . . . . 0.0 110.954 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 5.4 tt -44.95 -31.87 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.566 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -70.14 -62.42 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.193 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.53 -23.99 53.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.464 ' HA ' ' CG2' ' A' ' 674' ' ' ILE . . . -60.63 -26.62 67.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -49.36 -44.49 44.78 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -59.5 -67.14 0.41 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.495 0.664 . . . . 0.0 109.896 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.603 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.1 OUTLIER -51.03 -32.26 11.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.331 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 12.2 tt0 -72.49 -10.78 60.21 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.881 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.35 -13.63 37.44 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.607 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.499 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.19 -17.61 36.59 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 177.732 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.421 ' CD2' ' HB1' ' A' ' 656' ' ' ALA . 3.3 tm? -55.74 -34.66 65.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.41 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.853 178.464 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.46 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.9 OUTLIER . . . . . 0 CA--C 1.515 -0.398 0 CA-C-O 120.914 0.388 . . . . 0.0 110.804 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.421 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -83.86 19.39 1.73 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 110.394 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.403 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -113.66 -43.46 3.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.934 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -63.28 -34.86 78.61 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.416 ' C ' HD12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -80.23 -29.8 38.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.159 179.435 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.539 ' CB ' HD13 ' A' ' 674' ' ' ILE . . . -79.22 -13.36 59.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.189 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 663' ' ' ARG . 22.3 mt-10 -76.23 -36.7 58.42 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -67.53 -23.42 65.44 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.263 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.49 ' N ' ' CD1' ' A' ' 661' ' ' TYR . 5.0 m-85 -67.76 -58.07 5.25 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.062 0.458 . . . . 0.0 110.588 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -60.02 -7.65 1.9 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.812 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.1 m -90.96 -35.92 14.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.699 0.285 . . . . 0.0 111.368 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 22.3 t -99.36 37.06 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.095 0.474 . . . . 0.0 110.127 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.69 26.33 68.41 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.647 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.95 19.69 20.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 0.0 110.727 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.445 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 22.5 pt -45.85 -37.93 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.806 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . 0.41 ' N ' HG13 ' A' ' 668' ' ' ILE . 9.4 tt0 -67.25 -58.12 5.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -60.06 -23.0 63.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.684 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 659' ' ' ALA . . . -67.73 -38.3 83.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.72 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -52.3 -32.85 39.55 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.954 0.406 . . . . 0.0 110.499 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.64 -67.7 0.41 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.874 179.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.539 HD13 ' CB ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -61.47 -19.54 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.912 179.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.449 ' CG ' ' CB ' ' A' ' 659' ' ' ALA . 2.5 mt-10 -68.59 -27.1 65.75 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -71.5 -13.41 61.8 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.228 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.507 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.65 -23.24 56.27 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.041 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.416 ' N ' ' HB2' ' A' ' 655' ' ' SER . 12.7 tp -51.59 -30.04 19.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.049 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.565 179.485 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.443 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.4 p90 . . . . . 0 CA--C 1.514 -0.423 0 CA-C-O 120.693 0.282 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.533 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.3 OUTLIER -76.72 11.66 1.61 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.186 0.517 . . . . 0.0 110.63 179.246 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -92.51 -44.21 8.75 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -32.81 70.98 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.648 ' HB3' HD12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -82.21 -23.52 35.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.044 179.017 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.682 ' CB ' ' HB3' ' A' ' 675' ' ' GLU . . . -89.09 0.07 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.45 -39.24 16.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.548 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -70.29 -30.21 67.17 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.715 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.463 ' N ' ' CD1' ' A' ' 661' ' ' TYR . 3.4 m-85 -62.81 -35.49 80.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.13 0.49 . . . . 0.0 109.956 178.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.491 ' HA ' ' CG2' ' A' ' 668' ' ' ILE . 2.6 mpt_? -71.11 -2.76 16.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.935 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.6 m -109.93 -28.9 8.51 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 4.7 m -97.57 36.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.024 0.44 . . . . 0.0 110.311 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.7 27.08 61.02 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.569 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -111.31 19.41 18.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.04 0.448 . . . . 0.0 110.864 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.491 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 24.3 pt -47.18 -35.25 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.539 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -70.54 -49.57 46.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.765 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.68 -29.71 70.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.537 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.429 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -63.81 -33.27 75.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.187 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.489 ' HA ' ' HG2' ' A' ' 675' ' ' GLU . 2.8 mt-10 -58.93 -22.18 59.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.132 -179.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -81.8 -61.47 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.44 0.638 . . . . 0.0 110.319 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.648 HD12 ' HB3' ' A' ' 658' ' ' TRP . 0.8 OUTLIER -62.5 -25.51 38.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.047 -179.567 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.682 ' HB3' ' CB ' ' A' ' 659' ' ' ALA . 1.5 pp20? -69.82 -29.52 66.82 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.276 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -24.1 12.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.856 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.86 -20.22 59.83 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.556 179.387 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 1.1 pp -73.54 -19.56 60.88 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.109 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 pttt . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.821 0.343 . . . . 0.0 111.548 -179.898 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.574 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.1 OUTLIER -100.33 23.0 10.72 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.494 0.664 . . . . 0.0 110.336 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -108.9 -37.67 5.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.289 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.457 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.1 OUTLIER -64.78 -28.9 69.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.543 -179.745 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.493 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . 1.7 m-90 -88.37 -29.46 20.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.541 ' CB ' HG13 ' A' ' 674' ' ' ILE . . . -79.48 -7.18 58.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.443 179.004 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.17 -44.32 9.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.506 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.504 ' CZ ' ' CE1' ' A' ' 662' ' ' TYR . 3.8 p90 -74.6 -18.83 60.51 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.691 179.736 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.507 ' CE2' HG22 ' A' ' 674' ' ' ILE . 5.9 m-85 -72.07 -29.72 64.41 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.396 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.516 ' HA ' ' CG2' ' A' ' 668' ' ' ILE . 5.8 mmt180 -66.9 -10.06 44.64 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.374 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.18 -22.24 6.69 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.44 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 18.7 t -92.65 31.94 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.899 0.38 . . . . 0.0 110.391 179.368 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.33 27.17 52.57 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.577 -179.168 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 662' ' ' TYR . 2.4 mttt -115.37 16.73 16.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.111 0.481 . . . . 0.0 110.968 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.516 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 12.9 pt -47.25 -38.46 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.0 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.17 -64.34 0.91 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.578 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.42 -23.67 50.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.382 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.475 ' HA ' ' CG2' ' A' ' 674' ' ' ILE . . . -63.8 -31.37 72.52 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -50.01 -51.12 44.43 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.806 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -58.07 -62.47 1.8 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.741 0.781 . . . . 0.0 109.895 178.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.574 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -51.96 -25.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.342 179.835 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.47 ' O ' ' HG ' ' A' ' 678' ' ' LEU . 2.8 tt0 -76.14 -11.76 59.99 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.233 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.1 -10.73 40.91 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.696 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.81 -22.09 22.27 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.202 178.833 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 675' ' ' GLU . 3.8 pp -65.3 -25.96 67.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.812 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 CA--C 1.532 0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 178.562 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.552 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 . . . . . 0 CA--C 1.511 -0.528 0 CA-C-O 120.815 0.34 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.535 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.5 OUTLIER -74.74 20.2 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.168 0.508 . . . . 0.0 110.346 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.561 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -103.04 -42.58 5.75 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.07 178.781 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -48.34 77.52 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.503 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -72.45 -10.53 59.91 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.704 178.449 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.615 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -86.23 -19.51 29.87 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.319 -179.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.43 -20.19 48.12 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.174 -0.611 . . . . 0.0 110.62 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 658' ' ' TRP . 71.8 m-85 -86.73 -14.13 43.32 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.616 178.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.85 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -72.64 -35.01 67.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.301 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.85 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -82.09 10.91 5.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.374 179.977 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -128.03 -33.08 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.41 ' CG2' ' CG ' ' A' ' 667' ' ' LYS . 27.5 m -93.82 32.54 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.29 32.58 84.21 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 671' ' ' ALA . 29.5 mmtm -113.15 20.57 16.15 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.017 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.435 ' O ' ' HB1' ' A' ' 671' ' ' ALA . 2.1 mp -51.57 -25.63 5.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.127 179.684 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.22 -54.49 4.18 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.657 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.11 -18.42 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 177.048 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.738 ' HB2' ' CD1' ' A' ' 662' ' ' TYR . . . -53.1 -48.96 67.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.106 179.277 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.94 -19.27 6.34 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.599 -179.719 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -82.13 -58.24 3.04 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 120.778 0.323 . . . . 0.0 111.451 179.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.535 HD12 ' O ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -76.53 -3.63 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.05 179.807 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.468 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 20.5 tt0 -87.52 -26.54 23.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.856 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -80.11 -11.35 59.77 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.534 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -26.73 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.972 0.415 . . . . 0.0 110.093 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 -21.47 63.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.361 -179.816 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.565 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 . . . . . 0 CA--C 1.509 -0.624 0 CA-C-O 120.82 0.343 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.439 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.5 OUTLIER -77.07 26.5 0.15 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.538 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.652 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -109.81 -42.5 4.24 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.329 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -63.59 -38.87 92.78 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.141 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.529 ' C ' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -83.39 -14.54 52.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.703 178.465 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.652 ' HB2' ' HA ' ' A' ' 656' ' ' ALA . . . -83.98 -21.33 31.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -76.27 -20.5 57.3 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.95 179.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -84.89 -11.4 55.68 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.367 179.557 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.817 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -79.38 -34.9 41.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.139 179.386 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.817 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -81.83 9.51 7.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.372 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.81 -32.13 3.1 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.851 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 35.0 m -96.89 35.37 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.961 0.41 . . . . 0.0 110.536 179.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.84 31.79 72.9 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.498 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.65 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -106.39 16.62 24.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.907 0.384 . . . . 0.0 111.45 -179.637 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.458 ' O ' ' HB1' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -52.13 -24.12 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.991 -179.602 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -85.73 -59.48 2.3 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . 0.406 ' CB ' ' HD2' ' A' ' 667' ' ' LYS . 0.3 OUTLIER -59.59 -19.3 47.82 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.156 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.687 ' CB ' ' CD1' ' A' ' 662' ' ' TYR . . . -51.26 -47.63 62.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.886 178.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -53.54 -19.43 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.393 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -79.13 -61.15 2.1 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.529 HD13 ' C ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -76.82 -5.01 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.986 179.731 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.473 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 68.4 tt0 -86.05 -25.36 25.94 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.632 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 4.7 mtpt -74.36 -19.47 60.43 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.787 179.4 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.439 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -81.05 -16.67 52.6 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.333 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.464 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -60.31 -39.51 87.26 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.966 178.868 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.781 179.826 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.458 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.343 0 CA-C-O 120.981 0.42 . . . . 0.0 111.214 . . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.475 ' OG ' ' C ' ' A' ' 677' ' ' THR . 0.0 OUTLIER -126.04 20.82 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.629 0.728 . . . . 0.0 109.886 179.127 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.411 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -115.17 -37.43 4.1 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.16 178.732 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.498 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 2.6 tp60 -74.41 -36.84 63.47 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.401 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.498 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 2.7 m-90 -83.63 -21.32 32.55 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.989 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.675 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -71.87 -22.2 61.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.796 -179.583 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -80.69 -13.86 58.64 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.165 179.231 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.459 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 91.1 m-85 -91.95 -14.31 29.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.422 178.833 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.817 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -74.65 -37.16 62.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.114 179.6 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.817 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.03 11.23 5.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.481 179.996 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 t -127.05 -34.96 2.29 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 33.8 m -95.56 34.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.926 0.393 . . . . 0.0 110.473 179.648 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.17 31.9 74.63 Favored Glycine 0 CA--C 1.507 -0.447 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.527 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.611 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.29 18.75 21.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 111.37 179.957 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 9.6 tt -50.14 -27.07 3.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -86.51 -51.64 6.06 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . 0.426 ' CB ' ' HG2' ' A' ' 667' ' ' LYS . 0.0 OUTLIER -62.57 -18.6 62.42 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 177.207 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.723 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -53.21 -47.98 68.48 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.059 179.126 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -52.52 -19.83 2.53 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.912 179.827 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -75.28 -67.26 0.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.832 0.348 . . . . 0.0 111.553 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.508 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -71.81 -13.0 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 22.4 tt0 -79.28 -27.36 42.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.05 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.55 -8.27 59.61 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.691 179.029 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.475 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.86 -23.12 33.81 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 178.017 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.437 ' N ' ' HB2' ' A' ' 655' ' ' SER . 0.2 OUTLIER -52.51 -34.05 47.81 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.613 179.052 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.256 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.372 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.492 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.1 p90 . . . . . 0 CA--C 1.513 -0.469 0 CA-C-O 120.76 0.314 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.52 26.61 0.29 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.177 179.162 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.492 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -112.13 -46.22 3.22 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.038 178.705 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.05 -38.79 86.46 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.484 ' HB3' HD12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -86.97 5.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.937 178.553 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.56 ' CB ' ' CE2' ' A' ' 662' ' ' TYR . . . -104.29 -19.11 14.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.91 178.638 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -77.35 -22.0 52.44 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.378 178.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.405 ' HB2' ' CZ3' ' A' ' 658' ' ' TRP . 66.9 m-85 -82.72 -13.75 55.8 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.236 179.304 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.852 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -75.92 -37.23 58.96 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.363 179.49 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.852 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.54 10.74 6.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.609 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.12 -32.73 2.96 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 34.7 m -97.99 36.08 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.984 0.421 . . . . 0.0 110.416 179.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.05 31.5 72.93 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.561 -179.374 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.603 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -106.97 17.87 22.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.891 0.377 . . . . 0.0 111.487 -179.783 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.47 -29.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.395 -179.88 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -83.34 -51.36 7.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -63.0 -18.41 63.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.696 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -55.47 -43.77 75.83 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.736 178.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -47.35 -31.83 4.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.48 -179.711 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -76.38 -51.94 10.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 111.16 179.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.54 HG21 ' HA ' ' A' ' 671' ' ' ALA . 0.1 OUTLIER -72.82 -18.28 18.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.62 -179.035 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' A' ' 671' ' ' ALA . 0.7 OUTLIER -86.03 -21.16 27.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 110.309 178.913 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -79.55 -16.0 56.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.85 179.516 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.413 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.56 -3.28 58.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.991 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.442 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 1.1 tt -80.18 -24.26 40.45 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.487 179.182 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.348 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.625 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.526 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 . . . . . 0 CA--C 1.511 -0.54 0 CA-C-O 120.821 0.344 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.573 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.5 OUTLIER -76.67 19.85 0.26 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.237 0.542 . . . . 0.0 110.329 178.978 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.535 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -100.35 -44.34 5.95 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.025 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -64.93 -39.75 93.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.427 ' CZ3' ' HB2' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -85.75 8.95 17.93 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.795 178.365 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.552 ' CB ' ' CE2' ' A' ' 662' ' ' TYR . . . -104.46 -25.29 12.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.836 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -73.74 -16.86 61.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.211 178.573 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.427 ' HB2' ' CZ3' ' A' ' 658' ' ' TRP . 20.1 m-30 -85.21 -17.41 37.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.017 179.123 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.831 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -71.84 -36.6 70.22 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.264 -0.575 . . . . 0.0 110.588 179.606 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.831 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 2.8 ptt180 -77.84 5.28 9.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.48 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 91.6 p -128.67 -30.97 2.26 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.847 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 18.6 m -94.29 33.59 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.888 0.375 . . . . 0.0 110.517 179.602 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.56 32.14 72.64 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.788 -179.337 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.664 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 2.6 ttpt -112.13 19.13 18.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.907 0.384 . . . . 0.0 111.295 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.431 ' O ' ' HB1' ' A' ' 671' ' ' ALA . 2.3 tp -51.5 -32.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -82.48 -50.02 9.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.059 179.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.48 -17.07 63.52 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 177.295 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.721 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -54.88 -44.99 74.59 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.672 179.018 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -45.79 -35.73 4.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.622 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.76 15.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.549 0.69 . . . . 0.0 110.904 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.608 HG21 ' HA ' ' A' ' 671' ' ' ALA . 0.1 OUTLIER -71.92 -10.92 14.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.675 -179.253 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 671' ' ' ALA . 2.0 tm-20 -94.91 -13.44 25.41 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.746 0.308 . . . . 0.0 110.648 178.76 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.83 -8.42 40.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.777 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.438 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -87.67 -27.27 22.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.32 179.332 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.454 ' HB3' ' C ' ' A' ' 655' ' ' SER . 3.7 pp -70.25 -20.51 63.06 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.009 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 13.5 mttm . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.934 0.397 . . . . 0.0 110.636 179.752 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.524 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.8 p90 . . . . . 0 CA--C 1.51 -0.57 0 CA-C-O 120.799 0.333 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.571 ' O ' ' HB1' ' A' ' 659' ' ' ALA . 0.7 OUTLIER -78.98 26.09 0.26 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.791 178.899 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.524 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -108.87 -41.21 4.81 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.643 178.461 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.476 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 2.8 tt0 -60.94 -49.46 77.38 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.802 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.581 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -73.0 -5.24 37.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.181 177.531 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.681 ' O ' ' CE1' ' A' ' 662' ' ' TYR . . . -106.72 9.36 31.18 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.497 178.467 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -109.9 -34.24 6.49 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.643 178.375 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 658' ' ' TRP . 20.9 p90 -100.6 13.0 36.17 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.025 177.573 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.762 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -102.98 -26.21 13.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.757 177.996 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.762 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -81.69 -0.56 43.31 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.715 178.924 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 t -124.31 -19.56 5.47 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.604 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 28.4 m -93.65 28.51 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 111.343 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 78.5 10.23 86.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.922 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.557 ' O ' ' N ' ' A' ' 671' ' ' ALA . 5.0 mmmt -105.32 20.75 18.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.003 0.401 . . . . 0.0 110.814 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.422 ' O ' ' HB3' ' A' ' 671' ' ' ALA . 2.3 tp -55.99 -39.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.01 -179.627 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -75.18 -56.92 4.24 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.628 -0.429 . . . . 0.0 109.902 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.08 -16.43 59.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.788 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.583 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -60.33 -41.25 93.14 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.125 179.253 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -49.49 -25.34 2.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.404 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -72.62 -62.39 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.486 ' O ' HG12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -70.03 -7.1 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.909 179.494 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.433 ' HB2' ' OH ' ' A' ' 662' ' ' TYR . 5.1 tm-20 -75.83 -32.24 59.72 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.482 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -75.1 -4.13 36.78 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.69 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.553 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.7 OUTLIER -96.21 -13.34 23.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.552 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.493 ' N ' ' HB2' ' A' ' 655' ' ' SER . 1.2 tm? -75.68 -26.58 57.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.27 179.379 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? . . . . . 0 C--O 1.232 0.169 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.016 179.99 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.483 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.505 ' OG ' ' OG1' ' A' ' 677' ' ' THR . 0.3 OUTLIER -94.8 26.24 3.66 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 121.147 0.498 . . . . 0.0 110.254 178.937 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.483 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -110.17 -38.57 5.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.536 178.817 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.436 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 7.9 tt0 -67.13 -39.11 86.55 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.677 -179.556 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.436 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 3.6 m-90 -84.6 -20.64 31.1 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.695 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -74.31 -35.59 63.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -179.425 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -76.31 -3.67 38.0 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.837 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.497 ' O ' ' CG2' ' A' ' 665' ' ' VAL . 21.8 m-85 -94.98 -34.94 12.17 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.656 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.784 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.3 OUTLIER -56.18 -39.26 72.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.655 179.196 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.784 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 3.1 ptm85 -62.09 -8.2 5.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.689 -179.557 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.97 -18.58 1.81 Allowed 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . 0.497 ' CG2' ' O ' ' A' ' 661' ' ' TYR . 7.5 t -89.76 19.19 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.606 0.241 . . . . 0.0 110.469 179.181 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.52 29.22 74.44 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.504 -0.855 . . . . 0.0 111.199 -178.763 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.683 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 0.7 OUTLIER -114.8 14.46 17.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 179.582 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . 0.503 ' O ' ' HB1' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -49.03 -25.81 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.031 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -86.39 -56.91 3.22 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.662 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -62.24 -15.99 50.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 176.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.731 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -50.48 -47.03 57.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.678 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -51.16 -21.67 2.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.986 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -74.89 -67.55 0.63 Allowed 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.027 0.442 . . . . 0.0 111.456 179.47 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.516 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -67.84 -13.16 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -80.4 -24.21 39.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.258 178.502 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -82.05 -15.77 52.41 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.586 179.943 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.505 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.93 -16.39 47.56 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.925 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.428 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -55.88 -33.8 64.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.284 178.137 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.235 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.316 178.754 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 654' ' ' TYR . . . . . 0.488 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 655' ' ' SER . . . . . 0.58 ' OG ' HG12 ' A' ' 674' ' ' ILE . 0.4 OUTLIER -96.55 24.49 5.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.145 178.958 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 656' ' ' ALA . . . . . 0.442 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -109.16 -41.96 4.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.771 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 657' ' ' GLN . . . . . 0.448 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.7 OUTLIER -66.25 -31.21 71.89 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.221 -179.944 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 658' ' ' TRP . . . . . 0.588 ' HA ' ' CD1' ' A' ' 661' ' ' TYR . 1.7 m-90 -87.14 -20.07 27.57 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 177.462 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 659' ' ' ALA . . . . . 0.756 ' O ' ' CE1' ' A' ' 662' ' ' TYR . . . -89.93 5.42 46.5 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.317 179.527 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.35 -12.2 13.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.99 178.273 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 661' ' ' TYR . . . . . 0.588 ' CD1' ' HA ' ' A' ' 658' ' ' TRP . 1.6 p90 -111.72 1.11 16.53 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.725 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 662' ' ' TYR . . . . . 0.838 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -95.64 -27.04 15.5 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.36 179.334 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 663' ' ' ARG . . . . . 0.838 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 19.4 mtp180 -81.54 -1.41 46.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.563 178.847 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.6 m -119.9 -26.0 5.71 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.755 -179.52 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 24.1 m -92.73 31.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.965 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 67.0 23.52 72.86 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.318 -179.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' A' ' 671' ' ' ALA . 0.4 OUTLIER -107.83 15.59 24.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.773 0.32 . . . . 0.0 111.261 179.665 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 2.8 mt -51.5 -32.26 13.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.197 -179.618 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -79.89 -59.67 2.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.223 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -61.9 -16.41 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.592 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 671' ' ' ALA . . . . . 0.749 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -58.87 -40.88 85.66 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.034 179.158 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -48.87 -23.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.616 -0.433 . . . . 0.0 111.194 179.308 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -70.8 -68.35 0.44 Allowed 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 674' ' ' ILE . . . . . 0.58 HG12 ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -68.0 -8.81 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.503 -0.479 . . . . 0.0 109.834 179.93 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 675' ' ' GLU . . . . . 0.466 ' HB2' ' OH ' ' A' ' 662' ' ' TYR . 16.5 tm-20 -77.0 -29.89 55.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.05 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -9.32 58.69 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.398 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 677' ' ' THR . . . . . 0.49 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -91.06 -15.94 28.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.87 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.53 -33.55 71.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.277 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt . . . . . 0 CA--C 1.531 0.23 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.551 178.859 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.489 -0.245 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.47 -79.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.898 0.38 . . . . 0.0 111.112 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 21.1 t70 63.32 100.57 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.765 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.499 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 -133.32 -53.71 0.9 Allowed 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.163 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.603 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.4 OUTLIER -76.15 19.21 0.24 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.636 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.499 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -104.18 -42.05 5.63 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -58.83 -38.9 79.7 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.497 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -75.57 -35.94 60.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.8 179.086 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.452 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -71.05 -16.04 62.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.567 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.02 -37.97 69.66 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.257 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -62.65 -46.07 89.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.888 0.375 . . . . 0.0 110.753 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.459 ' CD1' ' HB3' ' A' ' 667' ' ' LYS . 10.0 m-85 -54.86 -28.83 53.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.601 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 7.3 mmt85 -63.24 -20.08 65.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.877 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.03 -15.6 9.25 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 20.4 t -91.71 25.83 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.858 0.361 . . . . 0.0 110.341 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.88 65.28 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.72 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.459 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 3.0 mttt -124.36 16.24 9.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.94 0.4 . . . . 0.0 110.825 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.402 HG12 ' HD2' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -46.16 -31.58 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.214 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -60.04 2.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.931 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -22.64 57.3 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 675' ' ' GLU . . . -61.62 -32.27 72.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.352 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -52.44 -36.12 53.87 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.943 0.402 . . . . 0.0 110.489 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.56 -67.95 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.317 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.603 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -59.6 -17.58 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.712 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 671' ' ' ALA . 72.7 tt0 -78.79 -26.13 44.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.368 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -71.6 -19.14 62.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.309 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.44 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -76.21 -23.47 54.61 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.729 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 680' ' ' ASN . 0.9 OUTLIER -68.36 -28.49 67.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.126 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -48.53 92.46 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.102 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 678' ' ' LEU . 2.6 t30 -122.06 52.37 1.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.801 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -104.39 -41.75 5.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.88 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.8 -57.29 10.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.863 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.1 0 N-CA-C 112.547 -0.221 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . 66.42 103.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.976 0.417 . . . . 0.0 111.006 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . 0.454 ' HA ' ' CD2' ' A' ' 678' ' ' LEU . 5.0 p-10 -153.97 92.6 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.545 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.515 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 -116.53 -53.24 2.53 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.578 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.533 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -77.26 23.46 0.2 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.34 0.591 . . . . 0.0 110.685 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.515 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -108.38 -37.1 6.07 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.875 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.457 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -63.0 -34.32 77.31 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.993 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.469 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . 2.4 m-90 -84.04 -35.43 23.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.46 ' N ' HD13 ' A' ' 674' ' ' ILE . . . -67.16 -18.78 65.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.84 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -70.56 -43.79 68.75 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-O 121.001 0.429 . . . . 0.0 110.749 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.457 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 71.8 m-85 -62.64 -48.89 77.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.453 ' HB3' ' HB1' ' A' ' 671' ' ' ALA . 13.8 m-85 -54.18 -37.61 64.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.675 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.407 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 1.1 mpt_? -68.98 -9.73 53.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.684 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 4.2 m -122.04 -22.86 5.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.408 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 35.6 m -93.44 31.65 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.85 0.357 . . . . 0.0 110.715 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.11 65.41 Favored Glycine 0 CA--C 1.506 -0.505 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.037 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.448 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -120.04 19.64 12.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.201 0.524 . . . . 0.0 110.444 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.407 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 1.4 mp -47.83 -32.01 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.611 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -70.28 -60.75 2.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.308 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.14 -22.19 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.136 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.453 ' HB1' ' HB3' ' A' ' 662' ' ' TYR . . . -61.9 -37.85 86.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.207 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.09 -30.89 7.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.825 0.345 . . . . 0.0 110.476 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.78 -69.81 0.28 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.185 0.517 . . . . 0.0 110.484 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.469 ' CD1' ' HB2' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -62.2 -17.51 18.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.27 179.471 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.43 ' N ' ' O ' ' A' ' 671' ' ' ALA . 3.9 tt0 -76.2 -28.96 57.45 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 178.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -73.13 -9.97 59.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.147 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.533 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.2 OUTLIER -91.26 -9.51 44.9 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.934 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.494 ' O ' ' N ' ' A' ' 680' ' ' ASN . 3.4 tm? -73.03 -29.91 63.35 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.428 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.7 tptp -59.92 76.84 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.876 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.494 ' N ' ' O ' ' A' ' 678' ' ' LEU . 8.8 t-20 -105.5 88.77 2.92 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -148.72 31.62 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -111.39 108.33 17.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 48.9 t30 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.937 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -127.44 -44.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.46 100.12 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.779 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.536 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.8 p90 -126.16 -54.43 1.49 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.154 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.611 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -75.26 21.22 0.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.705 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.536 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -105.93 -42.29 5.17 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.12 -37.3 82.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.469 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -74.55 -36.52 63.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.825 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.466 ' N ' ' CD1' ' A' ' 674' ' ' ILE . . . -71.16 -13.05 61.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.663 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.38 -38.04 63.26 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.956 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -65.38 -50.52 65.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.859 0.361 . . . . 0.0 110.372 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.45 ' HB2' ' CB ' ' A' ' 671' ' ' ALA . 16.3 m-85 -52.87 -32.91 47.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.32 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.48 ' HA ' ' CG2' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -66.29 -12.06 54.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.297 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 5.1 p -134.91 20.04 3.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.826 0.346 . . . . 0.0 111.62 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 22.0 t -128.56 22.81 2.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.808 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.71 24.69 72.79 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.493 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.43 ' HG2' ' CD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -124.15 15.7 9.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.232 0.539 . . . . 0.0 110.643 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.48 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 10.0 pt -45.59 -33.81 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.559 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -67.98 -61.95 1.63 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.307 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -58.37 -22.35 53.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -63.94 -35.73 81.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.476 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.07 -39.55 59.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.837 0.351 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.87 -63.2 1.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.416 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.474 ' O ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -61.8 -13.79 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.805 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 671' ' ' ALA . 2.4 tm-20 -82.35 -27.89 31.9 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 110.486 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -76.74 -10.33 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.611 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -80.2 -25.14 39.81 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.008 178.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.437 ' N ' ' HB2' ' A' ' 655' ' ' SER . 2.4 pp -60.91 -27.95 68.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.717 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -59.57 82.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.559 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.437 ' N ' ' O ' ' A' ' 678' ' ' LEU . 0.4 OUTLIER -68.56 -67.71 0.45 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.064 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.64 159.92 19.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 47.1 mm-40 59.9 168.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.799 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 17.3 t30 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.979 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.75 -78.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.839 0.352 . . . . 0.0 111.061 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 13.9 t70 64.23 100.87 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.843 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.519 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.6 p90 -126.76 -49.61 1.49 Allowed 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.189 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.547 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -77.75 25.63 0.2 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.543 0.687 . . . . 0.0 110.32 179.297 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -109.19 -36.63 5.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.447 ' NE2' ' CZ3' ' A' ' 658' ' ' TRP . 10.0 tt0 -63.22 -29.81 71.07 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.643 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.572 ' HB2' HD13 ' A' ' 674' ' ' ILE . 2.0 m-90 -87.47 -35.09 18.43 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . . . . . . . . . . . -77.06 -8.63 57.78 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.098 178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -88.11 -47.59 8.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.285 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.517 ' CD1' ' O ' ' A' ' 658' ' ' TRP . 3.1 p90 -72.84 -21.95 60.87 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.199 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.452 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 5.2 m-85 -67.44 -32.72 73.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.454 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -67.4 -8.16 30.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.0 m -116.38 -22.73 8.65 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 31.2 m -96.44 35.42 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.982 0.42 . . . . 0.0 110.398 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.03 23.2 56.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.777 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.423 ' HD3' ' CD1' ' A' ' 662' ' ' TYR . 0.6 OUTLIER -111.87 19.0 18.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.001 0.429 . . . . 0.0 110.656 179.636 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.454 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 3.3 mt -49.21 -42.02 14.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.941 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -68.22 -54.74 15.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.471 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -23.25 66.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.433 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 675' ' ' GLU . . . -65.23 -43.04 92.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.426 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -47.87 -35.22 10.03 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.745 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.74 -67.74 0.4 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.317 0.58 . . . . 0.0 110.3 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.572 HD13 ' HB2' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -55.0 -31.52 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.924 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -60.31 -32.69 71.46 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.949 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.16 -23.19 67.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.626 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.418 ' O ' ' CZ ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -80.9 -16.7 52.9 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.386 179.146 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.464 ' N ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -75.12 -23.29 57.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.1 mttp -67.17 66.84 0.07 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.421 ' N ' ' O ' ' A' ' 678' ' ' LEU . 29.1 t-20 -65.77 131.54 46.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -164.7 155.0 14.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.829 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -126.5 -178.68 4.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 1.2 t30 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.892 179.955 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.146 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -147.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.897 0.38 . . . . 0.0 111.106 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.43 102.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.652 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.491 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.4 p90 -134.42 -50.58 0.8 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.287 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.512 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.1 OUTLIER -75.96 17.33 0.34 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.938 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.491 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -102.61 -45.24 5.1 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.6 -36.67 79.12 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.476 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.74 -30.58 59.25 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.972 179.164 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.417 ' CB ' HD11 ' A' ' 674' ' ' ILE . . . -80.48 -4.91 55.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.848 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.68 -38.08 26.4 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.771 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -66.86 -26.67 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.754 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.507 ' N ' ' CD1' ' A' ' 661' ' ' TYR . 3.7 m-85 -66.62 -37.35 84.67 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.072 0.463 . . . . 0.0 110.12 179.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.422 ' HG3' ' HA ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -64.57 -11.12 31.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.795 -179.782 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.69 -26.34 11.37 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 19.6 t -96.28 35.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.037 0.446 . . . . 0.0 110.288 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.81 28.32 57.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.536 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.421 ' HD3' ' CD1' ' A' ' 662' ' ' TYR . 12.2 mttm -116.59 18.09 15.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 111.14 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.422 ' HA ' ' HG3' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -49.71 -30.05 5.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.71 -56.76 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.09 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.05 -23.34 65.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.002 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 675' ' ' GLU . . . -61.47 -40.82 95.89 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.174 179.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.52 -33.19 3.86 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.726 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.07 -68.29 0.37 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.481 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.512 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -59.72 -19.1 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.472 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 1.4 tt0 -72.91 -30.02 63.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -23.57 67.48 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.271 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.445 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.22 -15.22 59.57 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.695 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.25 -23.78 54.52 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.54 -32.03 0.51 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.875 0.369 . . . . 0.0 111.199 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 47.74 83.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.287 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -163.83 -69.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.98 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -106.85 162.77 13.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.945 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.865 179.966 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -148.15 -61.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.995 0.426 . . . . 0.0 111.186 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.76 101.59 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.629 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -175.71 34.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.059 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.482 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -127.14 18.08 7.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.495 0.664 . . . . 0.0 110.559 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.03 -35.58 4.05 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.3 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.521 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 1.6 tt0 -76.53 -12.38 60.02 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.279 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.52 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 1.6 m-90 -106.03 -31.88 8.54 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.563 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -79.83 -15.06 58.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.294 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.402 ' HG3' ' CD1' ' A' ' 661' ' ' TYR . 11.4 pt-20 -78.81 -34.18 45.56 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 120.723 0.297 . . . . 0.0 110.857 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.521 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 45.9 m-85 -70.85 -47.05 61.45 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.56 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.483 ' HB2' ' CB ' ' A' ' 671' ' ' ALA . 21.9 m-85 -60.43 -35.33 75.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.194 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.432 ' HA ' ' CG2' ' A' ' 668' ' ' ILE . 0.1 OUTLIER -65.8 -13.8 60.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.342 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 36.3 p -118.86 -20.82 8.04 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 20.2 t -93.83 32.19 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.45 24.43 56.12 Favored Glycine 0 CA--C 1.507 -0.462 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.847 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 2.3 mmpt? -116.67 19.37 14.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.072 0.463 . . . . 0.0 110.346 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.432 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 15.3 pt -44.16 -33.21 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.14 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -67.76 -59.92 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.168 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.33 -25.94 60.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.116 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.483 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -59.33 -38.89 81.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.13 179.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.73 -32.14 5.52 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.445 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -69.73 0.27 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.339 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.563 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -57.06 -23.51 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.029 179.364 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.88 -29.55 70.5 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.1 mtpt -69.41 -15.88 63.38 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.926 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.476 ' HB ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -73.54 -21.02 60.49 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.317 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.442 ' N ' ' CB ' ' A' ' 655' ' ' SER . 0.2 OUTLIER -54.03 -29.54 44.17 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.72 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -77.14 7.92 4.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.116 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -45.62 -29.74 1.31 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.818 0.342 . . . . 0.0 111.305 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -57.83 102.03 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.961 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 61.25 100.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 41.4 t30 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.901 -179.94 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.424 -0.271 . . . . 0.0 112.424 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . 64.03 102.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -151.33 92.04 1.74 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.335 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.414 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 4.5 p90 -103.45 -46.11 4.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.08 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.514 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.6 OUTLIER -84.91 23.51 1.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.073 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -112.0 -38.15 4.88 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.097 178.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.436 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.8 tt0 -65.84 -26.9 67.87 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.535 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -90.18 -35.75 15.19 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.448 ' CB ' ' HG2' ' A' ' 675' ' ' GLU . . . -80.51 -2.77 47.45 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.335 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -94.22 -42.59 8.87 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.081 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.535 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 4.1 p90 -76.62 -15.35 59.85 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.393 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.53 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 8.6 m-85 -73.79 -30.2 62.62 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.439 ' HD2' HG13 ' A' ' 668' ' ' ILE . 6.4 mmt85 -69.94 -9.08 53.8 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.575 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 16.2 m -126.46 14.44 7.66 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 26.0 t -132.57 34.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.221 0.534 . . . . 0.0 109.714 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.85 26.03 64.71 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.625 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.42 ' HD3' ' CE1' ' A' ' 662' ' ' TYR . 14.0 mttp -122.42 16.05 10.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 111.315 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.439 HG13 ' HD2' ' A' ' 663' ' ' ARG . 5.0 tt -51.0 -36.03 15.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -75.76 -45.97 33.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.475 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.73 -25.99 66.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.231 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . . . . . . . . . . . -63.18 -33.22 75.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.331 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -51.96 -35.53 46.5 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.552 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.22 -67.47 0.42 Allowed 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.794 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 658' ' ' TRP . 0.7 OUTLIER -59.8 -19.14 16.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.487 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.448 ' HG2' ' CB ' ' A' ' 659' ' ' ALA . 1.0 OUTLIER -65.31 -33.78 76.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.596 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -17.55 64.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.323 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.514 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.23 -11.37 57.87 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.547 ' O ' ' N ' ' A' ' 680' ' ' ASN . 21.8 tp -65.72 -30.95 71.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.337 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.4 80.39 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.548 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 678' ' ' LEU . 10.0 p30 -96.68 22.95 7.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.148 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 -38.65 0.78 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.257 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.92 166.0 13.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.913 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.889 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -155.4 -68.65 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.989 0.424 . . . . 0.0 111.096 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 60.18 97.86 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.899 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.619 ' HE2' ' HB2' ' A' ' 680' ' ' ASN . 1.1 p90 -131.1 -56.75 1.03 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.759 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.42 ' O ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -85.22 20.43 1.96 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.114 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -114.23 -37.44 4.39 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.088 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.469 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.3 tt0 -66.8 -26.58 67.01 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.149 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.53 ' O ' ' CD2' ' A' ' 662' ' ' TYR . 2.0 m-90 -90.53 -31.59 16.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.551 ' CB ' HG13 ' A' ' 674' ' ' ILE . . . -80.61 -6.49 58.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.847 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.25 -37.28 11.61 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.598 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.519 ' CD1' ' HA ' ' A' ' 658' ' ' TRP . 3.7 p90 -79.71 -17.41 53.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.449 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.535 ' CE2' HG22 ' A' ' 674' ' ' ILE . 6.7 m-85 -73.32 -29.45 62.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.979 0.419 . . . . 0.0 109.909 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.405 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm-85 -69.32 -9.93 55.56 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.412 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 6.2 t -116.67 -23.43 8.18 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 29.9 m -94.4 33.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.002 0.43 . . . . 0.0 110.353 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 55.48 29.29 53.22 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.608 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.447 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -119.41 17.62 12.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.134 0.492 . . . . 0.0 111.185 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 4.8 tt -50.0 -30.57 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.643 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.43 -61.42 1.79 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.532 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -58.27 -24.49 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.813 0.339 . . . . 0.0 110.124 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.469 ' HA ' ' CG2' ' A' ' 674' ' ' ILE . . . -62.33 -29.15 70.24 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.944 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -51.32 -49.88 60.5 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.04 -65.01 0.67 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.852 0.835 . . . . 0.0 109.838 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.551 HG13 ' CB ' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -50.49 -28.88 5.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.026 -1.443 . . . . 0.0 110.776 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.44 -24.99 62.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.523 179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -81.24 -14.98 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.874 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.493 ' O ' ' HB2' ' A' ' 680' ' ' ASN . 0.0 OUTLIER -76.15 -26.65 56.48 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.35 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 12.3 tp -51.57 -29.82 18.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.999 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -68.08 -7.61 30.95 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.456 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.619 ' HB2' ' HE2' ' A' ' 654' ' ' TYR . 1.2 m-20 -46.36 -29.25 1.6 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.726 0.298 . . . . 0.0 111.251 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.32 166.26 23.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.796 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.4 140.38 33.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.944 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.873 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . 0.412 ' CB ' ' ND2' ' A' ' 680' ' ' ASN . . . 175.0 105.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 0.0 110.833 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -121.82 79.05 1.52 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.404 0.621 . . . . 0.0 110.327 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.462 ' C ' ' H ' ' A' ' 656' ' ' ALA . 7.3 p90 -79.0 -47.25 16.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.621 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.549 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -79.52 22.23 0.46 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.462 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -109.43 -44.36 3.91 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.024 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -61.97 -27.02 68.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.513 ' C ' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -91.2 -22.84 20.43 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.085 179.214 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.464 ' HB1' HD11 ' A' ' 674' ' ' ILE . . . -89.05 -6.09 57.39 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.6 -35.51 27.01 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.895 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.2 OUTLIER -70.99 -30.05 66.19 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.685 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.481 ' N ' ' CD1' ' A' ' 661' ' ' TYR . 3.8 m-85 -63.18 -34.56 77.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.237 0.541 . . . . 0.0 109.969 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.421 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.7 OUTLIER -72.57 -1.95 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.71 -27.03 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.449 HG11 ' HB2' ' A' ' 667' ' ' LYS . 13.2 p -97.95 35.91 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.041 0.448 . . . . 0.0 110.486 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.23 27.05 66.87 Favored Glycine 0 CA--C 1.508 -0.365 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.209 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.449 ' HB2' HG11 ' A' ' 665' ' ' VAL . 3.6 mttt -114.67 20.97 14.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.074 0.464 . . . . 0.0 110.696 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.421 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 5.5 mt -48.26 -32.33 3.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.371 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -39.42 28.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.495 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -25.49 62.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.43 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -63.53 -33.41 75.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.177 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -51.21 -31.68 21.28 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.477 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.91 -69.78 0.27 Allowed 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.437 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.513 HD13 ' C ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -58.77 -21.99 20.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.85 -24.67 65.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -17.6 64.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.298 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.549 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.4 OUTLIER -89.93 -1.7 58.02 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.839 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.437 ' N ' ' HB2' ' A' ' 655' ' ' SER . 6.1 tt -79.72 -30.2 40.89 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.583 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.95 -44.2 0.49 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.281 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.412 ' ND2' ' CB ' ' A' ' 652' ' ' ALA . 64.1 t-20 38.14 52.06 1.56 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.752 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.67 171.47 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.013 0.435 . . . . 0.0 110.981 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -157.96 128.27 6.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 35.6 m120 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.883 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . 67.25 103.68 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.044 0.45 . . . . 0.0 111.018 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . 0.419 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . 8.3 p-10 -154.57 92.67 1.51 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.415 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.461 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.5 p90 -114.45 -46.01 2.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.545 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -80.07 23.73 0.45 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.119 0.485 . . . . 0.0 110.607 179.317 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.461 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -109.79 -44.52 3.81 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -63.26 -35.94 82.02 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.528 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -77.46 -35.22 54.05 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.52 178.74 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.482 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -71.32 -13.81 62.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.553 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.59 -38.72 54.41 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -64.53 -41.85 96.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.454 ' HB2' ' CB ' ' A' ' 671' ' ' ALA . 15.5 m-85 -57.78 -28.1 63.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -71.44 -8.72 55.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.358 179.666 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 p -121.7 -23.76 5.46 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.411 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 29.7 m -92.78 31.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.831 0.348 . . . . 0.0 110.741 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.76 29.44 67.33 Favored Glycine 0 CA--C 1.506 -0.508 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.092 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 6.4 mmtt -119.82 18.35 12.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.1 0.476 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.416 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 2.2 mt -46.66 -32.75 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.564 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.5 -47.96 18.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.359 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -65.59 -24.12 67.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.165 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.454 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -62.72 -38.03 88.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.451 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -51.01 -32.07 20.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.939 0.4 . . . . 0.0 110.497 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.93 -69.26 0.31 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.542 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.5 HD12 ' HB3' ' A' ' 658' ' ' TRP . 0.6 OUTLIER -57.67 -24.46 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.661 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.473 ' N ' HG13 ' A' ' 674' ' ' ILE . 6.2 mt-10 -63.36 -25.38 68.27 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.699 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -5.45 44.86 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.384 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.408 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -93.25 -15.14 26.19 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.419 ' CD1' ' HA ' ' A' ' 653' ' ' ASP . 19.1 tp -64.64 -31.78 73.14 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.817 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -67.6 66.86 0.09 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.497 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 35.2 t30 -57.28 128.78 38.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.07 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -122.45 -68.98 0.85 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 61.57 96.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 3.5 t30 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.903 179.98 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 112.398 -0.281 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -80.39 -50.54 9.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.996 0.427 . . . . 0.0 111.139 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.74 99.19 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.466 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 -134.03 -43.78 0.8 Allowed 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.307 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.488 ' OG ' ' C ' ' A' ' 677' ' ' THR . 0.3 OUTLIER -80.16 24.69 0.41 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.411 0.624 . . . . 0.0 110.719 179.752 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.466 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -110.78 -39.36 4.87 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.194 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.442 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.2 OUTLIER -68.34 -22.14 64.7 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.771 -179.778 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.561 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.1 m-90 -93.78 -36.41 12.29 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.41 ' HA ' ' HB2' ' A' ' 671' ' ' ALA . . . -77.79 -7.5 56.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.159 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -90.06 -46.3 8.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.15 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.561 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.4 p90 -73.88 -21.77 59.97 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.031 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.52 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 3.9 m-85 -66.88 -32.61 73.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.419 ' HG3' HG13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -71.93 -4.27 27.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.634 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.3 18.54 4.88 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 14.8 p -136.74 32.88 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.043 0.449 . . . . 0.0 109.82 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.73 26.14 66.5 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.542 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.411 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 2.1 tptt -123.71 17.47 9.51 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.112 0.482 . . . . 0.0 111.18 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.419 HG13 ' HG3' ' A' ' 663' ' ' ARG . 4.8 tt -52.25 -35.35 19.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.569 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.5 -48.73 30.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.494 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -24.71 67.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.146 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.41 ' HB2' ' HA ' ' A' ' 659' ' ' ALA . . . -63.26 -37.83 88.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.49 -33.76 32.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.996 0.427 . . . . 0.0 110.534 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.12 -67.58 0.43 Allowed 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.714 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.425 HD13 ' O ' ' A' ' 674' ' ' ILE . 0.6 OUTLIER -58.34 -22.8 20.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.275 179.546 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -34.24 75.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.988 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -74.3 -7.26 52.18 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.659 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.488 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -88.39 -19.91 25.97 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 177.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 680' ' ' ASN . 3.1 tm? -60.39 -28.95 68.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.564 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 70.22 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.038 0.447 . . . . 0.0 110.381 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.534 ' N ' ' O ' ' A' ' 678' ' ' LEU . 59.6 t30 -74.77 115.13 14.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.007 -179.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -137.46 98.55 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.861 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -68.07 125.58 26.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.851 179.919 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -122.44 -80.92 0.63 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.814 0.34 . . . . 0.0 111.256 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 64.22 102.22 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.762 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.415 ' C ' ' H ' ' A' ' 656' ' ' ALA . 5.6 p90 -123.83 -43.77 2.11 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.447 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.644 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.8 OUTLIER -82.16 22.13 0.84 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.771 179.854 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.415 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -110.63 -44.33 3.69 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.911 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -62.97 -38.19 90.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.514 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -74.61 -33.01 62.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.397 178.572 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.51 ' CB ' HD13 ' A' ' 674' ' ' ILE . . . -74.58 -9.07 58.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -82.0 -37.56 26.4 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 120.731 0.3 . . . . 0.0 111.011 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -64.52 -40.64 95.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.409 . . . . 0.0 110.703 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.459 ' HB2' ' CB ' ' A' ' 671' ' ' ALA . 14.5 m-85 -57.19 -28.93 63.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.795 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 8.2 mmt85 -73.65 -6.81 49.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.259 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.8 t -133.68 24.23 4.01 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.451 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 32.9 m -140.71 28.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.114 0.483 . . . . 0.0 109.975 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.5 27.01 72.09 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.764 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.422 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 1.2 mptt -125.7 16.02 8.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.984 0.421 . . . . 0.0 110.954 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.418 ' N ' ' O ' ' A' ' 662' ' ' TYR . 10.3 tt -48.19 -30.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.409 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -83.89 -37.05 22.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.129 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.29 -25.64 62.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.083 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.459 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -62.06 -34.12 75.68 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.397 179.272 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -52.26 -35.25 49.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.927 0.394 . . . . 0.0 110.467 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -68.3 0.37 Allowed 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.462 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.51 HD13 ' CB ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -58.02 -22.58 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.718 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.451 ' HG2' ' CB ' ' A' ' 659' ' ' ALA . 2.3 mm-40 -64.58 -24.61 67.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.173 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.39 59.09 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.211 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.644 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -86.54 -15.03 41.22 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.677 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 680' ' ' ASN . 21.7 tp -61.2 -31.77 71.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.291 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.25 72.46 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.449 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.501 ' N ' ' O ' ' A' ' 678' ' ' LEU . 55.1 t-20 -64.31 -63.05 1.24 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.013 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 123.27 26.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.984 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -129.03 153.05 47.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.927 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -140.37 -47.87 0.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.851 0.358 . . . . 0.0 111.095 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 63.3 105.52 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.467 0.651 . . . . 0.0 110.839 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.491 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -135.85 -11.02 2.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.672 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.622 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.5 OUTLIER -98.27 26.96 4.95 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.721 0.772 . . . . 0.0 109.753 178.803 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -109.33 -34.34 6.58 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.981 178.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.472 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -65.31 -37.78 88.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.581 ' HB2' HD13 ' A' ' 674' ' ' ILE . 3.2 m-90 -79.89 -38.41 32.68 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.513 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -62.4 -18.97 62.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.222 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -75.32 -35.66 61.18 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 70.3 m-85 -66.49 -42.43 87.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.97 0.414 . . . . 0.0 110.843 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.458 ' HB3' ' O ' ' A' ' 667' ' ' LYS . 22.2 m-85 -57.5 -30.53 65.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.869 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm180 -68.97 -12.59 61.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.274 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -120.84 -24.49 5.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.432 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 25.7 m -91.32 30.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.911 0.386 . . . . 0.0 110.617 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.84 36.6 80.66 Favored Glycine 0 CA--C 1.505 -0.564 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.217 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.458 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 12.4 mmtt -128.1 16.48 6.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.02 0.438 . . . . 0.0 111.047 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.447 HG22 HD11 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.84 -30.31 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.418 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.66 -60.96 1.98 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.065 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.87 -22.7 59.68 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.436 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -59.3 -36.38 75.49 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.132 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.58 -36.9 11.33 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.16 -69.15 0.3 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.362 0.601 . . . . 0.0 110.263 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.622 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -55.97 -23.55 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.254 179.444 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.496 ' O ' ' HB2' ' A' ' 678' ' ' LEU . 9.4 tt0 -76.6 -14.86 59.96 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.971 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -81.71 -21.8 37.75 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.907 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.522 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -73.16 -17.76 61.34 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.22 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 675' ' ' GLU . 0.2 OUTLIER -50.67 -37.47 41.11 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.06 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 49.67 1.22 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.917 178.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -58.02 127.21 30.93 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.178 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.02 -46.6 0.12 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.819 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 -45.23 14.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.871 -179.954 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -174.76 -81.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.795 0.331 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -171.83 97.82 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.443 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.7 p90 -153.59 -51.51 0.1 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.781 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.437 ' HA ' ' CD1' ' A' ' 674' ' ' ILE . 0.1 OUTLIER -84.59 21.11 1.56 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.436 0.636 . . . . 0.0 110.388 179.12 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -112.74 -36.1 5.28 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.234 178.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.443 ' O ' ' CD2' ' A' ' 661' ' ' TYR . 1.4 tt0 -67.75 -34.81 77.56 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.702 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.483 ' HB2' HD13 ' A' ' 674' ' ' ILE . 2.4 m-90 -83.09 -40.73 19.44 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.531 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -71.0 -12.49 61.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.939 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -95.37 -30.83 13.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 120.897 0.38 . . . . 0.0 110.234 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.443 ' CD2' ' O ' ' A' ' 657' ' ' GLN . 22.3 m-30 -79.59 -30.88 41.69 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.19 179.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.48 ' HB3' ' O ' ' A' ' 667' ' ' LYS . 15.7 m-85 -65.85 -33.82 76.72 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.684 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 38.3 mmm-85 -68.46 -12.62 61.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.424 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.8 m -124.06 -21.16 5.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.408 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 11.8 m -93.31 28.04 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.878 0.371 . . . . 0.0 110.735 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.25 38.15 95.73 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 121.144 -0.55 . . . . 0.0 112.498 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 6.2 mttp -133.09 18.32 4.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.123 0.487 . . . . 0.0 110.395 178.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.43 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -46.96 -30.15 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.418 179.356 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -77.81 -50.41 12.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.406 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.62 -17.75 65.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.413 ' HA ' HG23 ' A' ' 674' ' ' ILE . . . -64.88 -36.65 85.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.523 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.53 -33.45 31.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.821 0.344 . . . . 0.0 110.479 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.6 -68.66 0.36 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.507 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -54.19 -24.05 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.315 179.625 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.97 73.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -74.45 -21.81 59.42 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.826 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.616 ' O ' ' HB2' ' A' ' 680' ' ' ASN . 0.0 OUTLIER -70.5 -20.98 62.8 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.43 ' N ' ' HB2' ' A' ' 655' ' ' SER . 1.8 tp -50.17 -32.82 17.19 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.648 178.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.89 36.71 1.02 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.045 179.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.616 ' HB2' ' O ' ' A' ' 677' ' ' THR . 1.2 t-20 -77.99 -161.62 0.27 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.489 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 2.6 mttt 69.68 82.7 0.16 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.871 0.367 . . . . 0.0 110.868 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -122.07 -42.97 2.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.854 179.948 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -109.01 -31.1 7.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.758 0.313 . . . . 0.0 111.083 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 61.77 99.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.477 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.2 p90 -133.66 -48.9 0.82 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.993 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.477 ' HB3' ' N ' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -79.31 22.84 0.41 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.422 0.629 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.477 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -108.67 -37.89 5.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.057 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.487 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.1 tt0 -67.41 -22.03 65.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.809 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.553 ' HA ' ' CD1' ' A' ' 661' ' ' TYR . 2.5 m-90 -92.72 -34.17 14.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 109.247 178.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.43 ' CB ' ' CG ' ' A' ' 675' ' ' GLU . . . -80.26 -6.42 57.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.696 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.14 -39.93 10.31 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.326 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.553 ' CD1' ' HA ' ' A' ' 658' ' ' TRP . 3.5 p90 -77.72 -19.32 55.42 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.089 179.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.474 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 5.2 m-85 -68.21 -33.96 75.37 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.425 ' HG3' HG13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -61.3 -14.1 24.18 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.667 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 42.4 p -108.62 -25.27 10.97 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 13.4 p -95.82 34.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.26 30.59 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.911 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.433 ' HD2' ' CD1' ' A' ' 662' ' ' TYR . 13.7 mttt -119.6 16.65 12.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.08 0.467 . . . . 0.0 111.302 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.425 HG13 ' HG3' ' A' ' 663' ' ' ARG . 7.6 tt -49.69 -41.35 16.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.832 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.64 -57.85 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.507 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -22.49 64.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.399 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.402 ' HB1' ' CB ' ' A' ' 662' ' ' TYR . . . -66.21 -39.92 89.98 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.583 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.36 -34.2 32.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.15 -67.36 0.44 Allowed 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.363 0.601 . . . . 0.0 110.54 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.463 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.6 OUTLIER -56.04 -25.31 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.36 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.43 ' CG ' ' CB ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -60.05 -37.46 79.91 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.637 179.087 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.17 -19.09 62.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.876 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.407 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.74 -13.57 47.94 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.209 179.142 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.477 ' N ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -79.12 -22.77 44.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.859 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm -67.15 66.77 0.07 Allowed 'General case' 0 CA--C 1.528 0.118 0 CA-C-O 120.906 0.384 . . . . 0.0 110.596 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.445 ' N ' ' O ' ' A' ' 678' ' ' LEU . 6.8 t-20 -74.32 -66.79 0.68 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.084 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 9.5 mttp -150.62 133.33 15.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.846 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.48 151.88 25.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.871 -179.923 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -116.51 -50.87 2.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.001 0.429 . . . . 0.0 111.172 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 7.2 t70 68.58 106.68 0.05 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.498 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -148.59 -11.01 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.034 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.48 ' OG ' ' OG1' ' A' ' 677' ' ' THR . 0.4 OUTLIER -97.6 26.44 5.01 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.984 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -111.72 -36.74 5.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.362 178.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -30.52 70.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.128 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.545 ' HA ' ' CD1' ' A' ' 661' ' ' TYR . 2.2 m-90 -86.4 -34.55 20.15 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.529 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -81.45 -2.91 51.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.431 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -96.7 -42.77 7.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.925 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.545 ' CD1' ' HA ' ' A' ' 658' ' ' TRP . 2.8 p90 -75.51 -23.94 56.78 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.469 ' CD2' ' O ' ' A' ' 658' ' ' TRP . 3.0 m-85 -65.47 -29.69 70.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.947 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.404 ' HD2' ' HA ' ' A' ' 668' ' ' ILE . 20.8 mmm-85 -69.32 -9.98 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.563 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -118.67 -22.79 7.31 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 14.6 p -94.35 33.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.04 0.448 . . . . 0.0 110.53 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.77 28.61 63.29 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.923 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -120.17 18.16 12.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 179.673 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.437 HD11 HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -51.52 -32.8 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.722 179.441 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.95 -54.36 8.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.166 179.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -22.66 66.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.083 179.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . . . . . . . . . . . -64.42 -34.26 77.78 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.577 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -53.26 -33.16 51.95 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.874 0.368 . . . . 0.0 110.454 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.75 -69.11 0.33 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.268 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.529 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -56.8 -23.21 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.803 179.197 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 678' ' ' LEU . 43.2 tt0 -66.92 -26.8 67.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.657 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -68.06 -20.81 64.99 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.484 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.48 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.05 -15.09 52.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.648 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 675' ' ' GLU . 10.8 tp -55.22 -37.46 67.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.195 178.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 mptt -79.32 52.47 1.35 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.777 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -73.06 115.06 11.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.017 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.53 -69.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.935 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 177.87 89.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.817 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.885 179.998 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -131.52 -45.78 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.876 0.369 . . . . 0.0 111.128 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 16.6 t70 69.15 106.61 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.642 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.463 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -169.3 32.24 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.001 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.479 ' HB3' ' CB ' ' A' ' 677' ' ' THR . 0.1 OUTLIER -124.79 19.6 8.55 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.51 0.671 . . . . 0.0 110.715 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.21 -31.55 5.28 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.51 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.489 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -74.87 -24.41 58.56 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.43 -179.599 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.43 ' O ' ' CD2' ' A' ' 662' ' ' TYR . 1.6 m-90 -92.69 -33.15 14.46 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.543 ' CB ' HG13 ' A' ' 674' ' ' ILE . . . -75.48 -13.37 60.37 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.34 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.68 -33.36 47.07 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.43 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.489 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 59.4 m-85 -73.47 -45.44 54.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.676 0.274 . . . . 0.0 111.015 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.561 ' CE2' HG22 ' A' ' 674' ' ' ILE . 13.3 m-85 -64.43 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.946 0.403 . . . . 0.0 110.143 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.401 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.8 OUTLIER -67.51 -11.87 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.197 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 87.1 p -121.36 -24.15 5.51 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.445 ' CG2' ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -91.86 30.27 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.772 0.32 . . . . 0.0 110.892 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.86 29.3 70.12 Favored Glycine 0 CA--C 1.505 -0.576 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.133 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.461 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 3.6 mtpp -121.67 19.55 11.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.179 0.514 . . . . 0.0 110.27 178.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.413 ' N ' ' O ' ' A' ' 662' ' ' TYR . 1.5 mp -46.58 -30.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.463 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -65.62 -57.33 8.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.926 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.74 -29.25 69.99 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.494 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -57.14 -29.78 63.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.783 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -48.94 -49.67 39.17 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.618 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.12 -65.67 0.56 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.887 0.851 . . . . 0.0 109.713 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.561 HG22 ' CE2' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -49.35 -35.5 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.841 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.24 -27.27 67.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -76.91 -11.81 59.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.943 179.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.479 ' CB ' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.6 -20.88 53.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.459 ' N ' ' CB ' ' A' ' 655' ' ' SER . 0.3 OUTLIER -52.24 -33.25 40.65 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.741 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -13.78 35.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.966 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 677' ' ' THR . 2.8 m120 -44.63 146.63 0.71 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.972 0.415 . . . . 0.0 111.354 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -160.61 79.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.862 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 104.82 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.289 -0.863 . . . . 0.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -92.0 -70.11 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.92 0.39 . . . . 0.0 111.175 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 60.77 100.62 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.389 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -162.57 -4.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.611 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.603 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 4.6 m -100.48 27.03 6.07 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.573 0.701 . . . . 0.0 109.644 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.421 ' HB1' ' CD2' ' A' ' 678' ' ' LEU . . . -108.72 -38.66 5.58 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.789 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.44 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.8 OUTLIER -59.15 -29.44 67.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.487 -179.61 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.44 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 2.0 m-90 -88.54 -33.55 17.69 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' A' ' 663' ' ' ARG . . . -67.57 -24.17 65.48 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.493 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -33.09 72.77 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.782 0.325 . . . . 0.0 111.59 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.439 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 62.8 m-85 -66.8 -46.86 73.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.517 ' CD2' HG22 ' A' ' 674' ' ' ILE . 23.9 m-85 -56.8 -30.88 64.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.942 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 10.2 mmm180 -61.38 -22.04 64.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.631 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.5 m -117.2 -16.14 10.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.824 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 18.5 t -92.53 27.41 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.814 0.34 . . . . 0.0 110.297 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.19 29.34 62.65 Favored Glycine 0 CA--C 1.505 -0.571 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.794 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.4 ' C ' ' HB3' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -124.48 14.94 8.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.091 0.472 . . . . 0.0 110.954 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 5.4 tt -44.95 -31.87 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.566 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -70.14 -62.42 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.193 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.53 -23.99 53.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.464 ' HA ' ' CG2' ' A' ' 674' ' ' ILE . . . -60.63 -26.62 67.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -49.36 -44.49 44.78 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -59.5 -67.14 0.41 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.495 0.664 . . . . 0.0 109.896 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.603 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.1 OUTLIER -51.03 -32.26 11.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.331 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 12.2 tt0 -72.49 -10.78 60.21 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.881 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.35 -13.63 37.44 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.607 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.499 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.19 -17.61 36.59 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 177.732 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.421 ' CD2' ' HB1' ' A' ' 656' ' ' ALA . 3.3 tm? -55.74 -34.66 65.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.41 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -77.62 53.91 1.14 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.853 178.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -91.97 113.83 26.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.985 -179.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 5.7 tttm 61.04 154.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.56 88.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.806 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 1.9 m120 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.915 179.892 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -175.96 -81.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 111.107 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.6 98.25 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.112 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.46 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.9 OUTLIER -150.82 -55.36 0.15 Allowed 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.804 179.72 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.421 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -83.86 19.39 1.73 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 110.394 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.403 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -113.66 -43.46 3.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.934 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -63.28 -34.86 78.61 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.416 ' C ' HD12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -80.23 -29.8 38.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.159 179.435 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.539 ' CB ' HD13 ' A' ' 674' ' ' ILE . . . -79.22 -13.36 59.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.189 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 663' ' ' ARG . 22.3 mt-10 -76.23 -36.7 58.42 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -67.53 -23.42 65.44 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.263 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.49 ' N ' ' CD1' ' A' ' 661' ' ' TYR . 5.0 m-85 -67.76 -58.07 5.25 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.062 0.458 . . . . 0.0 110.588 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -60.02 -7.65 1.9 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.812 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.1 m -90.96 -35.92 14.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.699 0.285 . . . . 0.0 111.368 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 22.3 t -99.36 37.06 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.095 0.474 . . . . 0.0 110.127 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.69 26.33 68.41 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.647 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.95 19.69 20.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 0.0 110.727 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.445 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 22.5 pt -45.85 -37.93 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.806 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . 0.41 ' N ' HG13 ' A' ' 668' ' ' ILE . 9.4 tt0 -67.25 -58.12 5.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -60.06 -23.0 63.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.684 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 659' ' ' ALA . . . -67.73 -38.3 83.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.72 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -52.3 -32.85 39.55 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.954 0.406 . . . . 0.0 110.499 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.64 -67.7 0.41 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.874 179.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.539 HD13 ' CB ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -61.47 -19.54 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.912 179.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.449 ' CG ' ' CB ' ' A' ' 659' ' ' ALA . 2.5 mt-10 -68.59 -27.1 65.75 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -71.5 -13.41 61.8 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.228 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.507 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.65 -23.24 56.27 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.041 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.416 ' N ' ' HB2' ' A' ' 655' ' ' SER . 12.7 tp -51.59 -30.04 19.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.049 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -75.49 2.85 10.51 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.565 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.451 ' HB3' ' CE2' ' A' ' 654' ' ' TYR . 48.9 t-20 -49.06 143.24 5.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.194 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp -107.0 -73.68 0.68 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.714 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 57.27 35.24 25.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.971 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.872 179.971 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.77 -53.2 19.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 63.24 101.17 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.791 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.443 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.4 p90 -118.14 -45.84 2.64 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.089 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.533 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.3 OUTLIER -76.72 11.66 1.61 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.186 0.517 . . . . 0.0 110.63 179.246 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -92.51 -44.21 8.75 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -32.81 70.98 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.648 ' HB3' HD12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -82.21 -23.52 35.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.044 179.017 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.682 ' CB ' ' HB3' ' A' ' 675' ' ' GLU . . . -89.09 0.07 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.45 -39.24 16.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.548 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -70.29 -30.21 67.17 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.715 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.463 ' N ' ' CD1' ' A' ' 661' ' ' TYR . 3.4 m-85 -62.81 -35.49 80.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.13 0.49 . . . . 0.0 109.956 178.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.491 ' HA ' ' CG2' ' A' ' 668' ' ' ILE . 2.6 mpt_? -71.11 -2.76 16.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.935 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.6 m -109.93 -28.9 8.51 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 4.7 m -97.57 36.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.024 0.44 . . . . 0.0 110.311 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.7 27.08 61.02 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.569 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -111.31 19.41 18.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.04 0.448 . . . . 0.0 110.864 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.491 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 24.3 pt -47.18 -35.25 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.539 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -70.54 -49.57 46.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.765 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.68 -29.71 70.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.537 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.429 ' CB ' ' HB2' ' A' ' 662' ' ' TYR . . . -63.81 -33.27 75.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.187 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.489 ' HA ' ' HG2' ' A' ' 675' ' ' GLU . 2.8 mt-10 -58.93 -22.18 59.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.132 -179.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -81.8 -61.47 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.44 0.638 . . . . 0.0 110.319 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.648 HD12 ' HB3' ' A' ' 658' ' ' TRP . 0.8 OUTLIER -62.5 -25.51 38.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.047 -179.567 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.682 ' HB3' ' CB ' ' A' ' 659' ' ' ALA . 1.5 pp20? -69.82 -29.52 66.82 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.276 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -24.1 12.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.856 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.86 -20.22 59.83 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.556 179.387 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 1.1 pp -73.54 -19.56 60.88 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.109 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -39.71 -33.93 0.22 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.821 0.343 . . . . 0.0 111.548 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 49.82 94.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.163 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.8 125.72 50.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -171.43 117.53 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 9.2 t30 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.929 179.966 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.439 -0.264 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -160.98 -47.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 51.9 26.18 3.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.033 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -6.06 44.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.762 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.574 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.1 OUTLIER -100.33 23.0 10.72 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.494 0.664 . . . . 0.0 110.336 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -108.9 -37.67 5.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.289 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.457 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.1 OUTLIER -64.78 -28.9 69.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.543 -179.745 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.493 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . 1.7 m-90 -88.37 -29.46 20.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.541 ' CB ' HG13 ' A' ' 674' ' ' ILE . . . -79.48 -7.18 58.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.443 179.004 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.17 -44.32 9.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.506 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.504 ' CZ ' ' CE1' ' A' ' 662' ' ' TYR . 3.8 p90 -74.6 -18.83 60.51 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.691 179.736 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.507 ' CE2' HG22 ' A' ' 674' ' ' ILE . 5.9 m-85 -72.07 -29.72 64.41 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.396 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.516 ' HA ' ' CG2' ' A' ' 668' ' ' ILE . 5.8 mmt180 -66.9 -10.06 44.64 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.374 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.18 -22.24 6.69 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.44 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 18.7 t -92.65 31.94 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.899 0.38 . . . . 0.0 110.391 179.368 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.33 27.17 52.57 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.577 -179.168 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.432 ' HB2' ' CD1' ' A' ' 662' ' ' TYR . 2.4 mttt -115.37 16.73 16.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.111 0.481 . . . . 0.0 110.968 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.516 ' CG2' ' HA ' ' A' ' 663' ' ' ARG . 12.9 pt -47.25 -38.46 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.0 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.17 -64.34 0.91 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.578 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.42 -23.67 50.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.382 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.475 ' HA ' ' CG2' ' A' ' 674' ' ' ILE . . . -63.8 -31.37 72.52 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -50.01 -51.12 44.43 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.806 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -58.07 -62.47 1.8 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.741 0.781 . . . . 0.0 109.895 178.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.574 ' O ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -51.96 -25.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.342 179.835 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.47 ' O ' ' HG ' ' A' ' 678' ' ' LEU . 2.8 tt0 -76.14 -11.76 59.99 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.233 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.1 -10.73 40.91 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.696 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.81 -22.09 22.27 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.202 178.833 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 675' ' ' GLU . 3.8 pp -65.3 -25.96 67.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.812 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -61.38 -10.22 6.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 178.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -33.34 125.21 0.39 Allowed 'General case' 0 C--N 1.342 0.268 0 C-N-CA 122.848 0.459 . . . . 0.0 112.076 -179.988 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -138.81 149.2 44.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.709 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.08 118.29 19.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.01 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 21.7 m120 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.967 179.997 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . 0.41 ' HA2' ' HA ' ' A' ' 682' ' ' GLN . . . . . . . . 0 N--CA 1.489 2.22 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -165.01 -68.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.365 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 53.97 89.33 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.369 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.552 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 -134.54 -56.69 0.84 Allowed 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.596 -179.078 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.535 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.5 OUTLIER -74.74 20.2 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.168 0.508 . . . . 0.0 110.346 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.561 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -103.04 -42.58 5.75 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.07 178.781 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -48.34 77.52 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.503 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -72.45 -10.53 59.91 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.704 178.449 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.615 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -86.23 -19.51 29.87 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.319 -179.857 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.43 -20.19 48.12 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.174 -0.611 . . . . 0.0 110.62 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 658' ' ' TRP . 71.8 m-85 -86.73 -14.13 43.32 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.616 178.721 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.85 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -72.64 -35.01 67.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.301 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.85 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -82.09 10.91 5.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.374 179.977 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -128.03 -33.08 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.41 ' CG2' ' CG ' ' A' ' 667' ' ' LYS . 27.5 m -93.82 32.54 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.29 32.58 84.21 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.613 ' O ' ' N ' ' A' ' 671' ' ' ALA . 29.5 mmtm -113.15 20.57 16.15 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.017 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.435 ' O ' ' HB1' ' A' ' 671' ' ' ALA . 2.1 mp -51.57 -25.63 5.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.127 179.684 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.22 -54.49 4.18 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.657 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.11 -18.42 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 177.048 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.738 ' HB2' ' CD1' ' A' ' 662' ' ' TYR . . . -53.1 -48.96 67.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.106 179.277 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.94 -19.27 6.34 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.599 -179.719 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -82.13 -58.24 3.04 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 120.778 0.323 . . . . 0.0 111.451 179.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.535 HD12 ' O ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -76.53 -3.63 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.05 179.807 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.468 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 20.5 tt0 -87.52 -26.54 23.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.856 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -80.11 -11.35 59.77 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.534 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -26.73 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.972 0.415 . . . . 0.0 110.093 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.462 ' O ' ' N ' ' A' ' 680' ' ' ASN . 0.2 OUTLIER -70.04 -21.47 63.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.361 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -52.21 86.88 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.462 ' N ' ' O ' ' A' ' 678' ' ' LEU . 0.3 OUTLIER -143.86 95.58 2.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.526 -179.923 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.79 140.63 14.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . 0.41 ' HA ' ' HA2' ' A' ' 651' ' ' GLY . 2.0 mt-30 -100.56 -30.25 11.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 39.7 t30 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.842 179.965 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -119.52 -47.76 2.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.951 0.405 . . . . 0.0 111.067 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 59.82 98.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.565 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 -135.31 -55.35 0.8 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.857 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.439 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.5 OUTLIER -77.07 26.5 0.15 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.538 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.652 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -109.81 -42.5 4.24 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.329 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -63.59 -38.87 92.78 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.141 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.529 ' C ' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -83.39 -14.54 52.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.703 178.465 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.652 ' HB2' ' HA ' ' A' ' 656' ' ' ALA . . . -83.98 -21.33 31.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -76.27 -20.5 57.3 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.95 179.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -84.89 -11.4 55.68 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.367 179.557 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.817 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -79.38 -34.9 41.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.139 179.386 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.817 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -81.83 9.51 7.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.372 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.81 -32.13 3.1 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.851 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 35.0 m -96.89 35.37 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.961 0.41 . . . . 0.0 110.536 179.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.84 31.79 72.9 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.498 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.65 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -106.39 16.62 24.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.907 0.384 . . . . 0.0 111.45 -179.637 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.458 ' O ' ' HB1' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -52.13 -24.12 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.991 -179.602 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -85.73 -59.48 2.3 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . 0.406 ' CB ' ' HD2' ' A' ' 667' ' ' LYS . 0.3 OUTLIER -59.59 -19.3 47.82 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.156 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.687 ' CB ' ' CD1' ' A' ' 662' ' ' TYR . . . -51.26 -47.63 62.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.886 178.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -53.54 -19.43 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.393 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -79.13 -61.15 2.1 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.529 HD13 ' C ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -76.82 -5.01 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.986 179.731 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.473 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 68.4 tt0 -86.05 -25.36 25.94 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.632 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 4.7 mtpt -74.36 -19.47 60.43 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.787 179.4 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.439 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -81.05 -16.67 52.6 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.333 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.464 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -60.31 -39.51 87.26 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.966 178.868 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt -58.52 86.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.781 179.826 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -82.14 57.38 3.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.778 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -170.33 -41.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.814 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 61.37 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 179.886 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 30.0 m-20 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.914 179.955 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -162.02 -44.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.911 0.386 . . . . 0.0 111.108 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 64.78 104.39 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.242 0.544 . . . . 0.0 110.552 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.458 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -163.73 28.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.214 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.475 ' OG ' ' C ' ' A' ' 677' ' ' THR . 0.0 OUTLIER -126.04 20.82 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.629 0.728 . . . . 0.0 109.886 179.127 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.411 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -115.17 -37.43 4.1 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.16 178.732 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.498 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 2.6 tp60 -74.41 -36.84 63.47 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.401 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.498 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 2.7 m-90 -83.63 -21.32 32.55 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.989 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.675 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -71.87 -22.2 61.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.796 -179.583 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -80.69 -13.86 58.64 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.165 179.231 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.459 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 91.1 m-85 -91.95 -14.31 29.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.422 178.833 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.817 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -74.65 -37.16 62.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.114 179.6 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.817 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.03 11.23 5.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.481 179.996 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 t -127.05 -34.96 2.29 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 33.8 m -95.56 34.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.926 0.393 . . . . 0.0 110.473 179.648 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.17 31.9 74.63 Favored Glycine 0 CA--C 1.507 -0.447 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.527 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.611 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.29 18.75 21.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 111.37 179.957 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 9.6 tt -50.14 -27.07 3.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -86.51 -51.64 6.06 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . 0.426 ' CB ' ' HG2' ' A' ' 667' ' ' LYS . 0.0 OUTLIER -62.57 -18.6 62.42 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 177.207 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.723 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -53.21 -47.98 68.48 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.059 179.126 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -52.52 -19.83 2.53 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.912 179.827 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -75.28 -67.26 0.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.832 0.348 . . . . 0.0 111.553 179.672 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.508 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -71.81 -13.0 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 22.4 tt0 -79.28 -27.36 42.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.05 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.55 -8.27 59.61 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.691 179.029 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.475 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.86 -23.12 33.81 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 178.017 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.437 ' N ' ' HB2' ' A' ' 655' ' ' SER . 0.2 OUTLIER -52.51 -34.05 47.81 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.613 179.052 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.59 -18.79 21.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.372 178.643 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -43.89 98.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.37 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -169.65 70.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -84.86 121.44 27.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.921 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.921 179.998 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.507 -0.237 . . . . 0.0 112.507 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -153.5 -80.43 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.91 0.386 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 56.99 95.1 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.492 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.1 p90 -137.8 -46.4 0.54 Allowed 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.52 26.61 0.29 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.177 179.162 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.492 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -112.13 -46.22 3.22 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.038 178.705 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.05 -38.79 86.46 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.484 ' HB3' HD12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -86.97 5.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.937 178.553 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.56 ' CB ' ' CE2' ' A' ' 662' ' ' TYR . . . -104.29 -19.11 14.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.91 178.638 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -77.35 -22.0 52.44 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.378 178.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.405 ' HB2' ' CZ3' ' A' ' 658' ' ' TRP . 66.9 m-85 -82.72 -13.75 55.8 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.236 179.304 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.852 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -75.92 -37.23 58.96 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.363 179.49 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.852 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.54 10.74 6.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.609 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.12 -32.73 2.96 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 34.7 m -97.99 36.08 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.984 0.421 . . . . 0.0 110.416 179.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.05 31.5 72.93 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.561 -179.374 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.603 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -106.97 17.87 22.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.891 0.377 . . . . 0.0 111.487 -179.783 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.47 -29.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.395 -179.88 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -83.34 -51.36 7.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -63.0 -18.41 63.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.696 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -55.47 -43.77 75.83 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.736 178.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -47.35 -31.83 4.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.48 -179.711 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -76.38 -51.94 10.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 111.16 179.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.54 HG21 ' HA ' ' A' ' 671' ' ' ALA . 0.1 OUTLIER -72.82 -18.28 18.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.62 -179.035 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' A' ' 671' ' ' ALA . 0.7 OUTLIER -86.03 -21.16 27.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 110.309 178.913 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -79.55 -16.0 56.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.85 179.516 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.413 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.56 -3.28 58.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.991 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.442 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 1.1 tt -80.18 -24.26 40.45 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.487 179.182 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.14 -34.41 0.06 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.625 -179.826 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.42 ' O ' ' CB ' ' A' ' 681' ' ' LYS . 4.2 t-20 -54.94 145.94 18.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.694 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 680' ' ' ASN . 0.2 OUTLIER 81.67 -47.99 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.234 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.31 83.14 0.14 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.868 0.366 . . . . 0.0 110.851 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -99.33 -77.65 0.52 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.952 0.405 . . . . 0.0 111.239 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 64.66 101.44 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.744 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.526 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 -123.08 -50.69 1.91 Allowed 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.179 -179.732 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.573 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.5 OUTLIER -76.67 19.85 0.26 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.237 0.542 . . . . 0.0 110.329 178.978 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.535 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -100.35 -44.34 5.95 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.025 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -64.93 -39.75 93.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.427 ' CZ3' ' HB2' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -85.75 8.95 17.93 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.795 178.365 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.552 ' CB ' ' CE2' ' A' ' 662' ' ' TYR . . . -104.46 -25.29 12.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.836 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -73.74 -16.86 61.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.211 178.573 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.427 ' HB2' ' CZ3' ' A' ' 658' ' ' TRP . 20.1 m-30 -85.21 -17.41 37.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.017 179.123 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.831 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -71.84 -36.6 70.22 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.264 -0.575 . . . . 0.0 110.588 179.606 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.831 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 2.8 ptt180 -77.84 5.28 9.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.48 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 91.6 p -128.67 -30.97 2.26 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.847 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 18.6 m -94.29 33.59 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.888 0.375 . . . . 0.0 110.517 179.602 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.56 32.14 72.64 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.788 -179.337 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.664 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 2.6 ttpt -112.13 19.13 18.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.907 0.384 . . . . 0.0 111.295 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.431 ' O ' ' HB1' ' A' ' 671' ' ' ALA . 2.3 tp -51.5 -32.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -82.48 -50.02 9.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.059 179.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.48 -17.07 63.52 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 177.295 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.721 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -54.88 -44.99 74.59 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.672 179.018 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -45.79 -35.73 4.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.622 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.76 15.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.549 0.69 . . . . 0.0 110.904 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.608 HG21 ' HA ' ' A' ' 671' ' ' ALA . 0.1 OUTLIER -71.92 -10.92 14.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.675 -179.253 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.459 ' N ' ' O ' ' A' ' 671' ' ' ALA . 2.0 tm-20 -94.91 -13.44 25.41 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.746 0.308 . . . . 0.0 110.648 178.76 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.83 -8.42 40.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.777 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.438 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -87.67 -27.27 22.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.32 179.332 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.454 ' HB3' ' C ' ' A' ' 655' ' ' SER . 3.7 pp -70.25 -20.51 63.06 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.009 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 13.5 mttm -66.16 67.62 0.05 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.934 0.397 . . . . 0.0 110.636 179.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 678' ' ' LEU . 11.5 t-20 -120.8 157.32 30.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.882 -179.781 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -116.78 -66.3 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.956 179.988 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -168.74 -56.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.9 179.999 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.919 -179.988 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.561 -0.216 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . 64.51 102.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.977 0.418 . . . . 0.0 111.0 -179.827 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -148.1 89.73 1.76 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.285 179.762 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.524 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.8 p90 -104.85 -55.01 2.4 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.039 -179.564 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.571 ' O ' ' HB1' ' A' ' 659' ' ' ALA . 0.7 OUTLIER -78.98 26.09 0.26 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.791 178.899 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.524 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -108.87 -41.21 4.81 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.643 178.461 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.476 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 2.8 tt0 -60.94 -49.46 77.38 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.802 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.581 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -73.0 -5.24 37.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.181 177.531 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.681 ' O ' ' CE1' ' A' ' 662' ' ' TYR . . . -106.72 9.36 31.18 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.497 178.467 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -109.9 -34.24 6.49 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.643 178.375 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 658' ' ' TRP . 20.9 p90 -100.6 13.0 36.17 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.025 177.573 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.762 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -102.98 -26.21 13.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.757 177.996 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.762 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -81.69 -0.56 43.31 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.715 178.924 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 t -124.31 -19.56 5.47 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.604 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 28.4 m -93.65 28.51 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 111.343 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 78.5 10.23 86.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.922 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.557 ' O ' ' N ' ' A' ' 671' ' ' ALA . 5.0 mmmt -105.32 20.75 18.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.003 0.401 . . . . 0.0 110.814 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.422 ' O ' ' HB3' ' A' ' 671' ' ' ALA . 2.3 tp -55.99 -39.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.01 -179.627 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -75.18 -56.92 4.24 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.628 -0.429 . . . . 0.0 109.902 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.08 -16.43 59.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.788 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.583 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -60.33 -41.25 93.14 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.125 179.253 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -49.49 -25.34 2.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.404 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -72.62 -62.39 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.486 ' O ' HG12 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -70.03 -7.1 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.909 179.494 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.433 ' HB2' ' OH ' ' A' ' 662' ' ' TYR . 5.1 tm-20 -75.83 -32.24 59.72 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.482 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -75.1 -4.13 36.78 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.69 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.553 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.7 OUTLIER -96.21 -13.34 23.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.552 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.493 ' N ' ' HB2' ' A' ' 655' ' ' SER . 1.2 tm? -75.68 -26.58 57.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.27 179.379 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? -64.06 69.51 0.02 OUTLIER 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.016 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . 0.479 ' N ' ' O ' ' A' ' 678' ' ' LEU . 62.0 t30 -109.78 -55.64 2.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.793 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 39.3 mmtt -149.09 140.69 23.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.807 -179.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -135.69 82.41 1.95 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 53.8 t30 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.859 179.915 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.522 -0.231 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -106.27 -46.97 3.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.333 . . . . 0.0 111.204 -179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 3.5 p30 43.61 36.23 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.141 -179.662 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.483 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -62.4 -9.83 9.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.114 179.903 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.505 ' OG ' ' OG1' ' A' ' 677' ' ' THR . 0.3 OUTLIER -94.8 26.24 3.66 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 121.147 0.498 . . . . 0.0 110.254 178.937 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.483 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -110.17 -38.57 5.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.536 178.817 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.436 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 7.9 tt0 -67.13 -39.11 86.55 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.677 -179.556 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.436 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 3.6 m-90 -84.6 -20.64 31.1 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.695 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -74.31 -35.59 63.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -179.425 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -76.31 -3.67 38.0 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.837 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.497 ' O ' ' CG2' ' A' ' 665' ' ' VAL . 21.8 m-85 -94.98 -34.94 12.17 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.656 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.784 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.3 OUTLIER -56.18 -39.26 72.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.655 179.196 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.784 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 3.1 ptm85 -62.09 -8.2 5.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.689 -179.557 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.97 -18.58 1.81 Allowed 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . 0.497 ' CG2' ' O ' ' A' ' 661' ' ' TYR . 7.5 t -89.76 19.19 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.606 0.241 . . . . 0.0 110.469 179.181 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.52 29.22 74.44 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.504 -0.855 . . . . 0.0 111.199 -178.763 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.683 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 0.7 OUTLIER -114.8 14.46 17.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 179.582 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . 0.503 ' O ' ' HB1' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -49.03 -25.81 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.031 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -86.39 -56.91 3.22 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.662 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -62.24 -15.99 50.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 176.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.731 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -50.48 -47.03 57.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.678 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -51.16 -21.67 2.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.986 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -74.89 -67.55 0.63 Allowed 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.027 0.442 . . . . 0.0 111.456 179.47 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.516 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -67.84 -13.16 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -80.4 -24.21 39.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.258 178.502 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -82.05 -15.77 52.41 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.586 179.943 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.505 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.93 -16.39 47.56 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.925 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.428 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -55.88 -33.8 64.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.284 178.137 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.77 38.14 0.62 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.316 178.754 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -59.85 -45.7 91.61 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.964 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 3.2 tptt -98.09 143.9 28.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.855 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -95.37 103.58 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.927 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.196 -0.906 . . . . 0.0 110.828 -179.995 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -59.0 -59.68 5.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.988 0.423 . . . . 0.0 111.124 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.53 105.71 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.568 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 654' ' ' TYR . . . . . 0.488 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -145.79 -7.61 0.57 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.921 -179.622 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 655' ' ' SER . . . . . 0.58 ' OG ' HG12 ' A' ' 674' ' ' ILE . 0.4 OUTLIER -96.55 24.49 5.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.145 178.958 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 656' ' ' ALA . . . . . 0.442 ' HA ' ' HB2' ' A' ' 659' ' ' ALA . . . -109.16 -41.96 4.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.771 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 657' ' ' GLN . . . . . 0.448 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.7 OUTLIER -66.25 -31.21 71.89 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.221 -179.944 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 658' ' ' TRP . . . . . 0.588 ' HA ' ' CD1' ' A' ' 661' ' ' TYR . 1.7 m-90 -87.14 -20.07 27.57 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 177.462 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 659' ' ' ALA . . . . . 0.756 ' O ' ' CE1' ' A' ' 662' ' ' TYR . . . -89.93 5.42 46.5 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.317 179.527 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.35 -12.2 13.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.99 178.273 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 661' ' ' TYR . . . . . 0.588 ' CD1' ' HA ' ' A' ' 658' ' ' TRP . 1.6 p90 -111.72 1.11 16.53 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.725 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 662' ' ' TYR . . . . . 0.838 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -95.64 -27.04 15.5 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.36 179.334 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 663' ' ' ARG . . . . . 0.838 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 19.4 mtp180 -81.54 -1.41 46.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.563 178.847 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.6 m -119.9 -26.0 5.71 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.755 -179.52 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 665' ' ' VAL . . . . . . . . . . . . . 24.1 m -92.73 31.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.965 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 67.0 23.52 72.86 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.318 -179.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . 0.598 ' O ' ' N ' ' A' ' 671' ' ' ALA . 0.4 OUTLIER -107.83 15.59 24.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.773 0.32 . . . . 0.0 111.261 179.665 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 2.8 mt -51.5 -32.26 13.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.197 -179.618 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -79.89 -59.67 2.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.223 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -61.9 -16.41 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.592 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 671' ' ' ALA . . . . . 0.749 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -58.87 -40.88 85.66 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.034 179.158 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -48.87 -23.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.616 -0.433 . . . . 0.0 111.194 179.308 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -70.8 -68.35 0.44 Allowed 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 674' ' ' ILE . . . . . 0.58 HG12 ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -68.0 -8.81 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.503 -0.479 . . . . 0.0 109.834 179.93 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 675' ' ' GLU . . . . . 0.466 ' HB2' ' OH ' ' A' ' 662' ' ' TYR . 16.5 tm-20 -77.0 -29.89 55.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.05 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -9.32 58.69 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.398 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 677' ' ' THR . . . . . 0.49 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -91.06 -15.94 28.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.87 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.53 -33.55 71.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.277 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt -57.62 -18.59 20.97 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.551 178.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -42.8 144.2 0.61 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.486 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.68 161.73 40.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.81 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.49 -47.83 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.867 -179.98 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 53.8 p30 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.855 -179.975 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.477 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 . . . . . 0 CA--C 1.513 -0.474 0 CA-C-O 120.839 0.352 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.4 OUTLIER -76.15 19.21 0.24 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.636 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.765 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -104.18 -42.05 5.63 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -58.83 -38.9 79.7 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.571 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.57 -35.94 60.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.8 179.086 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.667 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -71.05 -16.04 62.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.567 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.02 -37.97 69.66 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.257 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.702 ' O ' HG23 ' A' ' 665' ' ' VAL . 32.1 m-85 -62.65 -46.07 89.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.888 0.375 . . . . 0.0 110.753 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.786 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 10.0 m-85 -54.86 -28.83 53.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.601 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 7.3 mmt85 -63.24 -20.08 65.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.877 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.03 -15.6 9.25 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 661' ' ' TYR . 20.4 t -91.71 25.83 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.858 0.361 . . . . 0.0 110.341 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.88 65.28 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.72 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.478 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 3.0 mttt -124.36 16.24 9.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.94 0.4 . . . . 0.0 110.825 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.604 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.16 -31.58 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.214 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -60.04 2.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.931 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -22.64 57.3 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.786 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.62 -32.27 72.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.352 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -52.44 -36.12 53.87 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.943 0.402 . . . . 0.0 110.489 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.56 -67.95 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.317 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.767 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -59.6 -17.58 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.712 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.563 ' O ' HD23 ' A' ' 678' ' ' LEU . 72.7 tt0 -78.79 -26.13 44.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.368 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -71.6 -19.14 62.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.309 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.431 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -76.21 -23.47 54.61 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.729 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.765 HD22 ' HB2' ' A' ' 656' ' ' ALA . 0.9 OUTLIER -68.36 -28.49 67.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.126 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 4.3 tptt . . . . . 0 C--O 1.231 0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.102 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.478 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 120.908 0.385 . . . . 0.0 111.578 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.608 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.7 OUTLIER -77.26 23.46 0.2 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.34 0.591 . . . . 0.0 110.685 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.634 ' HB2' ' CD2' ' A' ' 678' ' ' LEU . . . -108.38 -37.1 6.07 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.875 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.457 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -63.0 -34.32 77.31 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.993 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.498 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . 2.4 m-90 -84.04 -35.43 23.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.5 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -67.16 -18.78 65.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.84 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -70.56 -43.79 68.75 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-O 121.001 0.429 . . . . 0.0 110.749 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.586 ' O ' HG22 ' A' ' 665' ' ' VAL . 71.8 m-85 -62.64 -48.89 77.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.818 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 13.8 m-85 -54.18 -37.61 64.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.675 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.787 ' HG3' HG23 ' A' ' 668' ' ' ILE . 1.1 mpt_? -68.98 -9.73 53.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.684 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 4.2 m -122.04 -22.86 5.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 661' ' ' TYR . 35.6 m -93.44 31.65 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.85 0.357 . . . . 0.0 110.715 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.11 65.41 Favored Glycine 0 CA--C 1.506 -0.505 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.037 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.581 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -120.04 19.64 12.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.201 0.524 . . . . 0.0 110.444 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.787 HG23 ' HG3' ' A' ' 663' ' ' ARG . 1.4 mp -47.83 -32.01 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.611 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -70.28 -60.75 2.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.308 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.14 -22.19 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.136 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.818 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.9 -37.85 86.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.207 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.09 -30.89 7.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.825 0.345 . . . . 0.0 110.476 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.78 -69.81 0.28 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.185 0.517 . . . . 0.0 110.484 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.638 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -62.2 -17.51 18.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.27 179.471 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -76.2 -28.96 57.45 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -73.13 -9.97 59.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.147 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.542 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.2 OUTLIER -91.26 -9.51 44.9 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.934 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.716 HD13 ' O ' ' A' ' 678' ' ' LEU . 3.4 tm? -73.03 -29.91 63.35 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.428 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.7 tptp . . . . . 0 C--N 1.333 -0.137 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.876 179.902 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.505 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.8 p90 . . . . . 0 CA--C 1.512 -0.519 0 CA-C-O 121.011 0.434 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.632 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -75.26 21.22 0.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.705 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.92 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -105.93 -42.29 5.17 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.12 -37.3 82.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.592 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.55 -36.52 63.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.825 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.818 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -71.16 -13.05 61.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.663 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.38 -38.04 63.26 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.956 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.864 ' O ' HG23 ' A' ' 665' ' ' VAL . 35.5 m-85 -65.38 -50.52 65.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.859 0.361 . . . . 0.0 110.372 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.815 ' CE2' HG21 ' A' ' 674' ' ' ILE . 16.3 m-85 -52.87 -32.91 47.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.32 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.959 ' HA ' HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -66.29 -12.06 54.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.297 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 5.1 p -134.91 20.04 3.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.826 0.346 . . . . 0.0 111.62 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.864 HG23 ' O ' ' A' ' 661' ' ' TYR . 22.0 t -128.56 22.81 2.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.808 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.71 24.69 72.79 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.493 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.426 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -124.15 15.7 9.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.232 0.539 . . . . 0.0 110.643 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.959 HG22 ' HA ' ' A' ' 663' ' ' ARG . 10.0 pt -45.59 -33.81 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.559 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -67.98 -61.95 1.63 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.307 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 670' ' ' GLU . . . . . 0.4 ' HB3' ' CG ' ' A' ' 667' ' ' LYS . 3.0 tm-20 -58.37 -22.35 53.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.809 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -63.94 -35.73 81.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.476 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.07 -39.55 59.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.837 0.351 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.87 -63.2 1.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.416 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.818 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -61.8 -13.79 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.805 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.549 ' HG2' HD23 ' A' ' 678' ' ' LEU . 2.4 tm-20 -82.35 -27.89 31.9 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 110.486 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -76.74 -10.33 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.632 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -80.2 -25.14 39.81 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.008 178.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.92 HD22 ' HB2' ' A' ' 656' ' ' ALA . 2.4 pp -60.91 -27.95 68.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.717 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.7 tttt . . . . . 0 C--N 1.333 -0.134 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.559 179.733 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.485 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.6 p90 . . . . . 0 CA--C 1.512 -0.487 0 CA-C-O 120.892 0.377 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.608 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -77.75 25.63 0.2 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.543 0.687 . . . . 0.0 110.32 179.297 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.533 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -109.19 -36.63 5.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.442 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 6.6 tt0 -63.22 -29.81 71.07 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.643 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.518 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -87.47 -35.09 18.43 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.73 ' HB2' HG23 ' A' ' 674' ' ' ILE . . . -77.06 -8.63 57.78 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.098 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -88.11 -47.59 8.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.285 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.1 p90 -72.84 -21.95 60.87 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.199 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.783 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.2 m-85 -67.44 -32.72 73.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.114 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.829 ' HG3' HG23 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -67.4 -8.16 30.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.0 m -116.38 -22.73 8.65 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.527 HG23 ' HG3' ' A' ' 667' ' ' LYS . 31.2 m -96.44 35.42 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.982 0.42 . . . . 0.0 110.398 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.03 23.2 56.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.777 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.527 ' HG3' HG23 ' A' ' 665' ' ' VAL . 0.6 OUTLIER -111.87 19.0 18.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.001 0.429 . . . . 0.0 110.656 179.636 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.829 HG23 ' HG3' ' A' ' 663' ' ' ARG . 3.3 mt -49.21 -42.02 14.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.941 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -68.22 -54.74 15.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.471 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -23.25 66.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.433 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.783 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -65.23 -43.04 92.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.426 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -47.87 -35.22 10.03 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.745 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.74 -67.74 0.4 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.317 0.58 . . . . 0.0 110.3 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.73 HG23 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -55.0 -31.52 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.924 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.485 ' CD ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -60.31 -32.69 71.46 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.949 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.16 -23.19 67.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.626 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.418 ' O ' ' CZ ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -80.9 -16.7 52.9 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.386 179.146 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.669 HD12 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -75.12 -23.29 57.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.1 mttp . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 179.448 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.456 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.4 p90 . . . . . 0 CA--C 1.513 -0.448 0 CA-C-O 120.886 0.374 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.645 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -75.96 17.33 0.34 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.938 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.589 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -102.61 -45.24 5.1 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.6 -36.67 79.12 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.517 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.74 -30.58 59.25 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.972 179.164 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.632 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -80.48 -4.91 55.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.848 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.68 -38.08 26.4 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.771 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -66.86 -26.67 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.754 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.774 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.7 m-85 -66.62 -37.35 84.67 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.072 0.463 . . . . 0.0 110.12 179.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -64.57 -11.12 31.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.795 -179.782 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.69 -26.34 11.37 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 665' ' ' VAL . 19.6 t -96.28 35.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.037 0.446 . . . . 0.0 110.288 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.81 28.32 57.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.536 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HD3' ' CD1' ' A' ' 662' ' ' TYR . 12.2 mttm -116.59 18.09 15.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 111.14 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.588 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -49.71 -30.05 5.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.71 -56.76 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.09 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.05 -23.34 65.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.002 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.774 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.47 -40.82 95.89 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.174 179.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.52 -33.19 3.86 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.726 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.07 -68.29 0.37 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.481 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.679 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -59.72 -19.1 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.472 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.647 ' O ' HD23 ' A' ' 678' ' ' LEU . 1.4 tt0 -72.91 -30.02 63.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -23.57 67.48 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.271 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.441 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.22 -15.22 59.57 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.695 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.647 HD23 ' O ' ' A' ' 675' ' ' GLU . 0.5 OUTLIER -76.25 -23.78 54.52 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.875 0.369 . . . . 0.0 111.199 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.978 0.418 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.74 ' HA ' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -127.14 18.08 7.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.495 0.664 . . . . 0.0 110.559 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.03 -35.58 4.05 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.3 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.543 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.6 tt0 -76.53 -12.38 60.02 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.279 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.543 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 1.6 m-90 -106.03 -31.88 8.54 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.804 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -79.83 -15.06 58.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.294 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.419 ' HG3' ' CD1' ' A' ' 661' ' ' TYR . 11.4 pt-20 -78.81 -34.18 45.56 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 120.723 0.297 . . . . 0.0 110.857 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.792 ' O ' HG23 ' A' ' 665' ' ' VAL . 45.9 m-85 -70.85 -47.05 61.45 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.56 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.915 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 21.9 m-85 -60.43 -35.33 75.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.194 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.821 ' HA ' HG22 ' A' ' 668' ' ' ILE . 0.1 OUTLIER -65.8 -13.8 60.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.342 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 36.3 p -118.86 -20.82 8.04 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 661' ' ' TYR . 20.2 t -93.83 32.19 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.45 24.43 56.12 Favored Glycine 0 CA--C 1.507 -0.462 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.847 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.476 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 2.3 mmpt? -116.67 19.37 14.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.072 0.463 . . . . 0.0 110.346 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.821 HG22 ' HA ' ' A' ' 663' ' ' ARG . 15.3 pt -44.16 -33.21 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.14 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -67.76 -59.92 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.168 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.33 -25.94 60.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.116 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.915 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -59.33 -38.89 81.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.13 179.117 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.73 -32.14 5.52 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.445 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -69.73 0.27 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.339 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.804 HD12 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -57.06 -23.51 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.029 179.364 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.41 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 1.4 mm-40 -64.88 -29.55 70.5 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.1 mtpt -69.41 -15.88 63.38 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.926 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.467 ' HB ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -73.54 -21.02 60.49 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.317 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -54.03 -29.54 44.17 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.72 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.4 tttt . . . . . 0 CA--C 1.534 0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.116 179.03 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.414 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 4.5 p90 . . . . . 0 CA--C 1.513 -0.454 0 CA-C-O 121.006 0.432 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.552 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.6 OUTLIER -84.91 23.51 1.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.073 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.645 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -112.0 -38.15 4.88 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.097 178.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.455 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.8 tt0 -65.84 -26.9 67.87 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.542 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -90.18 -35.75 15.19 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.91 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.51 -2.77 47.45 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.335 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -94.22 -42.59 8.87 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.081 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.752 ' O ' HG23 ' A' ' 665' ' ' VAL . 4.1 p90 -76.62 -15.35 59.85 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.393 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.756 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 8.6 m-85 -73.79 -30.2 62.62 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.459 ' HD2' HG13 ' A' ' 668' ' ' ILE . 6.4 mmt85 -69.94 -9.08 53.8 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.575 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 16.2 m -126.46 14.44 7.66 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.752 HG23 ' O ' ' A' ' 661' ' ' TYR . 26.0 t -132.57 34.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.221 0.534 . . . . 0.0 109.714 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.85 26.03 64.71 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.625 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.442 ' HD3' ' CE1' ' A' ' 662' ' ' TYR . 14.0 mttp -122.42 16.05 10.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 111.315 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.459 HG13 ' HD2' ' A' ' 663' ' ' ARG . 5.0 tt -51.0 -36.03 15.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -75.76 -45.97 33.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.475 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.73 -25.99 66.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.231 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.756 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -63.18 -33.22 75.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.331 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -51.96 -35.53 46.5 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.552 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.22 -67.47 0.42 Allowed 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.794 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.91 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.7 OUTLIER -59.8 -19.14 16.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.487 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.819 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 1.0 OUTLIER -65.31 -33.78 76.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.596 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -17.55 64.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.323 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.552 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.23 -11.37 57.87 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.957 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.645 ' CD1' ' HB2' ' A' ' 656' ' ' ALA . 21.8 tp -65.72 -30.95 71.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.337 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.158 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.548 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.459 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.1 p90 . . . . . 0 CA--C 1.516 -0.362 0 CA-C-O 120.917 0.389 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.413 ' OG ' ' CD2' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -85.22 20.43 1.96 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.114 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -114.23 -37.44 4.39 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.088 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.491 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.3 tt0 -66.8 -26.58 67.01 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.149 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.647 ' HB2' HD13 ' A' ' 674' ' ' ILE . 2.0 m-90 -90.53 -31.59 16.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 1.026 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.61 -6.49 58.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.847 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.25 -37.28 11.61 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.598 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.522 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.7 p90 -79.71 -17.41 53.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.449 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.781 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 6.7 m-85 -73.32 -29.45 62.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.979 0.419 . . . . 0.0 109.909 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm-85 -69.32 -9.93 55.56 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.412 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 6.2 t -116.67 -23.43 8.18 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.71 HG23 ' HB2' ' A' ' 667' ' ' LYS . 29.9 m -94.4 33.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.002 0.43 . . . . 0.0 110.353 179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 55.48 29.29 53.22 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.608 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.71 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -119.41 17.62 12.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.134 0.492 . . . . 0.0 111.185 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 4.8 tt -50.0 -30.57 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.643 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.43 -61.42 1.79 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.532 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -58.27 -24.49 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.813 0.339 . . . . 0.0 110.124 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.781 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -62.33 -29.15 70.24 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.944 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -51.32 -49.88 60.5 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.04 -65.01 0.67 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.852 0.835 . . . . 0.0 109.838 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 1.026 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -50.49 -28.88 5.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.026 -1.443 . . . . 0.0 110.776 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.51 ' CG ' ' HB1' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -71.44 -24.99 62.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.523 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -81.24 -14.98 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.874 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -26.65 56.48 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 678' ' ' LEU . 12.3 tp -51.57 -29.82 18.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.999 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.1 tttt . . . . . 0 CA--C 1.533 0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.456 179.514 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.429 ' C ' ' H ' ' A' ' 656' ' ' ALA . 7.3 p90 . . . . . 0 CA--C 1.514 -0.442 0 CA-C-O 120.885 0.374 . . . . 0.0 111.621 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.564 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -79.52 22.23 0.46 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.794 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -109.43 -44.36 3.91 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.024 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -61.97 -27.02 68.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.539 ' HB3' ' CD1' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -91.2 -22.84 20.43 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.085 179.214 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.791 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -89.05 -6.09 57.39 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.6 -35.51 27.01 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.895 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.2 OUTLIER -70.99 -30.05 66.19 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.685 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.799 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.8 m-85 -63.18 -34.56 77.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.237 0.541 . . . . 0.0 109.969 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.822 ' HG3' HG23 ' A' ' 668' ' ' ILE . 0.7 OUTLIER -72.57 -1.95 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.71 -27.03 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 665' ' ' VAL . 13.2 p -97.95 35.91 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.041 0.448 . . . . 0.0 110.486 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.23 27.05 66.87 Favored Glycine 0 CA--C 1.508 -0.365 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.209 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.588 ' HD2' HG13 ' A' ' 665' ' ' VAL . 3.6 mttt -114.67 20.97 14.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.074 0.464 . . . . 0.0 110.696 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.822 HG23 ' HG3' ' A' ' 663' ' ' ARG . 5.5 mt -48.26 -32.33 3.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.371 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -39.42 28.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.495 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -25.49 62.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.799 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.53 -33.41 75.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.177 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -51.21 -31.68 21.28 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.477 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.91 -69.78 0.27 Allowed 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.437 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.791 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -58.77 -21.99 20.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.558 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -67.85 -24.67 65.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.074 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -17.6 64.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.298 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.564 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.4 OUTLIER -89.93 -1.7 58.02 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.839 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.837 HD23 ' O ' ' A' ' 678' ' ' LEU . 6.1 tt -79.72 -30.2 40.89 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.583 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.258 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.281 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.431 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.5 p90 . . . . . 0 CA--C 1.516 -0.345 0 CA-C-O 120.599 0.238 . . . . 0.0 111.545 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -80.07 23.73 0.45 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.119 0.485 . . . . 0.0 110.607 179.317 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.731 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -109.79 -44.52 3.81 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -63.26 -35.94 82.02 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.711 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -77.46 -35.22 54.05 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.52 178.74 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.867 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -71.32 -13.81 62.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.553 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.59 -38.72 54.41 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -64.53 -41.85 96.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.835 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 15.5 m-85 -57.78 -28.1 63.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.888 ' HD2' HG23 ' A' ' 668' ' ' ILE . 0.5 OUTLIER -71.44 -8.72 55.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.358 179.666 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 p -121.7 -23.76 5.46 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.651 HG23 ' CG ' ' A' ' 667' ' ' LYS . 29.7 m -92.78 31.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.831 0.348 . . . . 0.0 110.741 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.76 29.44 67.33 Favored Glycine 0 CA--C 1.506 -0.508 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.092 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.651 ' CG ' HG23 ' A' ' 665' ' ' VAL . 6.4 mmtt -119.82 18.35 12.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.1 0.476 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.888 HG23 ' HD2' ' A' ' 663' ' ' ARG . 2.2 mt -46.66 -32.75 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.564 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.5 -47.96 18.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.359 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -65.59 -24.12 67.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.165 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.835 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -62.72 -38.03 88.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.451 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -51.01 -32.07 20.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.939 0.4 . . . . 0.0 110.497 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.93 -69.26 0.31 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.542 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.867 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -57.67 -24.46 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.661 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.699 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 6.2 mt-10 -63.36 -25.38 68.27 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.699 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -5.45 44.86 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.384 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.419 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -93.25 -15.14 26.19 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.731 HD13 ' HB2' ' A' ' 656' ' ' ALA . 19.1 tp -64.64 -31.78 73.14 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.817 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 6.9 mttp . . . . . 0 C--N 1.333 -0.126 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.497 179.463 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.436 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 . . . . . 0 CA--C 1.514 -0.431 0 CA-C-O 121.023 0.44 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.488 ' OG ' ' C ' ' A' ' 677' ' ' THR . 0.3 OUTLIER -80.16 24.69 0.41 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.411 0.624 . . . . 0.0 110.719 179.752 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.436 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -110.78 -39.36 4.87 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.194 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.2 OUTLIER -68.34 -22.14 64.7 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.771 -179.778 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.572 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.1 m-90 -93.78 -36.41 12.29 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.624 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -77.79 -7.5 56.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.159 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -90.06 -46.3 8.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.15 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.572 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.4 p90 -73.88 -21.77 59.97 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.031 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.795 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.9 m-85 -66.88 -32.61 73.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.429 ' HG3' HG13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -71.93 -4.27 27.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.634 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.3 18.54 4.88 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 665' ' ' VAL . 14.8 p -136.74 32.88 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.043 0.449 . . . . 0.0 109.82 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.73 26.14 66.5 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.542 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.598 ' HB2' HG13 ' A' ' 665' ' ' VAL . 2.1 tptt -123.71 17.47 9.51 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.112 0.482 . . . . 0.0 111.18 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.429 HG13 ' HG3' ' A' ' 663' ' ' ARG . 4.8 tt -52.25 -35.35 19.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.569 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.5 -48.73 30.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.494 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -24.71 67.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.146 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.795 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.26 -37.83 88.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.49 -33.76 32.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.996 0.427 . . . . 0.0 110.534 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.12 -67.58 0.43 Allowed 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.714 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.656 HG21 ' HE2' ' A' ' 662' ' ' TYR . 0.6 OUTLIER -58.34 -22.8 20.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.275 179.546 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.512 ' CG ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -61.69 -34.24 75.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.988 178.868 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -74.3 -7.26 52.18 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.659 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.488 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -88.39 -19.91 25.97 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 177.81 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.847 HD13 ' O ' ' A' ' 678' ' ' LEU . 3.1 tm? -60.39 -28.95 68.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.564 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.189 0 CA-C-O 121.038 0.447 . . . . 0.0 110.381 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.405 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 5.6 p90 . . . . . 0 CA--C 1.515 -0.379 0 CA-C-O 120.947 0.403 . . . . 0.0 111.447 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.662 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.8 OUTLIER -82.16 22.13 0.84 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.771 179.854 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.732 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -110.63 -44.33 3.69 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.911 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -62.97 -38.19 90.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.626 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.61 -33.01 62.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.397 178.572 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.888 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -74.58 -9.07 58.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -82.0 -37.56 26.4 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 120.731 0.3 . . . . 0.0 111.011 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -64.52 -40.64 95.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.409 . . . . 0.0 110.703 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.889 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 14.5 m-85 -57.19 -28.93 63.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.795 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.456 ' HD2' HG13 ' A' ' 668' ' ' ILE . 8.2 mmt85 -73.65 -6.81 49.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.259 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.8 t -133.68 24.23 4.01 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.597 HG22 ' HA ' ' A' ' 662' ' ' TYR . 32.9 m -140.71 28.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.114 0.483 . . . . 0.0 109.975 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.5 27.01 72.09 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.764 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.508 ' HB2' HG23 ' A' ' 665' ' ' VAL . 1.2 mptt -125.7 16.02 8.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.984 0.421 . . . . 0.0 110.954 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.456 HG13 ' HD2' ' A' ' 663' ' ' ARG . 10.3 tt -48.19 -30.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.409 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -83.89 -37.05 22.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.129 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.29 -25.64 62.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.083 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.889 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -62.06 -34.12 75.68 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.397 179.272 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -52.26 -35.25 49.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.927 0.394 . . . . 0.0 110.467 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -68.3 0.37 Allowed 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.462 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.888 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -58.02 -22.58 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.718 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.788 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 2.3 mm-40 -64.58 -24.61 67.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.173 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.39 59.09 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.211 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.662 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -86.54 -15.03 41.22 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.677 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.732 HD22 ' HB2' ' A' ' 656' ' ' ALA . 21.7 tp -61.2 -31.77 71.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.291 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.157 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.449 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.491 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 120.645 0.26 . . . . 0.0 111.672 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.5 OUTLIER -98.27 26.96 4.95 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.721 0.772 . . . . 0.0 109.753 178.803 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 1.031 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.33 -34.34 6.58 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.981 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.472 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -65.31 -37.78 88.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 658' ' ' TRP . . . . . . . . . . . . . 3.2 m-90 -79.89 -38.41 32.68 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.542 ' HB2' HG23 ' A' ' 674' ' ' ILE . . . -62.4 -18.97 62.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.222 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -75.32 -35.66 61.18 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 70.3 m-85 -66.49 -42.43 87.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.97 0.414 . . . . 0.0 110.843 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.791 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 22.2 m-85 -57.5 -30.53 65.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.869 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.532 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm180 -68.97 -12.59 61.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.274 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -120.84 -24.49 5.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.635 HG22 ' HA ' ' A' ' 662' ' ' TYR . 25.7 m -91.32 30.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.911 0.386 . . . . 0.0 110.617 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.84 36.6 80.66 Favored Glycine 0 CA--C 1.505 -0.564 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.217 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 12.4 mmtt -128.1 16.48 6.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.02 0.438 . . . . 0.0 111.047 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.84 -30.31 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.418 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.66 -60.96 1.98 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.065 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.87 -22.7 59.68 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.791 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -59.3 -36.38 75.49 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.132 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.58 -36.9 11.33 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.16 -69.15 0.3 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.362 0.601 . . . . 0.0 110.263 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.892 HD13 ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -55.97 -23.55 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.254 179.444 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 678' ' ' LEU . 9.4 tt0 -76.6 -14.86 59.96 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.971 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -81.71 -21.8 37.75 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.907 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.505 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -73.16 -17.76 61.34 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.22 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.031 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -50.67 -37.47 41.11 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.06 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.211 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.917 178.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.443 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.7 p90 . . . . . 0 CA--C 1.515 -0.379 0 CA-C-O 120.838 0.351 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.849 ' HA ' HD11 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -84.59 21.11 1.56 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.436 0.636 . . . . 0.0 110.388 179.12 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.52 ' HB2' HD11 ' A' ' 678' ' ' LEU . . . -112.74 -36.1 5.28 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.234 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.443 ' O ' ' CD2' ' A' ' 661' ' ' TYR . 1.4 tt0 -67.75 -34.81 77.56 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.702 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.473 ' O ' ' CD2' ' A' ' 662' ' ' TYR . 2.4 m-90 -83.09 -40.73 19.44 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.678 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -71.0 -12.49 61.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.939 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -95.37 -30.83 13.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 120.897 0.38 . . . . 0.0 110.234 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.719 ' O ' HG13 ' A' ' 665' ' ' VAL . 22.3 m-30 -79.59 -30.88 41.69 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.19 179.208 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.763 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 15.7 m-85 -65.85 -33.82 76.72 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.684 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 38.3 mmm-85 -68.46 -12.62 61.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.424 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.8 m -124.06 -21.16 5.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.719 HG13 ' O ' ' A' ' 661' ' ' TYR . 11.8 m -93.31 28.04 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.878 0.371 . . . . 0.0 110.735 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.25 38.15 95.73 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 121.144 -0.55 . . . . 0.0 112.498 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.493 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 6.2 mttp -133.09 18.32 4.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.123 0.487 . . . . 0.0 110.395 178.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.65 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.96 -30.15 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.418 179.356 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -77.81 -50.41 12.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.406 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.62 -17.75 65.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.763 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -64.88 -36.65 85.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.523 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.53 -33.45 31.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.821 0.344 . . . . 0.0 110.479 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.6 -68.66 0.36 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.849 HD11 ' HA ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -54.19 -24.05 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.315 179.625 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.97 73.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -74.45 -21.81 59.42 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.826 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.5 -20.98 62.8 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 656' ' ' ALA . 1.8 tp -50.17 -32.82 17.19 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.648 178.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.213 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.045 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.457 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.2 p90 . . . . . 0 CA--C 1.512 -0.505 0 CA-C-O 120.958 0.408 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.5 ' HB3' ' N ' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -79.31 22.84 0.41 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.422 0.629 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.759 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -108.67 -37.89 5.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.057 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.496 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.1 tt0 -67.41 -22.03 65.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.809 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.558 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.5 m-90 -92.72 -34.17 14.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 109.247 178.457 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.829 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.26 -6.42 57.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.696 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.14 -39.93 10.31 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.326 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.558 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.5 p90 -77.72 -19.32 55.42 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.089 179.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.659 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.2 m-85 -68.21 -33.96 75.37 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.234 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.441 ' HA ' ' HB ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -61.3 -14.1 24.18 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.667 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 42.4 p -108.62 -25.27 10.97 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.806 HG13 ' HG3' ' A' ' 667' ' ' LYS . 13.4 p -95.82 34.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.26 30.59 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.911 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.806 ' HG3' HG13 ' A' ' 665' ' ' VAL . 13.7 mttt -119.6 16.65 12.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.08 0.467 . . . . 0.0 111.302 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.441 ' HB ' ' HA ' ' A' ' 663' ' ' ARG . 7.6 tt -49.69 -41.35 16.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.832 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.64 -57.85 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.507 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -22.49 64.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.399 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.659 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -66.21 -39.92 89.98 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.583 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.36 -34.2 32.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.15 -67.36 0.44 Allowed 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.363 0.601 . . . . 0.0 110.54 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.829 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -56.04 -25.31 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.36 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.792 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -60.05 -37.46 79.91 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.637 179.087 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.17 -19.09 62.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.876 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.417 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.74 -13.57 47.94 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.209 179.142 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.759 HD13 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -79.12 -22.77 44.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.859 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.906 0.384 . . . . 0.0 110.596 179.687 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.498 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.197 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.47 ' OG ' ' OG1' ' A' ' 677' ' ' THR . 0.4 OUTLIER -97.6 26.44 5.01 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.984 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.924 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -111.72 -36.74 5.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.362 178.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -30.52 70.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.128 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.55 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.2 m-90 -86.4 -34.55 20.15 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.561 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -81.45 -2.91 51.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.431 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -96.7 -42.77 7.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.925 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.55 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 2.8 p90 -75.51 -23.94 56.78 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.767 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.0 m-85 -65.47 -29.69 70.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.947 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 668' ' ' ILE . 20.8 mmm-85 -69.32 -9.98 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.563 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -118.67 -22.79 7.31 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.625 HG12 ' HA ' ' A' ' 662' ' ' TYR . 14.6 p -94.35 33.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.04 0.448 . . . . 0.0 110.53 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.77 28.61 63.29 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.923 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.617 ' HB2' HG13 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -120.17 18.16 12.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 179.673 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.543 ' C ' HD13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -51.52 -32.8 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.722 179.441 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.95 -54.36 8.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.166 179.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -22.66 66.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.083 179.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.767 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -64.42 -34.26 77.78 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.577 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -53.26 -33.16 51.95 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.874 0.368 . . . . 0.0 110.454 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.75 -69.11 0.33 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.268 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.632 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -56.8 -23.21 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.803 179.197 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 678' ' ' LEU . 43.2 tt0 -66.92 -26.8 67.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.657 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -68.06 -20.81 64.99 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.484 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.47 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.05 -15.09 52.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.648 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.924 ' CD1' ' HB2' ' A' ' 656' ' ' ALA . 10.8 tp -55.22 -37.46 67.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.195 178.211 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 mptt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.777 178.591 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.463 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.392 0 CA-C-O 121.015 0.436 . . . . 0.0 111.001 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.607 ' HB3' ' HG1' ' A' ' 677' ' ' THR . 0.1 OUTLIER -124.79 19.6 8.55 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.51 0.671 . . . . 0.0 110.715 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.21 -31.55 5.28 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.51 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.489 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -74.87 -24.41 58.56 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.43 -179.599 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.685 ' HB2' HD13 ' A' ' 674' ' ' ILE . 1.6 m-90 -92.69 -33.15 14.46 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 1.003 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -75.48 -13.37 60.37 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.34 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.68 -33.36 47.07 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.43 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.557 ' O ' HG22 ' A' ' 665' ' ' VAL . 59.4 m-85 -73.47 -45.44 54.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.676 0.274 . . . . 0.0 111.015 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 1.026 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 13.3 m-85 -64.43 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.946 0.403 . . . . 0.0 110.143 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.417 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.8 OUTLIER -67.51 -11.87 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.197 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 87.1 p -121.36 -24.15 5.51 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.628 HG22 ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -91.86 30.27 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.772 0.32 . . . . 0.0 110.892 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.86 29.3 70.12 Favored Glycine 0 CA--C 1.505 -0.576 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.133 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.499 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 3.6 mtpp -121.67 19.55 11.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.179 0.514 . . . . 0.0 110.27 178.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.417 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 1.5 mp -46.58 -30.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.463 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -65.62 -57.33 8.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.926 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.74 -29.25 69.99 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 1.026 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -57.14 -29.78 63.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.783 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -48.94 -49.67 39.17 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.618 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.12 -65.67 0.56 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.887 0.851 . . . . 0.0 109.713 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 1.003 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -49.35 -35.5 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.841 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.24 -27.27 67.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -76.91 -11.81 59.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.943 179.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.607 ' HG1' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.6 -20.88 53.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.855 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 678' ' ' LEU . 0.3 OUTLIER -52.24 -33.25 40.65 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.741 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.258 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.966 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.193 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 4.6 m -100.48 27.03 6.07 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.573 0.701 . . . . 0.0 109.644 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.684 ' HB2' HD23 ' A' ' 678' ' ' LEU . . . -108.72 -38.66 5.58 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.789 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.443 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.8 OUTLIER -59.15 -29.44 67.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.487 -179.61 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 2.0 m-90 -88.54 -33.55 17.69 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 1.002 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -67.57 -24.17 65.48 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.493 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -33.09 72.77 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.782 0.325 . . . . 0.0 111.59 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.835 ' O ' HG23 ' A' ' 665' ' ' VAL . 62.8 m-85 -66.8 -46.86 73.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.893 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 23.9 m-85 -56.8 -30.88 64.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.942 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 10.2 mmm180 -61.38 -22.04 64.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.631 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.5 m -117.2 -16.14 10.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.824 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.835 HG23 ' O ' ' A' ' 661' ' ' TYR . 18.5 t -92.53 27.41 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.814 0.34 . . . . 0.0 110.297 179.191 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.19 29.34 62.65 Favored Glycine 0 CA--C 1.505 -0.571 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.794 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.418 ' C ' ' HB3' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -124.48 14.94 8.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.091 0.472 . . . . 0.0 110.954 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 5.4 tt -44.95 -31.87 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.566 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -70.14 -62.42 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.193 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.53 -23.99 53.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.893 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -60.63 -26.62 67.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.489 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -49.36 -44.49 44.78 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -59.5 -67.14 0.41 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.495 0.664 . . . . 0.0 109.896 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 1.002 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -51.03 -32.26 11.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.331 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 12.2 tt0 -72.49 -10.78 60.21 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.881 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.35 -13.63 37.44 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.607 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.474 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.19 -17.61 36.59 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 177.732 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.684 HD23 ' HB2' ' A' ' 656' ' ' ALA . 3.3 tm? -55.74 -34.66 65.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.41 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.853 178.464 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.46 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.9 OUTLIER . . . . . 0 CA--C 1.515 -0.398 0 CA-C-O 120.914 0.388 . . . . 0.0 110.804 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.42 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.2 OUTLIER -83.86 19.39 1.73 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 110.394 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.605 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -113.66 -43.46 3.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.934 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -63.28 -34.86 78.61 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.5 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -80.23 -29.8 38.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.159 179.435 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.909 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -79.22 -13.36 59.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.189 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 663' ' ' ARG . 22.3 mt-10 -76.23 -36.7 58.42 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -67.53 -23.42 65.44 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.263 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.803 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.0 m-85 -67.76 -58.07 5.25 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.062 0.458 . . . . 0.0 110.588 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.608 ' CB ' HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -60.02 -7.65 1.9 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.812 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.1 m -90.96 -35.92 14.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.699 0.285 . . . . 0.0 111.368 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 665' ' ' VAL . 22.3 t -99.36 37.06 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.095 0.474 . . . . 0.0 110.127 179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.69 26.33 68.41 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.647 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.95 19.69 20.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 0.0 110.727 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.608 HG22 ' CB ' ' A' ' 663' ' ' ARG . 22.5 pt -45.85 -37.93 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.806 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 669' ' ' GLU . . . . . 0.435 ' N ' HG13 ' A' ' 668' ' ' ILE . 9.4 tt0 -67.25 -58.12 5.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -60.06 -23.0 63.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.684 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.803 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -67.73 -38.3 83.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.72 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -52.3 -32.85 39.55 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.954 0.406 . . . . 0.0 110.499 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.64 -67.7 0.41 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.874 179.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.909 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -61.47 -19.54 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.912 179.688 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.739 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 2.5 mt-10 -68.59 -27.1 65.75 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -71.5 -13.41 61.8 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.228 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.65 -23.24 56.27 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.041 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.605 HD22 ' HB2' ' A' ' 656' ' ' ALA . 12.7 tp -51.59 -30.04 19.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.049 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.565 179.485 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.417 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.4 p90 . . . . . 0 CA--C 1.514 -0.423 0 CA-C-O 120.693 0.282 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.522 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -76.72 11.66 1.61 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.186 0.517 . . . . 0.0 110.63 179.246 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.794 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -92.51 -44.21 8.75 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -32.81 70.98 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.676 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -82.21 -23.52 35.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.044 179.017 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.879 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -89.09 0.07 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.45 -39.24 16.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.548 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -70.29 -30.21 67.17 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.715 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.849 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.4 m-85 -62.81 -35.49 80.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.13 0.49 . . . . 0.0 109.956 178.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.731 ' HA ' HG22 ' A' ' 668' ' ' ILE . 2.6 mpt_? -71.11 -2.76 16.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.935 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.6 m -109.93 -28.9 8.51 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.673 HG23 ' HB2' ' A' ' 667' ' ' LYS . 4.7 m -97.57 36.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.024 0.44 . . . . 0.0 110.311 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.7 27.08 61.02 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.569 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.673 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.3 OUTLIER -111.31 19.41 18.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.04 0.448 . . . . 0.0 110.864 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.731 HG22 ' HA ' ' A' ' 663' ' ' ARG . 24.3 pt -47.18 -35.25 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.539 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -70.54 -49.57 46.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.765 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.68 -29.71 70.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.537 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.849 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.81 -33.27 75.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.187 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.528 ' HA ' ' HG2' ' A' ' 675' ' ' GLU . 2.8 mt-10 -58.93 -22.18 59.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.132 -179.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -81.8 -61.47 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.44 0.638 . . . . 0.0 110.319 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.879 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.8 OUTLIER -62.5 -25.51 38.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.047 -179.567 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.704 ' HB3' ' CB ' ' A' ' 659' ' ' ALA . 1.5 pp20? -69.82 -29.52 66.82 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.276 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -24.1 12.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.856 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.86 -20.22 59.83 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.556 179.387 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.794 HD22 ' HB2' ' A' ' 656' ' ' ALA . 1.1 pp -73.54 -19.56 60.88 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.109 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 pttt . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.821 0.343 . . . . 0.0 111.548 -179.898 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.572 ' HB2' ' HB ' ' A' ' 677' ' ' THR . 0.1 OUTLIER -100.33 23.0 10.72 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.494 0.664 . . . . 0.0 110.336 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -108.9 -37.67 5.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.289 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.456 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.1 OUTLIER -64.78 -28.9 69.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.543 -179.745 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.542 ' HB2' HD13 ' A' ' 674' ' ' ILE . 1.7 m-90 -88.37 -29.46 20.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 1.065 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -79.48 -7.18 58.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.443 179.004 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.17 -44.32 9.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.506 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.79 ' O ' HG23 ' A' ' 665' ' ' VAL . 3.8 p90 -74.6 -18.83 60.51 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.691 179.736 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.767 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.9 m-85 -72.07 -29.72 64.41 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.396 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 1.012 ' HA ' HG22 ' A' ' 668' ' ' ILE . 5.8 mmt180 -66.9 -10.06 44.64 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.374 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.18 -22.24 6.69 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.44 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 661' ' ' TYR . 18.7 t -92.65 31.94 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.899 0.38 . . . . 0.0 110.391 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.33 27.17 52.57 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.577 -179.168 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.448 ' HB2' ' CD1' ' A' ' 662' ' ' TYR . 2.4 mttt -115.37 16.73 16.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.111 0.481 . . . . 0.0 110.968 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 1.012 HG22 ' HA ' ' A' ' 663' ' ' ARG . 12.9 pt -47.25 -38.46 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.0 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.17 -64.34 0.91 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.578 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.42 -23.67 50.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.382 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.767 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.8 -31.37 72.52 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -50.01 -51.12 44.43 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.806 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -58.07 -62.47 1.8 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.741 0.781 . . . . 0.0 109.895 178.998 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 1.065 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -51.96 -25.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.342 179.835 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.564 ' HA ' HD23 ' A' ' 678' ' ' LEU . 2.8 tt0 -76.14 -11.76 59.99 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.233 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.1 -10.73 40.91 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.696 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.572 ' HB ' ' HB2' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.81 -22.09 22.27 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.202 178.833 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.564 HD23 ' HA ' ' A' ' 675' ' ' GLU . 3.8 pp -65.3 -25.96 67.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.812 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 CA--C 1.532 0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 178.562 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.522 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 . . . . . 0 CA--C 1.511 -0.528 0 CA-C-O 120.815 0.34 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.787 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -74.74 20.2 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.168 0.508 . . . . 0.0 110.346 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 1.04 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -103.04 -42.58 5.75 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.07 178.781 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -48.34 77.52 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.922 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.504 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -72.45 -10.53 59.91 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.704 178.449 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.919 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -86.23 -19.51 29.87 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.319 -179.857 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.43 -20.19 48.12 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.174 -0.611 . . . . 0.0 110.62 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.848 ' O ' HG22 ' A' ' 665' ' ' VAL . 71.8 m-85 -86.73 -14.13 43.32 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.616 178.721 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.919 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -72.64 -35.01 67.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.301 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.865 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -82.09 10.91 5.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.374 179.977 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -128.03 -33.08 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.879 HG23 ' HG2' ' A' ' 667' ' ' LYS . 27.5 m -93.82 32.54 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.29 32.58 84.21 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.879 ' HG2' HG23 ' A' ' 665' ' ' VAL . 29.5 mmtm -113.15 20.57 16.15 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.017 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 663' ' ' ARG . 2.1 mp -51.57 -25.63 5.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.127 179.684 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.22 -54.49 4.18 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.657 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 670' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 8.2 mt-10 -61.11 -18.42 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 177.048 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.812 ' HB1' ' CE1' ' A' ' 662' ' ' TYR . . . -53.1 -48.96 67.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.106 179.277 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.94 -19.27 6.34 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.599 -179.719 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 673' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -82.13 -58.24 3.04 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 120.778 0.323 . . . . 0.0 111.451 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.685 HG23 ' HD2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -76.53 -3.63 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.05 179.807 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.469 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 20.5 tt0 -87.52 -26.54 23.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.856 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -80.11 -11.35 59.77 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.534 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -26.73 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.972 0.415 . . . . 0.0 110.093 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.04 HD13 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -70.04 -21.47 63.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.361 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.54 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 . . . . . 0 CA--C 1.509 -0.624 0 CA-C-O 120.82 0.343 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.722 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -77.07 26.5 0.15 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.538 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.931 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.81 -42.5 4.24 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.329 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -63.59 -38.87 92.78 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.141 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.508 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -83.39 -14.54 52.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.703 178.465 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.877 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -83.98 -21.33 31.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -76.27 -20.5 57.3 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.95 179.441 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.851 ' O ' HG22 ' A' ' 665' ' ' VAL . 19.7 m-85 -84.89 -11.4 55.68 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.367 179.557 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.877 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.38 -34.9 41.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.139 179.386 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.831 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -81.83 9.51 7.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.372 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.81 -32.13 3.1 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.851 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.851 HG22 ' O ' ' A' ' 661' ' ' TYR . 35.0 m -96.89 35.37 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.961 0.41 . . . . 0.0 110.536 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.84 31.79 72.9 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.498 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.697 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -106.39 16.62 24.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.907 0.384 . . . . 0.0 111.45 -179.637 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.793 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -52.13 -24.12 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.991 -179.602 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -85.73 -59.48 2.3 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 670' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 0.3 OUTLIER -59.59 -19.3 47.82 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.156 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.736 ' HB1' ' CE1' ' A' ' 662' ' ' TYR . . . -51.26 -47.63 62.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.886 178.939 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -53.54 -19.43 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.393 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 673' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -79.13 -61.15 2.1 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.638 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -76.82 -5.01 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.986 179.731 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.471 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 68.4 tt0 -86.05 -25.36 25.94 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.632 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 4.7 mtpt -74.36 -19.47 60.43 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.787 179.4 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.05 -16.67 52.6 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.333 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.931 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -60.31 -39.51 87.26 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.966 178.868 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.781 179.826 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.458 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.343 0 CA-C-O 120.981 0.42 . . . . 0.0 111.214 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.613 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -126.04 20.82 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.629 0.728 . . . . 0.0 109.886 179.127 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.438 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -115.17 -37.43 4.1 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.16 178.732 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.519 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.0 OUTLIER -74.41 -36.84 63.47 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.401 -179.825 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.519 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 2.7 m-90 -83.63 -21.32 32.55 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.989 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.813 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -71.87 -22.2 61.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.796 -179.583 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -80.69 -13.86 58.64 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.165 179.231 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.862 ' O ' HG22 ' A' ' 665' ' ' VAL . 91.1 m-85 -91.95 -14.31 29.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.422 178.833 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.825 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -74.65 -37.16 62.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.114 179.6 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.825 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.03 11.23 5.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.481 179.996 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 t -127.05 -34.96 2.29 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.862 HG22 ' O ' ' A' ' 661' ' ' TYR . 33.8 m -95.56 34.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.926 0.393 . . . . 0.0 110.473 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.17 31.9 74.63 Favored Glycine 0 CA--C 1.507 -0.447 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.527 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.643 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.29 18.75 21.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 111.37 179.957 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 9.6 tt -50.14 -27.07 3.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -86.51 -51.64 6.06 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 670' ' ' GLU . . . . . 0.537 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 0.0 OUTLIER -62.57 -18.6 62.42 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 177.207 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.723 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -53.21 -47.98 68.48 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.059 179.126 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -52.52 -19.83 2.53 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.912 179.827 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 673' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -75.28 -67.26 0.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.832 0.348 . . . . 0.0 111.553 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.696 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -71.81 -13.0 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 22.4 tt0 -79.28 -27.36 42.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.05 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.55 -8.27 59.61 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.691 179.029 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.475 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.86 -23.12 33.81 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 178.017 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.438 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -52.51 -34.05 47.81 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.613 179.052 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.256 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.372 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.465 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.1 p90 . . . . . 0 CA--C 1.513 -0.469 0 CA-C-O 120.76 0.314 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.702 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.52 26.61 0.29 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.177 179.162 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.499 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -112.13 -46.22 3.22 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.038 178.705 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.05 -38.79 86.46 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.938 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.464 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -86.97 5.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.937 178.553 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.909 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -104.29 -19.11 14.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.91 178.638 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -77.35 -22.0 52.44 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.378 178.836 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.863 ' O ' HG22 ' A' ' 665' ' ' VAL . 66.9 m-85 -82.72 -13.75 55.8 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.236 179.304 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.909 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -75.92 -37.23 58.96 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.363 179.49 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.865 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.54 10.74 6.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.609 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.12 -32.73 2.96 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.863 HG22 ' O ' ' A' ' 661' ' ' TYR . 34.7 m -97.99 36.08 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.984 0.421 . . . . 0.0 110.416 179.688 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.05 31.5 72.93 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.561 -179.374 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -106.97 17.87 22.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.891 0.377 . . . . 0.0 111.487 -179.783 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.47 -29.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.395 -179.88 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -83.34 -51.36 7.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 670' ' ' GLU . . . . . 0.41 ' HB3' ' HG2' ' A' ' 667' ' ' LYS . 8.4 tt0 -63.0 -18.41 63.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.63 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.696 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -55.47 -43.77 75.83 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.736 178.92 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -47.35 -31.83 4.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.48 -179.711 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -76.38 -51.94 10.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 111.16 179.537 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.734 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -72.82 -18.28 18.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.62 -179.035 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 671' ' ' ALA . 0.7 OUTLIER -86.03 -21.16 27.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 110.309 178.913 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -79.55 -16.0 56.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.85 179.516 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.432 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.56 -3.28 58.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.991 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 656' ' ' ALA . 1.1 tt -80.18 -24.26 40.45 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.487 179.182 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.348 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.625 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.497 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 . . . . . 0 CA--C 1.511 -0.54 0 CA-C-O 120.821 0.344 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.803 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -76.67 19.85 0.26 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.237 0.542 . . . . 0.0 110.329 178.978 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -100.35 -44.34 5.95 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.025 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -64.93 -39.75 93.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.592 ' C ' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -85.75 8.95 17.93 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.795 178.365 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.903 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -104.46 -25.29 12.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.836 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -73.74 -16.86 61.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.211 178.573 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.837 ' O ' HG22 ' A' ' 665' ' ' VAL . 20.1 m-30 -85.21 -17.41 37.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.017 179.123 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.903 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -71.84 -36.6 70.22 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.264 -0.575 . . . . 0.0 110.588 179.606 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.84 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 2.8 ptt180 -77.84 5.28 9.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.48 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 91.6 p -128.67 -30.97 2.26 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.847 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 661' ' ' TYR . 18.6 m -94.29 33.59 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.888 0.375 . . . . 0.0 110.517 179.602 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.56 32.14 72.64 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.788 -179.337 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.699 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 2.6 ttpt -112.13 19.13 18.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.907 0.384 . . . . 0.0 111.295 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.458 ' O ' HD12 ' A' ' 668' ' ' ILE . 2.3 tp -51.5 -32.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -82.48 -50.02 9.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.059 179.466 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 670' ' ' GLU . . . . . 0.416 ' HB2' ' HG2' ' A' ' 667' ' ' LYS . 0.3 OUTLIER -64.48 -17.07 63.52 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 177.295 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.749 ' HA ' HG23 ' A' ' 674' ' ' ILE . . . -54.88 -44.99 74.59 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.672 179.018 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -45.79 -35.73 4.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.622 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.76 15.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.549 0.69 . . . . 0.0 110.904 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 671' ' ' ALA . 0.1 OUTLIER -71.92 -10.92 14.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.675 -179.253 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.587 ' OE2' HD21 ' A' ' 678' ' ' LEU . 2.0 tm-20 -94.91 -13.44 25.41 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.746 0.308 . . . . 0.0 110.648 178.76 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.83 -8.42 40.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.777 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.423 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -87.67 -27.27 22.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.32 179.332 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.587 HD21 ' OE2' ' A' ' 675' ' ' GLU . 3.7 pp -70.25 -20.51 63.06 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.009 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 13.5 mttm . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.934 0.397 . . . . 0.0 110.636 179.752 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.49 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.8 p90 . . . . . 0 CA--C 1.51 -0.57 0 CA-C-O 120.799 0.333 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.562 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -78.98 26.09 0.26 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.791 178.899 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.661 ' HB2' ' CD2' ' A' ' 678' ' ' LEU . . . -108.87 -41.21 4.81 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.643 178.461 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.476 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 2.8 tt0 -60.94 -49.46 77.38 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.802 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.587 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -73.0 -5.24 37.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.181 177.531 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.716 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . . . -106.72 9.36 31.18 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.497 178.467 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -109.9 -34.24 6.49 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.643 178.375 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 658' ' ' TRP . 20.9 p90 -100.6 13.0 36.17 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.025 177.573 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.969 ' CZ ' ' HB1' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -102.98 -26.21 13.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.757 177.996 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.775 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -81.69 -0.56 43.31 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.715 178.924 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 t -124.31 -19.56 5.47 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.604 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.59 HG22 ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -93.65 28.51 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 111.343 179.957 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 78.5 10.23 86.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.922 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.682 ' O ' ' HB2' ' A' ' 671' ' ' ALA . 5.0 mmmt -105.32 20.75 18.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.003 0.401 . . . . 0.0 110.814 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' A' ' 671' ' ' ALA . 2.3 tp -55.99 -39.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.01 -179.627 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -75.18 -56.92 4.24 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.628 -0.429 . . . . 0.0 109.902 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.08 -16.43 59.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.788 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.969 ' HB1' ' CZ ' ' A' ' 662' ' ' TYR . . . -60.33 -41.25 93.14 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.125 179.253 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -49.49 -25.34 2.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.404 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -72.62 -62.39 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.766 HG23 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -70.03 -7.1 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.909 179.494 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 5.1 tm-20 -75.83 -32.24 59.72 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.482 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -75.1 -4.13 36.78 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.69 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.562 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.7 OUTLIER -96.21 -13.34 23.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.552 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.702 ' O ' HD22 ' A' ' 678' ' ' LEU . 1.2 tm? -75.68 -26.58 57.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.27 179.379 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? . . . . . 0 C--O 1.232 0.169 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.016 179.99 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.483 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.625 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.3 OUTLIER -94.8 26.24 3.66 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 121.147 0.498 . . . . 0.0 110.254 178.937 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . . . -110.17 -38.57 5.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.536 178.817 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.436 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 7.9 tt0 -67.13 -39.11 86.55 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.677 -179.556 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.436 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 3.6 m-90 -84.6 -20.64 31.1 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.727 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -74.31 -35.59 63.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -179.425 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -76.31 -3.67 38.0 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.837 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 1.017 ' O ' HG23 ' A' ' 665' ' ' VAL . 21.8 m-85 -94.98 -34.94 12.17 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.656 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.79 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.3 OUTLIER -56.18 -39.26 72.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.655 179.196 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.79 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 3.1 ptm85 -62.09 -8.2 5.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.689 -179.557 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.97 -18.58 1.81 Allowed 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.849 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 1.017 HG23 ' O ' ' A' ' 661' ' ' TYR . 7.5 t -89.76 19.19 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.606 0.241 . . . . 0.0 110.469 179.181 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.52 29.22 74.44 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.504 -0.855 . . . . 0.0 111.199 -178.763 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.715 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.7 OUTLIER -114.8 14.46 17.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 179.582 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.76 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -49.03 -25.81 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.031 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -86.39 -56.91 3.22 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.662 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 670' ' ' GLU . . . . . 0.507 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 1.1 tp10 -62.24 -15.99 50.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 176.612 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.731 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -50.48 -47.03 57.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.678 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -51.16 -21.67 2.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.986 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 673' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -74.89 -67.55 0.63 Allowed 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.027 0.442 . . . . 0.0 111.456 179.47 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -67.84 -13.16 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -80.4 -24.21 39.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.258 178.502 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -82.05 -15.77 52.41 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.586 179.943 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.505 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.93 -16.39 47.56 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.925 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.446 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -55.88 -33.8 64.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.284 178.137 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.235 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.316 178.754 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 654' ' ' TYR . . . . . 0.488 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 655' ' ' SER . . . . . 0.587 ' OG ' HG12 ' A' ' 674' ' ' ILE . 0.4 OUTLIER -96.55 24.49 5.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.145 178.958 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 656' ' ' ALA . . . . . 0.538 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.16 -41.96 4.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.771 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 657' ' ' GLN . . . . . 0.47 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.7 OUTLIER -66.25 -31.21 71.89 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.221 -179.944 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 658' ' ' TRP . . . . . 0.587 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 1.7 m-90 -87.14 -20.07 27.57 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 177.462 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 659' ' ' ALA . . . . . 0.756 ' O ' ' CE1' ' A' ' 662' ' ' TYR . . . -89.93 5.42 46.5 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.317 179.527 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.35 -12.2 13.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.99 178.273 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 661' ' ' TYR . . . . . 0.611 ' O ' HG22 ' A' ' 665' ' ' VAL . 1.6 p90 -111.72 1.11 16.53 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.725 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 662' ' ' TYR . . . . . 0.853 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -95.64 -27.04 15.5 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.36 179.334 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 663' ' ' ARG . . . . . 0.853 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 19.4 mtp180 -81.54 -1.41 46.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.563 178.847 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.6 m -119.9 -26.0 5.71 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.755 -179.52 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 665' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 661' ' ' TYR . 24.1 m -92.73 31.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 67.0 23.52 72.86 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.318 -179.728 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 671' ' ' ALA . 0.4 OUTLIER -107.83 15.59 24.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.773 0.32 . . . . 0.0 111.261 179.665 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 668' ' ' ILE . . . . . 0.411 HG13 ' HA ' ' A' ' 663' ' ' ARG . 2.8 mt -51.5 -32.26 13.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.197 -179.618 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -79.89 -59.67 2.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.223 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -61.9 -16.41 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.592 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 671' ' ' ALA . . . . . 0.826 ' HB1' ' CZ ' ' A' ' 662' ' ' TYR . . . -58.87 -40.88 85.66 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.034 179.158 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -48.87 -23.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.616 -0.433 . . . . 0.0 111.194 179.308 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -70.8 -68.35 0.44 Allowed 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 674' ' ' ILE . . . . . 0.696 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -68.0 -8.81 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.503 -0.479 . . . . 0.0 109.834 179.93 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 675' ' ' GLU . . . . . 0.455 ' HB2' ' OH ' ' A' ' 662' ' ' TYR . 16.5 tm-20 -77.0 -29.89 55.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.05 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -9.32 58.69 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.398 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 677' ' ' THR . . . . . 0.486 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -91.06 -15.94 28.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.87 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.538 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.6 OUTLIER -59.53 -33.55 71.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.277 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt . . . . . 0 CA--C 1.531 0.23 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.551 178.859 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.489 -0.245 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 652' ' ' ALA . . . . . 0.448 ' HB3' ' CB ' ' A' ' 680' ' ' ASN . . . -69.47 -79.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.898 0.38 . . . . 0.0 111.112 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.516 ' OD1' HD13 ' A' ' 678' ' ' LEU . 21.1 t70 63.32 100.57 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.765 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.477 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 -133.32 -53.71 0.9 Allowed 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.163 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.4 OUTLIER -76.15 19.21 0.24 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.636 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.765 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -104.18 -42.05 5.63 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -58.83 -38.9 79.7 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.571 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.57 -35.94 60.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.8 179.086 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.667 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -71.05 -16.04 62.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.567 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.02 -37.97 69.66 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.257 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.702 ' O ' HG23 ' A' ' 665' ' ' VAL . 32.1 m-85 -62.65 -46.07 89.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.888 0.375 . . . . 0.0 110.753 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.786 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 10.0 m-85 -54.86 -28.83 53.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.601 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 7.3 mmt85 -63.24 -20.08 65.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.877 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.03 -15.6 9.25 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 661' ' ' TYR . 20.4 t -91.71 25.83 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.858 0.361 . . . . 0.0 110.341 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.88 65.28 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.72 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.478 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 3.0 mttt -124.36 16.24 9.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.94 0.4 . . . . 0.0 110.825 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.604 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.16 -31.58 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.214 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -60.04 2.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.931 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -22.64 57.3 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.786 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.62 -32.27 72.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.352 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -52.44 -36.12 53.87 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.943 0.402 . . . . 0.0 110.489 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.56 -67.95 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.317 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.767 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -59.6 -17.58 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.712 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.563 ' O ' HD23 ' A' ' 678' ' ' LEU . 72.7 tt0 -78.79 -26.13 44.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.368 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -71.6 -19.14 62.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.309 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.431 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -76.21 -23.47 54.61 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.729 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.765 HD22 ' HB2' ' A' ' 656' ' ' ALA . 0.9 OUTLIER -68.36 -28.49 67.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.126 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -48.53 92.46 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.102 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.448 ' CB ' ' HB3' ' A' ' 652' ' ' ALA . 2.6 t30 -122.06 52.37 1.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.801 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -104.39 -41.75 5.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.88 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.8 -57.29 10.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.863 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.1 0 N-CA-C 112.547 -0.221 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 652' ' ' ALA . . . . . 0.423 ' HB1' ' HB3' ' A' ' 680' ' ' ASN . . . 66.42 103.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.976 0.417 . . . . 0.0 111.006 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.471 ' HA ' ' CD2' ' A' ' 678' ' ' LEU . 5.0 p-10 -153.97 92.6 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.545 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.478 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 -116.53 -53.24 2.53 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.578 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.608 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.7 OUTLIER -77.26 23.46 0.2 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.34 0.591 . . . . 0.0 110.685 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.634 ' HB2' ' CD2' ' A' ' 678' ' ' LEU . . . -108.38 -37.1 6.07 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.875 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.457 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -63.0 -34.32 77.31 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.993 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.498 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . 2.4 m-90 -84.04 -35.43 23.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.5 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -67.16 -18.78 65.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.84 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -70.56 -43.79 68.75 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-O 121.001 0.429 . . . . 0.0 110.749 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.586 ' O ' HG22 ' A' ' 665' ' ' VAL . 71.8 m-85 -62.64 -48.89 77.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.818 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 13.8 m-85 -54.18 -37.61 64.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.675 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.787 ' HG3' HG23 ' A' ' 668' ' ' ILE . 1.1 mpt_? -68.98 -9.73 53.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.684 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 4.2 m -122.04 -22.86 5.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 661' ' ' TYR . 35.6 m -93.44 31.65 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.85 0.357 . . . . 0.0 110.715 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.11 65.41 Favored Glycine 0 CA--C 1.506 -0.505 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.037 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.581 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -120.04 19.64 12.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.201 0.524 . . . . 0.0 110.444 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.787 HG23 ' HG3' ' A' ' 663' ' ' ARG . 1.4 mp -47.83 -32.01 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.611 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -70.28 -60.75 2.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.308 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.14 -22.19 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.136 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.818 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.9 -37.85 86.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.207 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.09 -30.89 7.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.825 0.345 . . . . 0.0 110.476 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.78 -69.81 0.28 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.185 0.517 . . . . 0.0 110.484 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.638 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -62.2 -17.51 18.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.27 179.471 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -76.2 -28.96 57.45 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -73.13 -9.97 59.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.147 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.542 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.2 OUTLIER -91.26 -9.51 44.9 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.934 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.716 HD13 ' O ' ' A' ' 678' ' ' LEU . 3.4 tm? -73.03 -29.91 63.35 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.428 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.7 tptp -59.92 76.84 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.876 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.494 ' N ' ' O ' ' A' ' 678' ' ' LEU . 8.8 t-20 -105.5 88.77 2.92 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -148.72 31.62 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -111.39 108.33 17.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 48.9 t30 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.937 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -127.44 -44.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.46 100.12 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.779 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.505 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.8 p90 -126.16 -54.43 1.49 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.154 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.632 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -75.26 21.22 0.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.705 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.92 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -105.93 -42.29 5.17 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.12 -37.3 82.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.592 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.55 -36.52 63.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.825 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.818 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -71.16 -13.05 61.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.663 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.38 -38.04 63.26 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.956 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.864 ' O ' HG23 ' A' ' 665' ' ' VAL . 35.5 m-85 -65.38 -50.52 65.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.859 0.361 . . . . 0.0 110.372 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.815 ' CE2' HG21 ' A' ' 674' ' ' ILE . 16.3 m-85 -52.87 -32.91 47.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.32 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.959 ' HA ' HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -66.29 -12.06 54.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.297 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 5.1 p -134.91 20.04 3.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.826 0.346 . . . . 0.0 111.62 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.864 HG23 ' O ' ' A' ' 661' ' ' TYR . 22.0 t -128.56 22.81 2.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.808 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.71 24.69 72.79 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.493 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.426 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -124.15 15.7 9.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.232 0.539 . . . . 0.0 110.643 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.959 HG22 ' HA ' ' A' ' 663' ' ' ARG . 10.0 pt -45.59 -33.81 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.559 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -67.98 -61.95 1.63 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.307 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 670' ' ' GLU . . . . . 0.4 ' HB3' ' CG ' ' A' ' 667' ' ' LYS . 3.0 tm-20 -58.37 -22.35 53.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.809 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -63.94 -35.73 81.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.476 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.07 -39.55 59.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.837 0.351 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.87 -63.2 1.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.416 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.818 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -61.8 -13.79 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.805 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.549 ' HG2' HD23 ' A' ' 678' ' ' LEU . 2.4 tm-20 -82.35 -27.89 31.9 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 110.486 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -76.74 -10.33 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.632 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -80.2 -25.14 39.81 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.008 178.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.92 HD22 ' HB2' ' A' ' 656' ' ' ALA . 2.4 pp -60.91 -27.95 68.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.717 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -59.57 82.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.559 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.437 ' N ' ' O ' ' A' ' 678' ' ' LEU . 0.4 OUTLIER -68.56 -67.71 0.45 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.064 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.64 159.92 19.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 47.1 mm-40 59.9 168.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.799 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 17.3 t30 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.979 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.75 -78.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.839 0.352 . . . . 0.0 111.061 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.718 ' OD2' ' HB3' ' A' ' 656' ' ' ALA . 13.9 t70 64.23 100.87 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.843 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.485 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.6 p90 -126.76 -49.61 1.49 Allowed 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.189 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.608 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -77.75 25.63 0.2 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.543 0.687 . . . . 0.0 110.32 179.297 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.718 ' HB3' ' OD2' ' A' ' 653' ' ' ASP . . . -109.19 -36.63 5.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.442 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 6.6 tt0 -63.22 -29.81 71.07 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.643 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.518 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -87.47 -35.09 18.43 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.73 ' HB2' HG23 ' A' ' 674' ' ' ILE . . . -77.06 -8.63 57.78 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.098 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -88.11 -47.59 8.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.285 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.1 p90 -72.84 -21.95 60.87 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.199 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.783 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.2 m-85 -67.44 -32.72 73.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.829 ' HG3' HG23 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -67.4 -8.16 30.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.0 m -116.38 -22.73 8.65 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.527 HG23 ' HG3' ' A' ' 667' ' ' LYS . 31.2 m -96.44 35.42 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.982 0.42 . . . . 0.0 110.398 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.03 23.2 56.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.777 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.527 ' HG3' HG23 ' A' ' 665' ' ' VAL . 0.6 OUTLIER -111.87 19.0 18.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.001 0.429 . . . . 0.0 110.656 179.636 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.829 HG23 ' HG3' ' A' ' 663' ' ' ARG . 3.3 mt -49.21 -42.02 14.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.941 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -68.22 -54.74 15.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.471 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -23.25 66.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.433 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.783 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -65.23 -43.04 92.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.426 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -47.87 -35.22 10.03 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.745 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.74 -67.74 0.4 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.317 0.58 . . . . 0.0 110.3 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.73 HG23 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -55.0 -31.52 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.924 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.485 ' CD ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -60.31 -32.69 71.46 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.949 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.16 -23.19 67.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.626 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.418 ' O ' ' CZ ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -80.9 -16.7 52.9 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.386 179.146 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.669 HD12 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -75.12 -23.29 57.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.1 mttp -67.17 66.84 0.07 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.461 ' N ' ' O ' ' A' ' 678' ' ' LEU . 29.1 t-20 -65.77 131.54 46.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -164.7 155.0 14.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.829 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -126.5 -178.68 4.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 1.2 t30 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.892 179.955 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.146 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -147.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.897 0.38 . . . . 0.0 111.106 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.43 102.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.652 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.456 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.4 p90 -134.42 -50.58 0.8 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.287 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.645 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -75.96 17.33 0.34 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.938 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.589 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -102.61 -45.24 5.1 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.6 -36.67 79.12 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.517 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.74 -30.58 59.25 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.972 179.164 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.632 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -80.48 -4.91 55.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.848 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.68 -38.08 26.4 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.771 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -66.86 -26.67 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.754 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.774 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.7 m-85 -66.62 -37.35 84.67 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.072 0.463 . . . . 0.0 110.12 179.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -64.57 -11.12 31.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.795 -179.782 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.69 -26.34 11.37 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 665' ' ' VAL . 19.6 t -96.28 35.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.037 0.446 . . . . 0.0 110.288 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.81 28.32 57.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.536 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HD3' ' CD1' ' A' ' 662' ' ' TYR . 12.2 mttm -116.59 18.09 15.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 111.14 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.588 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -49.71 -30.05 5.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.71 -56.76 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.09 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.05 -23.34 65.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.002 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.774 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.47 -40.82 95.89 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.174 179.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.52 -33.19 3.86 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.726 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.07 -68.29 0.37 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.481 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.679 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -59.72 -19.1 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.472 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.647 ' O ' HD23 ' A' ' 678' ' ' LEU . 1.4 tt0 -72.91 -30.02 63.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -23.57 67.48 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.271 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.441 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.22 -15.22 59.57 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.695 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.647 HD23 ' O ' ' A' ' 675' ' ' GLU . 0.5 OUTLIER -76.25 -23.78 54.52 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.54 -32.03 0.51 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.875 0.369 . . . . 0.0 111.199 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 47.74 83.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.287 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -163.83 -69.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.98 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -106.85 162.77 13.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.945 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.865 179.966 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -148.15 -61.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.995 0.426 . . . . 0.0 111.186 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.76 101.59 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.629 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -175.71 34.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.059 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.74 ' HA ' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -127.14 18.08 7.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.495 0.664 . . . . 0.0 110.559 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.03 -35.58 4.05 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.3 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.543 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.6 tt0 -76.53 -12.38 60.02 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.279 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.543 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 1.6 m-90 -106.03 -31.88 8.54 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.804 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -79.83 -15.06 58.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.294 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.419 ' HG3' ' CD1' ' A' ' 661' ' ' TYR . 11.4 pt-20 -78.81 -34.18 45.56 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 120.723 0.297 . . . . 0.0 110.857 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.792 ' O ' HG23 ' A' ' 665' ' ' VAL . 45.9 m-85 -70.85 -47.05 61.45 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.56 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.915 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 21.9 m-85 -60.43 -35.33 75.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.194 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.821 ' HA ' HG22 ' A' ' 668' ' ' ILE . 0.1 OUTLIER -65.8 -13.8 60.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.342 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 36.3 p -118.86 -20.82 8.04 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 661' ' ' TYR . 20.2 t -93.83 32.19 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.45 24.43 56.12 Favored Glycine 0 CA--C 1.507 -0.462 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.847 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.476 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 2.3 mmpt? -116.67 19.37 14.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.072 0.463 . . . . 0.0 110.346 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.821 HG22 ' HA ' ' A' ' 663' ' ' ARG . 15.3 pt -44.16 -33.21 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.14 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -67.76 -59.92 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.168 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.33 -25.94 60.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.116 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.915 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -59.33 -38.89 81.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.13 179.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.73 -32.14 5.52 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.445 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -69.73 0.27 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.339 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.804 HD12 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -57.06 -23.51 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.029 179.364 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.41 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 1.4 mm-40 -64.88 -29.55 70.5 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.1 mtpt -69.41 -15.88 63.38 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.926 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.467 ' HB ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -73.54 -21.02 60.49 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.317 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -54.03 -29.54 44.17 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.72 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -77.14 7.92 4.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.116 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -45.62 -29.74 1.31 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.818 0.342 . . . . 0.0 111.305 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -57.83 102.03 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.961 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 61.25 100.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 41.4 t30 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.901 -179.94 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.424 -0.271 . . . . 0.0 112.424 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . 64.03 102.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 656' ' ' ALA . 1.3 m-20 -151.33 92.04 1.74 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.335 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.414 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 4.5 p90 -103.45 -46.11 4.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.08 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.552 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.6 OUTLIER -84.91 23.51 1.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.073 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.645 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -112.0 -38.15 4.88 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.097 178.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.455 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.8 tt0 -65.84 -26.9 67.87 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.542 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -90.18 -35.75 15.19 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.91 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.51 -2.77 47.45 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.335 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -94.22 -42.59 8.87 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.081 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.752 ' O ' HG23 ' A' ' 665' ' ' VAL . 4.1 p90 -76.62 -15.35 59.85 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.393 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.756 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 8.6 m-85 -73.79 -30.2 62.62 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.459 ' HD2' HG13 ' A' ' 668' ' ' ILE . 6.4 mmt85 -69.94 -9.08 53.8 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.575 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 16.2 m -126.46 14.44 7.66 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.752 HG23 ' O ' ' A' ' 661' ' ' TYR . 26.0 t -132.57 34.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.221 0.534 . . . . 0.0 109.714 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.85 26.03 64.71 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.625 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.442 ' HD3' ' CE1' ' A' ' 662' ' ' TYR . 14.0 mttp -122.42 16.05 10.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 111.315 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.459 HG13 ' HD2' ' A' ' 663' ' ' ARG . 5.0 tt -51.0 -36.03 15.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -75.76 -45.97 33.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.475 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.73 -25.99 66.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.231 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.756 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -63.18 -33.22 75.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.331 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -51.96 -35.53 46.5 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.552 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.22 -67.47 0.42 Allowed 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.794 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.91 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.7 OUTLIER -59.8 -19.14 16.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.487 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.819 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 1.0 OUTLIER -65.31 -33.78 76.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.596 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -17.55 64.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.323 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.552 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.23 -11.37 57.87 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.645 ' CD1' ' HB2' ' A' ' 656' ' ' ALA . 21.8 tp -65.72 -30.95 71.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.337 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.4 80.39 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.548 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 678' ' ' LEU . 10.0 p30 -96.68 22.95 7.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.148 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 -38.65 0.78 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.257 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.92 166.0 13.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.913 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.889 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -155.4 -68.65 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.989 0.424 . . . . 0.0 111.096 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 60.18 97.86 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.899 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.646 ' HE2' ' HB2' ' A' ' 680' ' ' ASN . 1.1 p90 -131.1 -56.75 1.03 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.759 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.413 ' OG ' ' CD2' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -85.22 20.43 1.96 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.114 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -114.23 -37.44 4.39 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.088 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.491 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.3 tt0 -66.8 -26.58 67.01 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.149 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.647 ' HB2' HD13 ' A' ' 674' ' ' ILE . 2.0 m-90 -90.53 -31.59 16.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 1.026 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.61 -6.49 58.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.847 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.25 -37.28 11.61 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.598 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.522 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.7 p90 -79.71 -17.41 53.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.449 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.781 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 6.7 m-85 -73.32 -29.45 62.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.979 0.419 . . . . 0.0 109.909 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm-85 -69.32 -9.93 55.56 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.412 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 6.2 t -116.67 -23.43 8.18 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.71 HG23 ' HB2' ' A' ' 667' ' ' LYS . 29.9 m -94.4 33.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.002 0.43 . . . . 0.0 110.353 179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 55.48 29.29 53.22 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.608 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.71 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -119.41 17.62 12.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.134 0.492 . . . . 0.0 111.185 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 4.8 tt -50.0 -30.57 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.643 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.43 -61.42 1.79 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.532 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -58.27 -24.49 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.813 0.339 . . . . 0.0 110.124 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.781 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -62.33 -29.15 70.24 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.944 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -51.32 -49.88 60.5 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.04 -65.01 0.67 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.852 0.835 . . . . 0.0 109.838 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 1.026 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -50.49 -28.88 5.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.026 -1.443 . . . . 0.0 110.776 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.51 ' CG ' ' HB1' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -71.44 -24.99 62.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.523 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -81.24 -14.98 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.874 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 680' ' ' ASN . 0.0 OUTLIER -76.15 -26.65 56.48 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.35 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 678' ' ' LEU . 12.3 tp -51.57 -29.82 18.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.999 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -68.08 -7.61 30.95 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.456 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.646 ' HB2' ' HE2' ' A' ' 654' ' ' TYR . 1.2 m-20 -46.36 -29.25 1.6 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.726 0.298 . . . . 0.0 111.251 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.32 166.26 23.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.796 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.4 140.38 33.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.944 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.873 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 651' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 652' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 652' ' ' ALA . . . . . 0.786 ' HB3' ' ND2' ' A' ' 680' ' ' ASN . . . 175.0 105.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 0.0 110.833 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.667 ' OD2' HD21 ' A' ' 678' ' ' LEU . 0.6 OUTLIER -121.82 79.05 1.52 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.404 0.621 . . . . 0.0 110.327 179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.429 ' C ' ' H ' ' A' ' 656' ' ' ALA . 7.3 p90 -79.0 -47.25 16.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.621 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.564 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -79.52 22.23 0.46 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.794 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -109.43 -44.36 3.91 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.024 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -61.97 -27.02 68.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.539 ' HB3' ' CD1' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -91.2 -22.84 20.43 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.085 179.214 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.791 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -89.05 -6.09 57.39 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.6 -35.51 27.01 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.895 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.2 OUTLIER -70.99 -30.05 66.19 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.685 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.799 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.8 m-85 -63.18 -34.56 77.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.237 0.541 . . . . 0.0 109.969 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.822 ' HG3' HG23 ' A' ' 668' ' ' ILE . 0.7 OUTLIER -72.57 -1.95 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.71 -27.03 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 665' ' ' VAL . 13.2 p -97.95 35.91 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.041 0.448 . . . . 0.0 110.486 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.23 27.05 66.87 Favored Glycine 0 CA--C 1.508 -0.365 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.209 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.588 ' HD2' HG13 ' A' ' 665' ' ' VAL . 3.6 mttt -114.67 20.97 14.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.074 0.464 . . . . 0.0 110.696 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.822 HG23 ' HG3' ' A' ' 663' ' ' ARG . 5.5 mt -48.26 -32.33 3.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.371 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -39.42 28.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.495 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -25.49 62.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.799 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.53 -33.41 75.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.177 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -51.21 -31.68 21.28 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.477 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.91 -69.78 0.27 Allowed 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.437 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.791 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -58.77 -21.99 20.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.558 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -67.85 -24.67 65.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.074 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -17.6 64.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.298 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.564 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.4 OUTLIER -89.93 -1.7 58.02 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.839 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.837 HD23 ' O ' ' A' ' 678' ' ' LEU . 6.1 tt -79.72 -30.2 40.89 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.583 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.95 -44.2 0.49 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.281 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.786 ' ND2' ' HB3' ' A' ' 652' ' ' ALA . 64.1 t-20 38.14 52.06 1.56 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.752 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.67 171.47 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.013 0.435 . . . . 0.0 110.981 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -157.96 128.27 6.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 35.6 m120 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.883 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 651' ' ' GLY . . . . . 0.4 ' O ' ' HB3' ' A' ' 652' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 652' ' ' ALA . . . . . 0.46 ' HB1' ' CB ' ' A' ' 680' ' ' ASN . . . 67.25 103.68 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.044 0.45 . . . . 0.0 111.018 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.434 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . 8.3 p-10 -154.57 92.67 1.51 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.415 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.431 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.5 p90 -114.45 -46.01 2.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.545 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -80.07 23.73 0.45 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.119 0.485 . . . . 0.0 110.607 179.317 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.731 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -109.79 -44.52 3.81 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -63.26 -35.94 82.02 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.711 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -77.46 -35.22 54.05 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.52 178.74 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.867 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -71.32 -13.81 62.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.553 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.59 -38.72 54.41 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -64.53 -41.85 96.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.835 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 15.5 m-85 -57.78 -28.1 63.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.888 ' HD2' HG23 ' A' ' 668' ' ' ILE . 0.5 OUTLIER -71.44 -8.72 55.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.358 179.666 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 p -121.7 -23.76 5.46 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.651 HG23 ' CG ' ' A' ' 667' ' ' LYS . 29.7 m -92.78 31.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.831 0.348 . . . . 0.0 110.741 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.76 29.44 67.33 Favored Glycine 0 CA--C 1.506 -0.508 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.092 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.651 ' CG ' HG23 ' A' ' 665' ' ' VAL . 6.4 mmtt -119.82 18.35 12.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.1 0.476 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.888 HG23 ' HD2' ' A' ' 663' ' ' ARG . 2.2 mt -46.66 -32.75 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.564 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.5 -47.96 18.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.359 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -65.59 -24.12 67.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.165 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.835 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -62.72 -38.03 88.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.451 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -51.01 -32.07 20.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.939 0.4 . . . . 0.0 110.497 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.93 -69.26 0.31 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.542 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.867 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -57.67 -24.46 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.661 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.699 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 6.2 mt-10 -63.36 -25.38 68.27 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.699 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -5.45 44.86 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.384 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.419 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -93.25 -15.14 26.19 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.731 HD13 ' HB2' ' A' ' 656' ' ' ALA . 19.1 tp -64.64 -31.78 73.14 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.817 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -67.6 66.86 0.09 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.497 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.46 ' CB ' ' HB1' ' A' ' 652' ' ' ALA . 9.4 t-20 -57.28 128.78 38.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.07 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -122.45 -68.98 0.85 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 61.57 96.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 3.5 t30 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.903 179.98 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 112.398 -0.281 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -80.39 -50.54 9.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.996 0.427 . . . . 0.0 111.139 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.74 99.19 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.436 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 -134.03 -43.78 0.8 Allowed 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.307 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.488 ' OG ' ' C ' ' A' ' 677' ' ' THR . 0.3 OUTLIER -80.16 24.69 0.41 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.411 0.624 . . . . 0.0 110.719 179.752 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.436 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -110.78 -39.36 4.87 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.194 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.2 OUTLIER -68.34 -22.14 64.7 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.771 -179.778 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.572 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.1 m-90 -93.78 -36.41 12.29 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.624 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -77.79 -7.5 56.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.159 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -90.06 -46.3 8.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.15 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.572 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.4 p90 -73.88 -21.77 59.97 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.031 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.795 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.9 m-85 -66.88 -32.61 73.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.429 ' HG3' HG13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -71.93 -4.27 27.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.634 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.3 18.54 4.88 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 665' ' ' VAL . 14.8 p -136.74 32.88 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.043 0.449 . . . . 0.0 109.82 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.73 26.14 66.5 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.542 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.598 ' HB2' HG13 ' A' ' 665' ' ' VAL . 2.1 tptt -123.71 17.47 9.51 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.112 0.482 . . . . 0.0 111.18 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.429 HG13 ' HG3' ' A' ' 663' ' ' ARG . 4.8 tt -52.25 -35.35 19.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.569 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.5 -48.73 30.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.494 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -24.71 67.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.146 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.795 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.26 -37.83 88.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.49 -33.76 32.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.996 0.427 . . . . 0.0 110.534 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.12 -67.58 0.43 Allowed 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.714 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.656 HG21 ' HE2' ' A' ' 662' ' ' TYR . 0.6 OUTLIER -58.34 -22.8 20.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.275 179.546 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.512 ' CG ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -61.69 -34.24 75.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.988 178.868 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -74.3 -7.26 52.18 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.659 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.488 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -88.39 -19.91 25.97 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 177.81 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.847 HD13 ' O ' ' A' ' 678' ' ' LEU . 3.1 tm? -60.39 -28.95 68.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.564 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 70.22 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.038 0.447 . . . . 0.0 110.381 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.538 ' N ' ' O ' ' A' ' 678' ' ' LEU . 59.6 t30 -74.77 115.13 14.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.007 -179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -137.46 98.55 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.861 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -68.07 125.58 26.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.851 179.919 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -122.44 -80.92 0.63 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.814 0.34 . . . . 0.0 111.256 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.4 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . 8.5 m-20 64.22 102.22 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.762 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.405 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 5.6 p90 -123.83 -43.77 2.11 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.447 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.662 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.8 OUTLIER -82.16 22.13 0.84 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.771 179.854 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.732 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -110.63 -44.33 3.69 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.911 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -62.97 -38.19 90.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.626 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.61 -33.01 62.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.397 178.572 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.888 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -74.58 -9.07 58.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -82.0 -37.56 26.4 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 120.731 0.3 . . . . 0.0 111.011 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -64.52 -40.64 95.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.409 . . . . 0.0 110.703 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.889 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 14.5 m-85 -57.19 -28.93 63.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.795 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.456 ' HD2' HG13 ' A' ' 668' ' ' ILE . 8.2 mmt85 -73.65 -6.81 49.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.259 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.8 t -133.68 24.23 4.01 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.597 HG22 ' HA ' ' A' ' 662' ' ' TYR . 32.9 m -140.71 28.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.114 0.483 . . . . 0.0 109.975 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.5 27.01 72.09 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.764 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.508 ' HB2' HG23 ' A' ' 665' ' ' VAL . 1.2 mptt -125.7 16.02 8.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.984 0.421 . . . . 0.0 110.954 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.456 HG13 ' HD2' ' A' ' 663' ' ' ARG . 10.3 tt -48.19 -30.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.409 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -83.89 -37.05 22.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.129 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.29 -25.64 62.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.083 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.889 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -62.06 -34.12 75.68 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.397 179.272 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -52.26 -35.25 49.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.927 0.394 . . . . 0.0 110.467 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -68.3 0.37 Allowed 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.462 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.888 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -58.02 -22.58 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.718 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.788 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 2.3 mm-40 -64.58 -24.61 67.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.173 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.39 59.09 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.211 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.662 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -86.54 -15.03 41.22 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.677 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.732 HD22 ' HB2' ' A' ' 656' ' ' ALA . 21.7 tp -61.2 -31.77 71.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.291 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.25 72.46 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.449 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.501 ' N ' ' O ' ' A' ' 678' ' ' LEU . 55.1 t-20 -64.31 -63.05 1.24 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.013 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 123.27 26.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.984 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -129.03 153.05 47.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.927 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -140.37 -47.87 0.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.851 0.358 . . . . 0.0 111.095 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 63.3 105.52 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.467 0.651 . . . . 0.0 110.839 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.491 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -135.85 -11.02 2.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.672 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.5 OUTLIER -98.27 26.96 4.95 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.721 0.772 . . . . 0.0 109.753 178.803 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 1.031 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.33 -34.34 6.58 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.981 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.472 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -65.31 -37.78 88.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 658' ' ' TRP . . . . . . . . . . . . . 3.2 m-90 -79.89 -38.41 32.68 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.542 ' HB2' HG23 ' A' ' 674' ' ' ILE . . . -62.4 -18.97 62.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.222 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -75.32 -35.66 61.18 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 70.3 m-85 -66.49 -42.43 87.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.97 0.414 . . . . 0.0 110.843 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.791 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 22.2 m-85 -57.5 -30.53 65.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.869 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.532 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm180 -68.97 -12.59 61.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.274 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -120.84 -24.49 5.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.635 HG22 ' HA ' ' A' ' 662' ' ' TYR . 25.7 m -91.32 30.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.911 0.386 . . . . 0.0 110.617 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.84 36.6 80.66 Favored Glycine 0 CA--C 1.505 -0.564 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.217 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 12.4 mmtt -128.1 16.48 6.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.02 0.438 . . . . 0.0 111.047 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.84 -30.31 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.418 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.66 -60.96 1.98 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.065 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.87 -22.7 59.68 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.791 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -59.3 -36.38 75.49 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.132 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.58 -36.9 11.33 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.16 -69.15 0.3 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.362 0.601 . . . . 0.0 110.263 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.892 HD13 ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -55.97 -23.55 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.254 179.444 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 678' ' ' LEU . 9.4 tt0 -76.6 -14.86 59.96 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.971 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -81.71 -21.8 37.75 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.907 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.505 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -73.16 -17.76 61.34 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.22 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.031 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -50.67 -37.47 41.11 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.06 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 49.67 1.22 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.917 178.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -58.02 127.21 30.93 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.178 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.02 -46.6 0.12 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.819 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 -45.23 14.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.871 -179.954 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -174.76 -81.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.795 0.331 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -171.83 97.82 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.443 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.7 p90 -153.59 -51.51 0.1 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.781 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.849 ' HA ' HD11 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -84.59 21.11 1.56 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.436 0.636 . . . . 0.0 110.388 179.12 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.52 ' HB2' HD11 ' A' ' 678' ' ' LEU . . . -112.74 -36.1 5.28 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.234 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.443 ' O ' ' CD2' ' A' ' 661' ' ' TYR . 1.4 tt0 -67.75 -34.81 77.56 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.702 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.473 ' O ' ' CD2' ' A' ' 662' ' ' TYR . 2.4 m-90 -83.09 -40.73 19.44 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.678 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -71.0 -12.49 61.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.939 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -95.37 -30.83 13.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 120.897 0.38 . . . . 0.0 110.234 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.719 ' O ' HG13 ' A' ' 665' ' ' VAL . 22.3 m-30 -79.59 -30.88 41.69 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.19 179.208 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.763 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 15.7 m-85 -65.85 -33.82 76.72 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.684 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 38.3 mmm-85 -68.46 -12.62 61.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.424 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.8 m -124.06 -21.16 5.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.719 HG13 ' O ' ' A' ' 661' ' ' TYR . 11.8 m -93.31 28.04 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.878 0.371 . . . . 0.0 110.735 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.25 38.15 95.73 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 121.144 -0.55 . . . . 0.0 112.498 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.493 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 6.2 mttp -133.09 18.32 4.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.123 0.487 . . . . 0.0 110.395 178.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.65 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.96 -30.15 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.418 179.356 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -77.81 -50.41 12.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.406 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.62 -17.75 65.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.763 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -64.88 -36.65 85.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.523 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.53 -33.45 31.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.821 0.344 . . . . 0.0 110.479 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.6 -68.66 0.36 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.849 HD11 ' HA ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -54.19 -24.05 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.315 179.625 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.97 73.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -74.45 -21.81 59.42 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.826 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.63 ' O ' ' HB2' ' A' ' 680' ' ' ASN . 0.0 OUTLIER -70.5 -20.98 62.8 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 656' ' ' ALA . 1.8 tp -50.17 -32.82 17.19 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.648 178.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.89 36.71 1.02 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.045 179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.63 ' HB2' ' O ' ' A' ' 677' ' ' THR . 1.2 t-20 -77.99 -161.62 0.27 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.489 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 2.6 mttt 69.68 82.7 0.16 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.871 0.367 . . . . 0.0 110.868 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -122.07 -42.97 2.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.854 179.948 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -109.01 -31.1 7.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.758 0.313 . . . . 0.0 111.083 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 61.77 99.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.457 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.2 p90 -133.66 -48.9 0.82 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.993 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.5 ' HB3' ' N ' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -79.31 22.84 0.41 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.422 0.629 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.759 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -108.67 -37.89 5.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.057 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.496 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.1 tt0 -67.41 -22.03 65.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.809 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.558 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.5 m-90 -92.72 -34.17 14.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 109.247 178.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.829 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.26 -6.42 57.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.696 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.14 -39.93 10.31 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.326 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.558 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.5 p90 -77.72 -19.32 55.42 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.089 179.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.659 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.2 m-85 -68.21 -33.96 75.37 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.234 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.441 ' HA ' ' HB ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -61.3 -14.1 24.18 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.667 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 42.4 p -108.62 -25.27 10.97 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.806 HG13 ' HG3' ' A' ' 667' ' ' LYS . 13.4 p -95.82 34.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.26 30.59 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.911 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.806 ' HG3' HG13 ' A' ' 665' ' ' VAL . 13.7 mttt -119.6 16.65 12.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.08 0.467 . . . . 0.0 111.302 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.441 ' HB ' ' HA ' ' A' ' 663' ' ' ARG . 7.6 tt -49.69 -41.35 16.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.832 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.64 -57.85 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.507 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -22.49 64.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.399 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.659 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -66.21 -39.92 89.98 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.583 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.36 -34.2 32.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.15 -67.36 0.44 Allowed 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.363 0.601 . . . . 0.0 110.54 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.829 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -56.04 -25.31 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.36 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.792 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -60.05 -37.46 79.91 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.637 179.087 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.17 -19.09 62.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.876 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.417 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.74 -13.57 47.94 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.209 179.142 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.759 HD13 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -79.12 -22.77 44.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.859 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm -67.15 66.77 0.07 Allowed 'General case' 0 CA--C 1.528 0.118 0 CA-C-O 120.906 0.384 . . . . 0.0 110.596 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.445 ' N ' ' O ' ' A' ' 678' ' ' LEU . 29.0 t30 -74.32 -66.79 0.68 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.084 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 9.5 mttp -150.62 133.33 15.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.846 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.48 151.88 25.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.871 -179.923 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -116.51 -50.87 2.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.001 0.429 . . . . 0.0 111.172 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.401 ' HA ' ' ND2' ' A' ' 680' ' ' ASN . 7.2 t70 68.58 106.68 0.05 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.498 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -148.59 -11.01 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.034 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.47 ' OG ' ' OG1' ' A' ' 677' ' ' THR . 0.4 OUTLIER -97.6 26.44 5.01 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.984 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.924 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -111.72 -36.74 5.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.362 178.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -30.52 70.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.128 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.55 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.2 m-90 -86.4 -34.55 20.15 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.561 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -81.45 -2.91 51.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.431 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -96.7 -42.77 7.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.925 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.55 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 2.8 p90 -75.51 -23.94 56.78 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.767 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.0 m-85 -65.47 -29.69 70.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.947 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 668' ' ' ILE . 20.8 mmm-85 -69.32 -9.98 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.563 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -118.67 -22.79 7.31 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.625 HG12 ' HA ' ' A' ' 662' ' ' TYR . 14.6 p -94.35 33.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.04 0.448 . . . . 0.0 110.53 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.77 28.61 63.29 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.923 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.617 ' HB2' HG13 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -120.17 18.16 12.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 179.673 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.543 ' C ' HD13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -51.52 -32.8 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.722 179.441 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.95 -54.36 8.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.166 179.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -22.66 66.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.083 179.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.767 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -64.42 -34.26 77.78 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.577 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -53.26 -33.16 51.95 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.874 0.368 . . . . 0.0 110.454 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.75 -69.11 0.33 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.268 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.632 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -56.8 -23.21 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.803 179.197 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 678' ' ' LEU . 43.2 tt0 -66.92 -26.8 67.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.657 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -68.06 -20.81 64.99 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.484 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.47 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.05 -15.09 52.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.648 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.924 ' CD1' ' HB2' ' A' ' 656' ' ' ALA . 10.8 tp -55.22 -37.46 67.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.195 178.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 mptt -79.32 52.47 1.35 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.777 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.401 ' ND2' ' HA ' ' A' ' 653' ' ' ASP . 7.6 p30 -73.06 115.06 11.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.017 -179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.53 -69.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.935 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 177.87 89.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.817 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.885 179.998 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -131.52 -45.78 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.876 0.369 . . . . 0.0 111.128 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 16.6 t70 69.15 106.61 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.642 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.463 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -169.3 32.24 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.001 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.607 ' HB3' ' HG1' ' A' ' 677' ' ' THR . 0.1 OUTLIER -124.79 19.6 8.55 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.51 0.671 . . . . 0.0 110.715 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.21 -31.55 5.28 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.51 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.489 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -74.87 -24.41 58.56 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.43 -179.599 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.685 ' HB2' HD13 ' A' ' 674' ' ' ILE . 1.6 m-90 -92.69 -33.15 14.46 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 1.003 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -75.48 -13.37 60.37 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.34 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.68 -33.36 47.07 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.43 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.557 ' O ' HG22 ' A' ' 665' ' ' VAL . 59.4 m-85 -73.47 -45.44 54.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.676 0.274 . . . . 0.0 111.015 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 1.026 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 13.3 m-85 -64.43 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.946 0.403 . . . . 0.0 110.143 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.417 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.8 OUTLIER -67.51 -11.87 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.197 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 87.1 p -121.36 -24.15 5.51 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.628 HG22 ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -91.86 30.27 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.772 0.32 . . . . 0.0 110.892 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.86 29.3 70.12 Favored Glycine 0 CA--C 1.505 -0.576 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.133 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.499 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 3.6 mtpp -121.67 19.55 11.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.179 0.514 . . . . 0.0 110.27 178.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.417 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 1.5 mp -46.58 -30.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.463 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -65.62 -57.33 8.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.926 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.74 -29.25 69.99 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 1.026 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -57.14 -29.78 63.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.783 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -48.94 -49.67 39.17 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.618 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.12 -65.67 0.56 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.887 0.851 . . . . 0.0 109.713 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 1.003 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -49.35 -35.5 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.841 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.24 -27.27 67.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -76.91 -11.81 59.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.943 179.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.661 HG22 ' OD1' ' A' ' 680' ' ' ASN . 0.0 OUTLIER -77.6 -20.88 53.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 678' ' ' LEU . 0.3 OUTLIER -52.24 -33.25 40.65 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.741 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -13.78 35.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.966 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.661 ' OD1' HG22 ' A' ' 677' ' ' THR . 2.8 m120 -44.63 146.63 0.71 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.972 0.415 . . . . 0.0 111.354 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -160.61 79.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.862 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 104.82 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.289 -0.863 . . . . 0.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 652' ' ' ALA . . . . . 0.904 ' HB3' ' HB3' ' A' ' 680' ' ' ASN . . . -92.0 -70.11 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.92 0.39 . . . . 0.0 111.175 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.446 ' HA ' HD22 ' A' ' 678' ' ' LEU . 0.9 OUTLIER 60.77 100.62 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.389 -179.535 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -162.57 -4.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.611 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 4.6 m -100.48 27.03 6.07 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.573 0.701 . . . . 0.0 109.644 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.684 ' HB2' HD23 ' A' ' 678' ' ' LEU . . . -108.72 -38.66 5.58 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.789 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.443 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.8 OUTLIER -59.15 -29.44 67.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.487 -179.61 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 2.0 m-90 -88.54 -33.55 17.69 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 1.002 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -67.57 -24.17 65.48 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.493 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -33.09 72.77 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.782 0.325 . . . . 0.0 111.59 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.835 ' O ' HG23 ' A' ' 665' ' ' VAL . 62.8 m-85 -66.8 -46.86 73.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.893 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 23.9 m-85 -56.8 -30.88 64.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.942 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 10.2 mmm180 -61.38 -22.04 64.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.631 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.5 m -117.2 -16.14 10.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.824 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.835 HG23 ' O ' ' A' ' 661' ' ' TYR . 18.5 t -92.53 27.41 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.814 0.34 . . . . 0.0 110.297 179.191 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.19 29.34 62.65 Favored Glycine 0 CA--C 1.505 -0.571 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.794 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.418 ' C ' ' HB3' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -124.48 14.94 8.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.091 0.472 . . . . 0.0 110.954 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 5.4 tt -44.95 -31.87 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.566 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -70.14 -62.42 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.193 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.53 -23.99 53.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.893 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -60.63 -26.62 67.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.489 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -49.36 -44.49 44.78 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -59.5 -67.14 0.41 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.495 0.664 . . . . 0.0 109.896 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 1.002 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -51.03 -32.26 11.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.331 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 12.2 tt0 -72.49 -10.78 60.21 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.881 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.35 -13.63 37.44 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.607 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.474 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.19 -17.61 36.59 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 177.732 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.684 HD23 ' HB2' ' A' ' 656' ' ' ALA . 3.3 tm? -55.74 -34.66 65.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.41 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -77.62 53.91 1.14 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.853 178.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.904 ' HB3' ' HB3' ' A' ' 652' ' ' ALA . 0.4 OUTLIER -91.97 113.83 26.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.985 -179.442 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 5.7 tttm 61.04 154.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.56 88.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.806 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 1.9 m120 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.915 179.892 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -175.96 -81.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 111.107 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.6 98.25 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.112 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.472 ' CE2' ' HB3' ' A' ' 680' ' ' ASN . 0.9 OUTLIER -150.82 -55.36 0.15 Allowed 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.804 179.72 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.42 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.2 OUTLIER -83.86 19.39 1.73 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 110.394 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.605 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -113.66 -43.46 3.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.934 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -63.28 -34.86 78.61 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.5 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -80.23 -29.8 38.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.159 179.435 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.909 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -79.22 -13.36 59.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.189 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 663' ' ' ARG . 22.3 mt-10 -76.23 -36.7 58.42 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -67.53 -23.42 65.44 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.263 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.803 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.0 m-85 -67.76 -58.07 5.25 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.062 0.458 . . . . 0.0 110.588 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.608 ' CB ' HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -60.02 -7.65 1.9 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.812 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.1 m -90.96 -35.92 14.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.699 0.285 . . . . 0.0 111.368 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 665' ' ' VAL . 22.3 t -99.36 37.06 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.095 0.474 . . . . 0.0 110.127 179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.69 26.33 68.41 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.647 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.95 19.69 20.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 0.0 110.727 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.608 HG22 ' CB ' ' A' ' 663' ' ' ARG . 22.5 pt -45.85 -37.93 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.806 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 669' ' ' GLU . . . . . 0.435 ' N ' HG13 ' A' ' 668' ' ' ILE . 9.4 tt0 -67.25 -58.12 5.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -60.06 -23.0 63.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.684 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.803 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -67.73 -38.3 83.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.72 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -52.3 -32.85 39.55 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.954 0.406 . . . . 0.0 110.499 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.64 -67.7 0.41 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.874 179.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.909 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -61.47 -19.54 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.912 179.688 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.739 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 2.5 mt-10 -68.59 -27.1 65.75 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -71.5 -13.41 61.8 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.228 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.65 -23.24 56.27 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.041 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.605 HD22 ' HB2' ' A' ' 656' ' ' ALA . 12.7 tp -51.59 -30.04 19.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.049 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -75.49 2.85 10.51 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.565 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.472 ' HB3' ' CE2' ' A' ' 654' ' ' TYR . 48.9 t-20 -49.06 143.24 5.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.194 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp -107.0 -73.68 0.68 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.714 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 57.27 35.24 25.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.971 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.872 179.971 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.77 -53.2 19.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 653' ' ' ASP . . . . . 0.526 ' CG ' HD13 ' A' ' 678' ' ' LEU . 1.4 m-20 63.24 101.17 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.791 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.417 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.4 p90 -118.14 -45.84 2.64 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.089 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.522 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -76.72 11.66 1.61 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.186 0.517 . . . . 0.0 110.63 179.246 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.794 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -92.51 -44.21 8.75 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -32.81 70.98 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.676 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -82.21 -23.52 35.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.044 179.017 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.879 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -89.09 0.07 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.45 -39.24 16.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.548 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -70.29 -30.21 67.17 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.715 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.849 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.4 m-85 -62.81 -35.49 80.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.13 0.49 . . . . 0.0 109.956 178.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.731 ' HA ' HG22 ' A' ' 668' ' ' ILE . 2.6 mpt_? -71.11 -2.76 16.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.935 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.6 m -109.93 -28.9 8.51 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.673 HG23 ' HB2' ' A' ' 667' ' ' LYS . 4.7 m -97.57 36.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.024 0.44 . . . . 0.0 110.311 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.7 27.08 61.02 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.569 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.673 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.3 OUTLIER -111.31 19.41 18.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.04 0.448 . . . . 0.0 110.864 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.731 HG22 ' HA ' ' A' ' 663' ' ' ARG . 24.3 pt -47.18 -35.25 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.539 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -70.54 -49.57 46.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.765 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.68 -29.71 70.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.537 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.849 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.81 -33.27 75.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.187 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.528 ' HA ' ' HG2' ' A' ' 675' ' ' GLU . 2.8 mt-10 -58.93 -22.18 59.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.132 -179.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -81.8 -61.47 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.44 0.638 . . . . 0.0 110.319 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.879 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.8 OUTLIER -62.5 -25.51 38.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.047 -179.567 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.704 ' HB3' ' CB ' ' A' ' 659' ' ' ALA . 1.5 pp20? -69.82 -29.52 66.82 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.276 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -24.1 12.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.856 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.86 -20.22 59.83 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.556 179.387 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.794 HD22 ' HB2' ' A' ' 656' ' ' ALA . 1.1 pp -73.54 -19.56 60.88 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.109 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -39.71 -33.93 0.22 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.821 0.343 . . . . 0.0 111.548 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 49.82 94.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.163 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.8 125.72 50.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -171.43 117.53 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 9.2 t30 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.929 179.966 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.439 -0.264 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -160.98 -47.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 51.9 26.18 3.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.033 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -6.06 44.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.762 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.572 ' HB2' ' HB ' ' A' ' 677' ' ' THR . 0.1 OUTLIER -100.33 23.0 10.72 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.494 0.664 . . . . 0.0 110.336 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -108.9 -37.67 5.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.289 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.456 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.1 OUTLIER -64.78 -28.9 69.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.543 -179.745 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.542 ' HB2' HD13 ' A' ' 674' ' ' ILE . 1.7 m-90 -88.37 -29.46 20.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 1.065 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -79.48 -7.18 58.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.443 179.004 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.17 -44.32 9.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.506 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.79 ' O ' HG23 ' A' ' 665' ' ' VAL . 3.8 p90 -74.6 -18.83 60.51 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.691 179.736 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.767 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.9 m-85 -72.07 -29.72 64.41 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.396 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 1.012 ' HA ' HG22 ' A' ' 668' ' ' ILE . 5.8 mmt180 -66.9 -10.06 44.64 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.374 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.18 -22.24 6.69 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.44 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 661' ' ' TYR . 18.7 t -92.65 31.94 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.899 0.38 . . . . 0.0 110.391 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.33 27.17 52.57 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.577 -179.168 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.448 ' HB2' ' CD1' ' A' ' 662' ' ' TYR . 2.4 mttt -115.37 16.73 16.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.111 0.481 . . . . 0.0 110.968 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 1.012 HG22 ' HA ' ' A' ' 663' ' ' ARG . 12.9 pt -47.25 -38.46 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.0 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.17 -64.34 0.91 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.578 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.42 -23.67 50.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.382 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.767 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.8 -31.37 72.52 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -50.01 -51.12 44.43 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.806 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -58.07 -62.47 1.8 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.741 0.781 . . . . 0.0 109.895 178.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 1.065 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -51.96 -25.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.342 179.835 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.564 ' HA ' HD23 ' A' ' 678' ' ' LEU . 2.8 tt0 -76.14 -11.76 59.99 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.233 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.1 -10.73 40.91 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.696 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.572 ' HB ' ' HB2' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.81 -22.09 22.27 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.202 178.833 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.564 HD23 ' HA ' ' A' ' 675' ' ' GLU . 3.8 pp -65.3 -25.96 67.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.812 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -61.38 -10.22 6.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 178.562 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -33.34 125.21 0.39 Allowed 'General case' 0 C--N 1.342 0.268 0 C-N-CA 122.848 0.459 . . . . 0.0 112.076 -179.988 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -138.81 149.2 44.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.709 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.08 118.29 19.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.01 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 21.7 m120 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.967 179.997 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 651' ' ' GLY . . . . . 0.426 ' HA3' ' HA ' ' A' ' 682' ' ' GLN . . . . . . . . 0 N--CA 1.489 2.22 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 652' ' ' ALA . . . . . 0.459 ' HB3' ' CB ' ' A' ' 680' ' ' ASN . . . -165.01 -68.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.365 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 53.97 89.33 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.369 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.522 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 -134.54 -56.69 0.84 Allowed 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.596 -179.078 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.787 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -74.74 20.2 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.168 0.508 . . . . 0.0 110.346 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 1.04 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -103.04 -42.58 5.75 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.07 178.781 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -48.34 77.52 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.922 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.504 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -72.45 -10.53 59.91 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.704 178.449 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.919 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -86.23 -19.51 29.87 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.319 -179.857 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.43 -20.19 48.12 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.174 -0.611 . . . . 0.0 110.62 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.848 ' O ' HG22 ' A' ' 665' ' ' VAL . 71.8 m-85 -86.73 -14.13 43.32 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.616 178.721 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.919 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -72.64 -35.01 67.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.301 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.865 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -82.09 10.91 5.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.374 179.977 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -128.03 -33.08 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.879 HG23 ' HG2' ' A' ' 667' ' ' LYS . 27.5 m -93.82 32.54 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.29 32.58 84.21 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.879 ' HG2' HG23 ' A' ' 665' ' ' VAL . 29.5 mmtm -113.15 20.57 16.15 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.017 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 663' ' ' ARG . 2.1 mp -51.57 -25.63 5.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.127 179.684 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.22 -54.49 4.18 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.657 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 670' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 8.2 mt-10 -61.11 -18.42 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 177.048 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.812 ' HB1' ' CE1' ' A' ' 662' ' ' TYR . . . -53.1 -48.96 67.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.106 179.277 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.94 -19.27 6.34 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.599 -179.719 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 673' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -82.13 -58.24 3.04 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 120.778 0.323 . . . . 0.0 111.451 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.685 HG23 ' HD2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -76.53 -3.63 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.05 179.807 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.469 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 20.5 tt0 -87.52 -26.54 23.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.856 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -80.11 -11.35 59.77 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.534 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -26.73 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.972 0.415 . . . . 0.0 110.093 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.04 HD13 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -70.04 -21.47 63.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.361 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -52.21 86.88 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.462 ' N ' ' O ' ' A' ' 678' ' ' LEU . 0.7 OUTLIER -143.86 95.58 2.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.526 -179.923 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.79 140.63 14.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 682' ' ' GLN . . . . . 0.426 ' HA ' ' HA3' ' A' ' 651' ' ' GLY . 2.0 mt-30 -100.56 -30.25 11.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 39.7 t30 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.842 179.965 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -119.52 -47.76 2.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.951 0.405 . . . . 0.0 111.067 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 59.82 98.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.54 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 -135.31 -55.35 0.8 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.857 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.722 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -77.07 26.5 0.15 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.538 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.931 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.81 -42.5 4.24 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.329 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -63.59 -38.87 92.78 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.141 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.508 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -83.39 -14.54 52.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.703 178.465 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.877 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -83.98 -21.33 31.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -76.27 -20.5 57.3 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.95 179.441 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.851 ' O ' HG22 ' A' ' 665' ' ' VAL . 19.7 m-85 -84.89 -11.4 55.68 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.367 179.557 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.877 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.38 -34.9 41.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.139 179.386 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.831 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -81.83 9.51 7.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.372 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.81 -32.13 3.1 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.851 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.851 HG22 ' O ' ' A' ' 661' ' ' TYR . 35.0 m -96.89 35.37 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.961 0.41 . . . . 0.0 110.536 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.84 31.79 72.9 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.498 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.697 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -106.39 16.62 24.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.907 0.384 . . . . 0.0 111.45 -179.637 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.793 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -52.13 -24.12 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.991 -179.602 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -85.73 -59.48 2.3 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 670' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 0.3 OUTLIER -59.59 -19.3 47.82 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.156 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.736 ' HB1' ' CE1' ' A' ' 662' ' ' TYR . . . -51.26 -47.63 62.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.886 178.939 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -53.54 -19.43 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.393 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 673' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -79.13 -61.15 2.1 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.638 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -76.82 -5.01 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.986 179.731 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.471 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 68.4 tt0 -86.05 -25.36 25.94 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.632 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 4.7 mtpt -74.36 -19.47 60.43 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.787 179.4 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.05 -16.67 52.6 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.333 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.931 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -60.31 -39.51 87.26 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.966 178.868 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt -58.52 86.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.781 179.826 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -82.14 57.38 3.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.778 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -170.33 -41.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.814 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 61.37 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 179.886 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 30.0 m-20 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.914 179.955 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -162.02 -44.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.911 0.386 . . . . 0.0 111.108 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 64.78 104.39 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.242 0.544 . . . . 0.0 110.552 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.458 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -163.73 28.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.214 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.613 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -126.04 20.82 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.629 0.728 . . . . 0.0 109.886 179.127 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.438 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -115.17 -37.43 4.1 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.16 178.732 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.519 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.0 OUTLIER -74.41 -36.84 63.47 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.401 -179.825 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.519 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 2.7 m-90 -83.63 -21.32 32.55 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.989 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.813 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -71.87 -22.2 61.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.796 -179.583 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -80.69 -13.86 58.64 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.165 179.231 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.862 ' O ' HG22 ' A' ' 665' ' ' VAL . 91.1 m-85 -91.95 -14.31 29.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.422 178.833 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.825 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -74.65 -37.16 62.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.114 179.6 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.825 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.03 11.23 5.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.481 179.996 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 t -127.05 -34.96 2.29 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.862 HG22 ' O ' ' A' ' 661' ' ' TYR . 33.8 m -95.56 34.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.926 0.393 . . . . 0.0 110.473 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.17 31.9 74.63 Favored Glycine 0 CA--C 1.507 -0.447 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.527 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.643 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.29 18.75 21.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 111.37 179.957 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 9.6 tt -50.14 -27.07 3.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -86.51 -51.64 6.06 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 670' ' ' GLU . . . . . 0.537 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 0.0 OUTLIER -62.57 -18.6 62.42 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 177.207 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.723 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -53.21 -47.98 68.48 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.059 179.126 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -52.52 -19.83 2.53 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.912 179.827 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 673' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -75.28 -67.26 0.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.832 0.348 . . . . 0.0 111.553 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.696 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -71.81 -13.0 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 22.4 tt0 -79.28 -27.36 42.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.05 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.55 -8.27 59.61 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.691 179.029 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.475 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.86 -23.12 33.81 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 178.017 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.438 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -52.51 -34.05 47.81 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.613 179.052 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.59 -18.79 21.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.372 178.643 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -43.89 98.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.37 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -169.65 70.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -84.86 121.44 27.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.921 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.921 179.998 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.507 -0.237 . . . . 0.0 112.507 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -153.5 -80.43 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.91 0.386 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 56.99 95.1 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.465 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.1 p90 -137.8 -46.4 0.54 Allowed 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.702 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.52 26.61 0.29 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.177 179.162 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.499 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -112.13 -46.22 3.22 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.038 178.705 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.05 -38.79 86.46 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.938 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.464 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -86.97 5.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.937 178.553 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.909 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -104.29 -19.11 14.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.91 178.638 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -77.35 -22.0 52.44 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.378 178.836 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.863 ' O ' HG22 ' A' ' 665' ' ' VAL . 66.9 m-85 -82.72 -13.75 55.8 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.236 179.304 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.909 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -75.92 -37.23 58.96 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.363 179.49 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.865 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.54 10.74 6.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.609 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.12 -32.73 2.96 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.863 HG22 ' O ' ' A' ' 661' ' ' TYR . 34.7 m -97.99 36.08 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.984 0.421 . . . . 0.0 110.416 179.688 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.05 31.5 72.93 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.561 -179.374 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -106.97 17.87 22.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.891 0.377 . . . . 0.0 111.487 -179.783 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.47 -29.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.395 -179.88 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -83.34 -51.36 7.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 670' ' ' GLU . . . . . 0.41 ' HB3' ' HG2' ' A' ' 667' ' ' LYS . 8.4 tt0 -63.0 -18.41 63.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.63 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.696 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -55.47 -43.77 75.83 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.736 178.92 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -47.35 -31.83 4.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.48 -179.711 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -76.38 -51.94 10.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 111.16 179.537 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.734 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -72.82 -18.28 18.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.62 -179.035 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 671' ' ' ALA . 0.7 OUTLIER -86.03 -21.16 27.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 110.309 178.913 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -79.55 -16.0 56.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.85 179.516 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.432 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.56 -3.28 58.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.991 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 656' ' ' ALA . 1.1 tt -80.18 -24.26 40.45 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.487 179.182 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.14 -34.41 0.06 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.625 -179.826 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.42 ' O ' ' CB ' ' A' ' 681' ' ' LYS . 4.2 t-20 -54.94 145.94 18.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.694 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 681' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 680' ' ' ASN . 0.2 OUTLIER 81.67 -47.99 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.234 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.31 83.14 0.14 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.868 0.366 . . . . 0.0 110.851 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -99.33 -77.65 0.52 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.952 0.405 . . . . 0.0 111.239 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 64.66 101.44 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.744 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.497 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 -123.08 -50.69 1.91 Allowed 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.179 -179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.803 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -76.67 19.85 0.26 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.237 0.542 . . . . 0.0 110.329 178.978 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -100.35 -44.34 5.95 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.025 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -64.93 -39.75 93.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.592 ' C ' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -85.75 8.95 17.93 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.795 178.365 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.903 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -104.46 -25.29 12.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.836 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -73.74 -16.86 61.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.211 178.573 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.837 ' O ' HG22 ' A' ' 665' ' ' VAL . 20.1 m-30 -85.21 -17.41 37.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.017 179.123 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.903 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -71.84 -36.6 70.22 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.264 -0.575 . . . . 0.0 110.588 179.606 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.84 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 2.8 ptt180 -77.84 5.28 9.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.48 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 91.6 p -128.67 -30.97 2.26 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.847 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 661' ' ' TYR . 18.6 m -94.29 33.59 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.888 0.375 . . . . 0.0 110.517 179.602 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.56 32.14 72.64 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.788 -179.337 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.699 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 2.6 ttpt -112.13 19.13 18.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.907 0.384 . . . . 0.0 111.295 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.458 ' O ' HD12 ' A' ' 668' ' ' ILE . 2.3 tp -51.5 -32.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -82.48 -50.02 9.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.059 179.466 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 670' ' ' GLU . . . . . 0.416 ' HB2' ' HG2' ' A' ' 667' ' ' LYS . 0.3 OUTLIER -64.48 -17.07 63.52 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 177.295 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.749 ' HA ' HG23 ' A' ' 674' ' ' ILE . . . -54.88 -44.99 74.59 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.672 179.018 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -45.79 -35.73 4.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.622 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.76 15.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.549 0.69 . . . . 0.0 110.904 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 671' ' ' ALA . 0.1 OUTLIER -71.92 -10.92 14.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.675 -179.253 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.587 ' OE2' HD21 ' A' ' 678' ' ' LEU . 2.0 tm-20 -94.91 -13.44 25.41 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.746 0.308 . . . . 0.0 110.648 178.76 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.83 -8.42 40.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.777 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.423 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -87.67 -27.27 22.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.32 179.332 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.587 HD21 ' OE2' ' A' ' 675' ' ' GLU . 3.7 pp -70.25 -20.51 63.06 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.009 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 13.5 mttm -66.16 67.62 0.05 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.934 0.397 . . . . 0.0 110.636 179.752 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 678' ' ' LEU . 11.5 t-20 -120.8 157.32 30.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.882 -179.781 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -116.78 -66.3 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.956 179.988 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -168.74 -56.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.9 179.999 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.919 -179.988 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.561 -0.216 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 652' ' ' ALA . . . . . 0.836 ' HB3' ' HB2' ' A' ' 681' ' ' LYS . . . 64.51 102.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.977 0.418 . . . . 0.0 111.0 -179.827 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -148.1 89.73 1.76 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.285 179.762 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.49 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.8 p90 -104.85 -55.01 2.4 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.039 -179.564 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.562 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -78.98 26.09 0.26 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.791 178.899 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.661 ' HB2' ' CD2' ' A' ' 678' ' ' LEU . . . -108.87 -41.21 4.81 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.643 178.461 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.476 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 2.8 tt0 -60.94 -49.46 77.38 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.802 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.587 ' HE3' ' O ' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -73.0 -5.24 37.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.181 177.531 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.716 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . . . -106.72 9.36 31.18 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.497 178.467 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -109.9 -34.24 6.49 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.643 178.375 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 658' ' ' TRP . 20.9 p90 -100.6 13.0 36.17 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.025 177.573 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.969 ' CZ ' ' HB1' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -102.98 -26.21 13.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.757 177.996 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.775 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -81.69 -0.56 43.31 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.715 178.924 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 t -124.31 -19.56 5.47 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.604 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.59 HG22 ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -93.65 28.51 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 111.343 179.957 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 78.5 10.23 86.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.922 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.682 ' O ' ' HB2' ' A' ' 671' ' ' ALA . 5.0 mmmt -105.32 20.75 18.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.003 0.401 . . . . 0.0 110.814 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' A' ' 671' ' ' ALA . 2.3 tp -55.99 -39.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.01 -179.627 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -75.18 -56.92 4.24 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.628 -0.429 . . . . 0.0 109.902 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.08 -16.43 59.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.788 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.969 ' HB1' ' CZ ' ' A' ' 662' ' ' TYR . . . -60.33 -41.25 93.14 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.125 179.253 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -49.49 -25.34 2.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.404 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -72.62 -62.39 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.766 HG23 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -70.03 -7.1 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.909 179.494 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 5.1 tm-20 -75.83 -32.24 59.72 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.482 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -75.1 -4.13 36.78 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.69 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.562 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.7 OUTLIER -96.21 -13.34 23.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.552 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.702 ' O ' HD22 ' A' ' 678' ' ' LEU . 1.2 tm? -75.68 -26.58 57.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.27 179.379 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? -64.06 69.51 0.02 OUTLIER 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.016 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 680' ' ' ASN . . . . . 0.479 ' N ' ' O ' ' A' ' 678' ' ' LEU . 5.2 t-20 -109.78 -55.64 2.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.793 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 681' ' ' LYS . . . . . 0.836 ' HB2' ' HB3' ' A' ' 652' ' ' ALA . 39.3 mmtt -149.09 140.69 23.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.807 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -135.69 82.41 1.95 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 53.8 t30 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.859 179.915 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.522 -0.231 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -106.27 -46.97 3.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.333 . . . . 0.0 111.204 -179.819 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 3.5 p30 43.61 36.23 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.141 -179.662 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.483 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -62.4 -9.83 9.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.114 179.903 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.625 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.3 OUTLIER -94.8 26.24 3.66 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 121.147 0.498 . . . . 0.0 110.254 178.937 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . . . -110.17 -38.57 5.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.536 178.817 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.436 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 7.9 tt0 -67.13 -39.11 86.55 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.677 -179.556 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.436 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 3.6 m-90 -84.6 -20.64 31.1 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.727 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -74.31 -35.59 63.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -179.425 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -76.31 -3.67 38.0 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.837 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 1.017 ' O ' HG23 ' A' ' 665' ' ' VAL . 21.8 m-85 -94.98 -34.94 12.17 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.656 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.79 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.3 OUTLIER -56.18 -39.26 72.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.655 179.196 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.79 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 3.1 ptm85 -62.09 -8.2 5.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.689 -179.557 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.97 -18.58 1.81 Allowed 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.849 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 1.017 HG23 ' O ' ' A' ' 661' ' ' TYR . 7.5 t -89.76 19.19 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.606 0.241 . . . . 0.0 110.469 179.181 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.52 29.22 74.44 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.504 -0.855 . . . . 0.0 111.199 -178.763 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.715 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.7 OUTLIER -114.8 14.46 17.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 179.582 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.76 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -49.03 -25.81 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.031 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -86.39 -56.91 3.22 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.662 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 670' ' ' GLU . . . . . 0.507 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 1.1 tp10 -62.24 -15.99 50.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 176.612 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.731 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -50.48 -47.03 57.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.678 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -51.16 -21.67 2.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.986 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 673' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -74.89 -67.55 0.63 Allowed 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.027 0.442 . . . . 0.0 111.456 179.47 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -67.84 -13.16 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -80.4 -24.21 39.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.258 178.502 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -82.05 -15.77 52.41 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.586 179.943 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.505 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.93 -16.39 47.56 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.925 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.446 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -55.88 -33.8 64.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.284 178.137 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.77 38.14 0.62 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.316 178.754 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -59.85 -45.7 91.61 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.964 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 3.2 tptt -98.09 143.9 28.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.855 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -95.37 103.58 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.927 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.196 -0.906 . . . . 0.0 110.828 -179.995 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -59.0 -59.68 5.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.988 0.423 . . . . 0.0 111.124 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.53 105.71 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.568 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 654' ' ' TYR . . . . . 0.488 ' N ' ' CD1' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -145.79 -7.61 0.57 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.921 -179.622 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 655' ' ' SER . . . . . 0.587 ' OG ' HG12 ' A' ' 674' ' ' ILE . 0.4 OUTLIER -96.55 24.49 5.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.145 178.958 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 656' ' ' ALA . . . . . 0.538 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.16 -41.96 4.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.771 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 657' ' ' GLN . . . . . 0.47 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.7 OUTLIER -66.25 -31.21 71.89 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.221 -179.944 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 658' ' ' TRP . . . . . 0.587 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 1.7 m-90 -87.14 -20.07 27.57 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 177.462 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 659' ' ' ALA . . . . . 0.756 ' O ' ' CE1' ' A' ' 662' ' ' TYR . . . -89.93 5.42 46.5 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.317 179.527 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.35 -12.2 13.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.99 178.273 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 661' ' ' TYR . . . . . 0.611 ' O ' HG22 ' A' ' 665' ' ' VAL . 1.6 p90 -111.72 1.11 16.53 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.725 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 662' ' ' TYR . . . . . 0.853 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -95.64 -27.04 15.5 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.36 179.334 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 663' ' ' ARG . . . . . 0.853 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 19.4 mtp180 -81.54 -1.41 46.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.563 178.847 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.6 m -119.9 -26.0 5.71 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.755 -179.52 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 665' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 661' ' ' TYR . 24.1 m -92.73 31.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 67.0 23.52 72.86 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.318 -179.728 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 671' ' ' ALA . 0.4 OUTLIER -107.83 15.59 24.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.773 0.32 . . . . 0.0 111.261 179.665 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 668' ' ' ILE . . . . . 0.411 HG13 ' HA ' ' A' ' 663' ' ' ARG . 2.8 mt -51.5 -32.26 13.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.197 -179.618 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -79.89 -59.67 2.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.223 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -61.9 -16.41 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.592 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 671' ' ' ALA . . . . . 0.826 ' HB1' ' CZ ' ' A' ' 662' ' ' TYR . . . -58.87 -40.88 85.66 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.034 179.158 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -48.87 -23.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.616 -0.433 . . . . 0.0 111.194 179.308 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -70.8 -68.35 0.44 Allowed 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 674' ' ' ILE . . . . . 0.696 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -68.0 -8.81 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.503 -0.479 . . . . 0.0 109.834 179.93 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 675' ' ' GLU . . . . . 0.455 ' HB2' ' OH ' ' A' ' 662' ' ' TYR . 16.5 tm-20 -77.0 -29.89 55.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.05 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -9.32 58.69 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.398 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 677' ' ' THR . . . . . 0.486 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -91.06 -15.94 28.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.87 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.538 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.6 OUTLIER -59.53 -33.55 71.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.277 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt -57.62 -18.59 20.97 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.551 178.859 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -42.8 144.2 0.61 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.486 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.68 161.73 40.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.81 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.49 -47.83 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.867 -179.98 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 53.8 p30 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.855 -179.975 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.477 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 . . . . . 0 CA--C 1.513 -0.474 0 CA-C-O 120.839 0.352 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.4 OUTLIER -76.15 19.21 0.24 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.636 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.765 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -104.18 -42.05 5.63 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -58.83 -38.9 79.7 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.571 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.57 -35.94 60.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.8 179.086 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.667 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -71.05 -16.04 62.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.567 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.02 -37.97 69.66 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.257 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.702 ' O ' HG23 ' A' ' 665' ' ' VAL . 32.1 m-85 -62.65 -46.07 89.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.888 0.375 . . . . 0.0 110.753 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.786 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 10.0 m-85 -54.86 -28.83 53.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.601 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 7.3 mmt85 -63.24 -20.08 65.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.877 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.03 -15.6 9.25 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 661' ' ' TYR . 20.4 t -91.71 25.83 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.858 0.361 . . . . 0.0 110.341 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.88 65.28 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.72 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.478 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 3.0 mttt -124.36 16.24 9.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.94 0.4 . . . . 0.0 110.825 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.604 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.16 -31.58 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.214 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -60.04 2.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.931 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -22.64 57.3 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.786 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.62 -32.27 72.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.352 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -52.44 -36.12 53.87 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.943 0.402 . . . . 0.0 110.489 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.56 -67.95 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.317 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.767 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -59.6 -17.58 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.712 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.563 ' O ' HD23 ' A' ' 678' ' ' LEU . 72.7 tt0 -78.79 -26.13 44.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.368 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -71.6 -19.14 62.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.309 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.431 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -76.21 -23.47 54.61 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.729 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.765 HD22 ' HB2' ' A' ' 656' ' ' ALA . 0.9 OUTLIER -68.36 -28.49 67.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.126 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 4.3 tptt . . . . . 0 C--O 1.231 0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.102 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.478 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 120.908 0.385 . . . . 0.0 111.578 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.608 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.7 OUTLIER -77.26 23.46 0.2 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.34 0.591 . . . . 0.0 110.685 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.634 ' HB2' ' CD2' ' A' ' 678' ' ' LEU . . . -108.38 -37.1 6.07 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.875 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.457 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -63.0 -34.32 77.31 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.993 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.498 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . 2.4 m-90 -84.04 -35.43 23.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.5 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -67.16 -18.78 65.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.84 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -70.56 -43.79 68.75 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-O 121.001 0.429 . . . . 0.0 110.749 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.586 ' O ' HG22 ' A' ' 665' ' ' VAL . 71.8 m-85 -62.64 -48.89 77.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.818 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 13.8 m-85 -54.18 -37.61 64.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.675 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.787 ' HG3' HG23 ' A' ' 668' ' ' ILE . 1.1 mpt_? -68.98 -9.73 53.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.684 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 4.2 m -122.04 -22.86 5.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 661' ' ' TYR . 35.6 m -93.44 31.65 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.85 0.357 . . . . 0.0 110.715 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.11 65.41 Favored Glycine 0 CA--C 1.506 -0.505 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.037 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.581 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -120.04 19.64 12.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.201 0.524 . . . . 0.0 110.444 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.787 HG23 ' HG3' ' A' ' 663' ' ' ARG . 1.4 mp -47.83 -32.01 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.611 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -70.28 -60.75 2.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.308 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.14 -22.19 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.136 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.818 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.9 -37.85 86.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.207 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.09 -30.89 7.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.825 0.345 . . . . 0.0 110.476 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.78 -69.81 0.28 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.185 0.517 . . . . 0.0 110.484 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.638 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -62.2 -17.51 18.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.27 179.471 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -76.2 -28.96 57.45 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -73.13 -9.97 59.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.147 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.542 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.2 OUTLIER -91.26 -9.51 44.9 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.716 HD13 ' O ' ' A' ' 678' ' ' LEU . 3.4 tm? -73.03 -29.91 63.35 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.428 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.7 tptp . . . . . 0 C--N 1.333 -0.137 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.876 179.902 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.505 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.8 p90 . . . . . 0 CA--C 1.512 -0.519 0 CA-C-O 121.011 0.434 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.632 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -75.26 21.22 0.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.705 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.92 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -105.93 -42.29 5.17 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.12 -37.3 82.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.592 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.55 -36.52 63.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.825 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.818 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -71.16 -13.05 61.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.663 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.38 -38.04 63.26 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.956 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.864 ' O ' HG23 ' A' ' 665' ' ' VAL . 35.5 m-85 -65.38 -50.52 65.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.859 0.361 . . . . 0.0 110.372 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.815 ' CE2' HG21 ' A' ' 674' ' ' ILE . 16.3 m-85 -52.87 -32.91 47.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.32 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.959 ' HA ' HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -66.29 -12.06 54.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.297 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 5.1 p -134.91 20.04 3.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.826 0.346 . . . . 0.0 111.62 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.864 HG23 ' O ' ' A' ' 661' ' ' TYR . 22.0 t -128.56 22.81 2.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.808 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.71 24.69 72.79 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.493 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.426 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -124.15 15.7 9.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.232 0.539 . . . . 0.0 110.643 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.959 HG22 ' HA ' ' A' ' 663' ' ' ARG . 10.0 pt -45.59 -33.81 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.559 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -67.98 -61.95 1.63 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.307 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . 0.4 ' HB3' ' CG ' ' A' ' 667' ' ' LYS . 3.0 tm-20 -58.37 -22.35 53.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.809 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -63.94 -35.73 81.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.476 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.07 -39.55 59.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.837 0.351 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.87 -63.2 1.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.416 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.818 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -61.8 -13.79 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.805 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.549 ' HG2' HD23 ' A' ' 678' ' ' LEU . 2.4 tm-20 -82.35 -27.89 31.9 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 110.486 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -76.74 -10.33 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.632 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -80.2 -25.14 39.81 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.008 178.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.92 HD22 ' HB2' ' A' ' 656' ' ' ALA . 2.4 pp -60.91 -27.95 68.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.717 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.7 tttt . . . . . 0 C--N 1.333 -0.134 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.559 179.733 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.485 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.6 p90 . . . . . 0 CA--C 1.512 -0.487 0 CA-C-O 120.892 0.377 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.608 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -77.75 25.63 0.2 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.543 0.687 . . . . 0.0 110.32 179.297 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.533 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -109.19 -36.63 5.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.447 ' NE2' ' CZ3' ' A' ' 658' ' ' TRP . 10.0 tt0 -63.22 -29.81 71.07 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.643 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.518 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -87.47 -35.09 18.43 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.73 ' HB2' HG23 ' A' ' 674' ' ' ILE . . . -77.06 -8.63 57.78 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.098 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -88.11 -47.59 8.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.285 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.1 p90 -72.84 -21.95 60.87 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.199 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.783 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.2 m-85 -67.44 -32.72 73.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.829 ' HG3' HG23 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -67.4 -8.16 30.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.0 m -116.38 -22.73 8.65 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.527 HG23 ' HG3' ' A' ' 667' ' ' LYS . 31.2 m -96.44 35.42 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.982 0.42 . . . . 0.0 110.398 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.03 23.2 56.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.777 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.527 ' HG3' HG23 ' A' ' 665' ' ' VAL . 0.6 OUTLIER -111.87 19.0 18.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.001 0.429 . . . . 0.0 110.656 179.636 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.829 HG23 ' HG3' ' A' ' 663' ' ' ARG . 3.3 mt -49.21 -42.02 14.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.941 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -68.22 -54.74 15.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.471 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -23.25 66.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.433 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.783 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -65.23 -43.04 92.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.426 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -47.87 -35.22 10.03 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.745 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.74 -67.74 0.4 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.317 0.58 . . . . 0.0 110.3 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.73 HG23 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -55.0 -31.52 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.924 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.485 ' CD ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -60.31 -32.69 71.46 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.949 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.16 -23.19 67.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.626 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.418 ' O ' ' CZ ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -80.9 -16.7 52.9 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.386 179.146 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.669 ' O ' HD12 ' A' ' 678' ' ' LEU . 0.2 OUTLIER -75.12 -23.29 57.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.1 mttp . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 179.448 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.456 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.4 p90 . . . . . 0 CA--C 1.513 -0.448 0 CA-C-O 120.886 0.374 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.645 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -75.96 17.33 0.34 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.938 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.589 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -102.61 -45.24 5.1 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.6 -36.67 79.12 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.517 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.74 -30.58 59.25 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.972 179.164 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.632 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -80.48 -4.91 55.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.848 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.68 -38.08 26.4 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.771 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -66.86 -26.67 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.754 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.774 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.7 m-85 -66.62 -37.35 84.67 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.072 0.463 . . . . 0.0 110.12 179.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -64.57 -11.12 31.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.795 -179.782 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.69 -26.34 11.37 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 665' ' ' VAL . 19.6 t -96.28 35.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.037 0.446 . . . . 0.0 110.288 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.81 28.32 57.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.536 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HD3' ' CD1' ' A' ' 662' ' ' TYR . 12.2 mttm -116.59 18.09 15.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 111.14 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.588 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -49.71 -30.05 5.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.71 -56.76 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.09 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.05 -23.34 65.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.002 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.774 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.47 -40.82 95.89 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.174 179.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.52 -33.19 3.86 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.726 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.07 -68.29 0.37 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.481 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.679 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -59.72 -19.1 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.472 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.647 ' O ' HD23 ' A' ' 678' ' ' LEU . 1.4 tt0 -72.91 -30.02 63.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -23.57 67.48 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.271 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.441 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.22 -15.22 59.57 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.695 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.647 HD23 ' O ' ' A' ' 675' ' ' GLU . 0.5 OUTLIER -76.25 -23.78 54.52 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.875 0.369 . . . . 0.0 111.199 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.978 0.418 . . . . 0.0 111.059 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.74 ' HA ' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -127.14 18.08 7.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.495 0.664 . . . . 0.0 110.559 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.03 -35.58 4.05 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.3 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.543 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.6 tt0 -76.53 -12.38 60.02 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.279 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.543 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 1.6 m-90 -106.03 -31.88 8.54 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.804 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -79.83 -15.06 58.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.294 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.419 ' HG3' ' CD1' ' A' ' 661' ' ' TYR . 11.4 pt-20 -78.81 -34.18 45.56 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 120.723 0.297 . . . . 0.0 110.857 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.792 ' O ' HG23 ' A' ' 665' ' ' VAL . 45.9 m-85 -70.85 -47.05 61.45 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.56 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.915 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 21.9 m-85 -60.43 -35.33 75.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.194 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.821 ' HA ' HG22 ' A' ' 668' ' ' ILE . 0.1 OUTLIER -65.8 -13.8 60.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.342 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 36.3 p -118.86 -20.82 8.04 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 661' ' ' TYR . 20.2 t -93.83 32.19 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.45 24.43 56.12 Favored Glycine 0 CA--C 1.507 -0.462 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.847 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.476 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 2.3 mmpt? -116.67 19.37 14.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.072 0.463 . . . . 0.0 110.346 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.821 HG22 ' HA ' ' A' ' 663' ' ' ARG . 15.3 pt -44.16 -33.21 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.14 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -67.76 -59.92 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.168 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.33 -25.94 60.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.116 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.915 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -59.33 -38.89 81.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.13 179.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.73 -32.14 5.52 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.445 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -69.73 0.27 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.339 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.804 HD12 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -57.06 -23.51 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.029 179.364 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.41 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 1.4 mm-40 -64.88 -29.55 70.5 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.1 mtpt -69.41 -15.88 63.38 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.926 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.467 ' HB ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -73.54 -21.02 60.49 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.317 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -54.03 -29.54 44.17 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.72 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.4 tttt . . . . . 0 CA--C 1.534 0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.116 179.03 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.414 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 4.5 p90 . . . . . 0 CA--C 1.513 -0.454 0 CA-C-O 121.006 0.432 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.552 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.6 OUTLIER -84.91 23.51 1.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.073 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.645 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -112.0 -38.15 4.88 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.097 178.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.455 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.8 tt0 -65.84 -26.9 67.87 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.542 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -90.18 -35.75 15.19 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.91 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.51 -2.77 47.45 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.335 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -94.22 -42.59 8.87 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.081 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.752 ' O ' HG23 ' A' ' 665' ' ' VAL . 4.1 p90 -76.62 -15.35 59.85 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.393 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.756 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 8.6 m-85 -73.79 -30.2 62.62 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.459 ' HD2' HG13 ' A' ' 668' ' ' ILE . 6.4 mmt85 -69.94 -9.08 53.8 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.575 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 16.2 m -126.46 14.44 7.66 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.752 HG23 ' O ' ' A' ' 661' ' ' TYR . 26.0 t -132.57 34.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.221 0.534 . . . . 0.0 109.714 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.85 26.03 64.71 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.625 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.442 ' HD3' ' CE1' ' A' ' 662' ' ' TYR . 14.0 mttp -122.42 16.05 10.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 111.315 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.459 HG13 ' HD2' ' A' ' 663' ' ' ARG . 5.0 tt -51.0 -36.03 15.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -75.76 -45.97 33.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.475 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.73 -25.99 66.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.231 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.756 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -63.18 -33.22 75.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.331 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -51.96 -35.53 46.5 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.552 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.22 -67.47 0.42 Allowed 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.794 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.91 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.7 OUTLIER -59.8 -19.14 16.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.487 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.819 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 1.0 OUTLIER -65.31 -33.78 76.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.596 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -17.55 64.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.323 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.552 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.23 -11.37 57.87 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.645 ' CD1' ' HB2' ' A' ' 656' ' ' ALA . 21.8 tp -65.72 -30.95 71.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.337 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.158 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.548 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.459 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.1 p90 . . . . . 0 CA--C 1.516 -0.362 0 CA-C-O 120.917 0.389 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.413 ' OG ' ' CD2' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -85.22 20.43 1.96 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.114 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -114.23 -37.44 4.39 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.088 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.491 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.3 tt0 -66.8 -26.58 67.01 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.149 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.647 ' HB2' HD13 ' A' ' 674' ' ' ILE . 2.0 m-90 -90.53 -31.59 16.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 1.026 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.61 -6.49 58.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.847 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.25 -37.28 11.61 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.598 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.522 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.7 p90 -79.71 -17.41 53.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.449 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.781 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 6.7 m-85 -73.32 -29.45 62.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.979 0.419 . . . . 0.0 109.909 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm-85 -69.32 -9.93 55.56 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.412 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 6.2 t -116.67 -23.43 8.18 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.71 HG23 ' HB2' ' A' ' 667' ' ' LYS . 29.9 m -94.4 33.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.002 0.43 . . . . 0.0 110.353 179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 55.48 29.29 53.22 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.608 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.71 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -119.41 17.62 12.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.134 0.492 . . . . 0.0 111.185 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 4.8 tt -50.0 -30.57 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.643 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.43 -61.42 1.79 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.532 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -58.27 -24.49 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.813 0.339 . . . . 0.0 110.124 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.781 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -62.33 -29.15 70.24 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.944 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -51.32 -49.88 60.5 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.04 -65.01 0.67 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.852 0.835 . . . . 0.0 109.838 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 1.026 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -50.49 -28.88 5.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.026 -1.443 . . . . 0.0 110.776 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.51 ' CG ' ' HB1' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -71.44 -24.99 62.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.523 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -81.24 -14.98 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.874 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -26.65 56.48 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.457 ' HA ' HD12 ' A' ' 678' ' ' LEU . 12.3 tp -51.57 -29.82 18.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.999 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.1 tttt . . . . . 0 CA--C 1.533 0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.456 179.514 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.429 ' C ' ' H ' ' A' ' 656' ' ' ALA . 7.3 p90 . . . . . 0 CA--C 1.514 -0.442 0 CA-C-O 120.885 0.374 . . . . 0.0 111.621 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.564 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -79.52 22.23 0.46 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.794 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -109.43 -44.36 3.91 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.024 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -61.97 -27.02 68.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.539 ' HB3' ' CD1' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -91.2 -22.84 20.43 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.085 179.214 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.791 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -89.05 -6.09 57.39 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.6 -35.51 27.01 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.895 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.2 OUTLIER -70.99 -30.05 66.19 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.685 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.799 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.8 m-85 -63.18 -34.56 77.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.237 0.541 . . . . 0.0 109.969 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.822 ' HG3' HG23 ' A' ' 668' ' ' ILE . 0.7 OUTLIER -72.57 -1.95 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.71 -27.03 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 665' ' ' VAL . 13.2 p -97.95 35.91 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.041 0.448 . . . . 0.0 110.486 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.23 27.05 66.87 Favored Glycine 0 CA--C 1.508 -0.365 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.209 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.588 ' HD2' HG13 ' A' ' 665' ' ' VAL . 3.6 mttt -114.67 20.97 14.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.074 0.464 . . . . 0.0 110.696 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.822 HG23 ' HG3' ' A' ' 663' ' ' ARG . 5.5 mt -48.26 -32.33 3.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.371 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -39.42 28.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.495 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -25.49 62.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.799 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.53 -33.41 75.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.177 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -51.21 -31.68 21.28 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.477 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.91 -69.78 0.27 Allowed 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.437 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.791 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -58.77 -21.99 20.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.558 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -67.85 -24.67 65.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.074 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -17.6 64.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.298 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.564 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.4 OUTLIER -89.93 -1.7 58.02 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.839 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.837 ' O ' HD23 ' A' ' 678' ' ' LEU . 6.1 tt -79.72 -30.2 40.89 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.583 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.258 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.281 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.431 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.5 p90 . . . . . 0 CA--C 1.516 -0.345 0 CA-C-O 120.599 0.238 . . . . 0.0 111.545 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -80.07 23.73 0.45 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.119 0.485 . . . . 0.0 110.607 179.317 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.731 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -109.79 -44.52 3.81 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -63.26 -35.94 82.02 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.711 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -77.46 -35.22 54.05 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.52 178.74 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.867 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -71.32 -13.81 62.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.553 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.59 -38.72 54.41 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -64.53 -41.85 96.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.835 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 15.5 m-85 -57.78 -28.1 63.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.888 ' HD2' HG23 ' A' ' 668' ' ' ILE . 0.5 OUTLIER -71.44 -8.72 55.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.358 179.666 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 p -121.7 -23.76 5.46 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.651 HG23 ' CG ' ' A' ' 667' ' ' LYS . 29.7 m -92.78 31.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.831 0.348 . . . . 0.0 110.741 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.76 29.44 67.33 Favored Glycine 0 CA--C 1.506 -0.508 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.092 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.651 ' CG ' HG23 ' A' ' 665' ' ' VAL . 6.4 mmtt -119.82 18.35 12.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.1 0.476 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.888 HG23 ' HD2' ' A' ' 663' ' ' ARG . 2.2 mt -46.66 -32.75 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.564 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.5 -47.96 18.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.359 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -65.59 -24.12 67.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.165 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.835 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -62.72 -38.03 88.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.451 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -51.01 -32.07 20.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.939 0.4 . . . . 0.0 110.497 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.93 -69.26 0.31 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.542 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.867 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -57.67 -24.46 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.661 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.699 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 6.2 mt-10 -63.36 -25.38 68.27 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.699 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -5.45 44.86 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.384 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.419 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -93.25 -15.14 26.19 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.731 HD13 ' HB2' ' A' ' 656' ' ' ALA . 19.1 tp -64.64 -31.78 73.14 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.817 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 6.9 mttp . . . . . 0 C--N 1.333 -0.126 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.497 179.463 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.436 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 . . . . . 0 CA--C 1.514 -0.431 0 CA-C-O 121.023 0.44 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.488 ' OG ' ' C ' ' A' ' 677' ' ' THR . 0.3 OUTLIER -80.16 24.69 0.41 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.411 0.624 . . . . 0.0 110.719 179.752 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.436 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -110.78 -39.36 4.87 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.194 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.2 OUTLIER -68.34 -22.14 64.7 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.771 -179.778 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.572 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.1 m-90 -93.78 -36.41 12.29 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.624 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -77.79 -7.5 56.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.159 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -90.06 -46.3 8.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.15 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.572 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.4 p90 -73.88 -21.77 59.97 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.031 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.795 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.9 m-85 -66.88 -32.61 73.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.429 ' HG3' HG13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -71.93 -4.27 27.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.634 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.3 18.54 4.88 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 665' ' ' VAL . 14.8 p -136.74 32.88 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.043 0.449 . . . . 0.0 109.82 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.73 26.14 66.5 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.542 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.598 ' HB2' HG13 ' A' ' 665' ' ' VAL . 2.1 tptt -123.71 17.47 9.51 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.112 0.482 . . . . 0.0 111.18 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.429 HG13 ' HG3' ' A' ' 663' ' ' ARG . 4.8 tt -52.25 -35.35 19.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.569 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.5 -48.73 30.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.494 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -24.71 67.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.146 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.795 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.26 -37.83 88.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.49 -33.76 32.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.996 0.427 . . . . 0.0 110.534 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.12 -67.58 0.43 Allowed 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.714 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.656 HG21 ' HE2' ' A' ' 662' ' ' TYR . 0.6 OUTLIER -58.34 -22.8 20.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.275 179.546 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.512 ' CG ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -61.69 -34.24 75.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.988 178.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -74.3 -7.26 52.18 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.659 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.488 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -88.39 -19.91 25.97 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 177.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.847 HD13 ' O ' ' A' ' 678' ' ' LEU . 3.1 tm? -60.39 -28.95 68.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.564 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.189 0 CA-C-O 121.038 0.447 . . . . 0.0 110.381 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.405 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 5.6 p90 . . . . . 0 CA--C 1.515 -0.379 0 CA-C-O 120.947 0.403 . . . . 0.0 111.447 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.662 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.8 OUTLIER -82.16 22.13 0.84 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.771 179.854 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.732 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -110.63 -44.33 3.69 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.911 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -62.97 -38.19 90.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.626 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.61 -33.01 62.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.397 178.572 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.888 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -74.58 -9.07 58.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -82.0 -37.56 26.4 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 120.731 0.3 . . . . 0.0 111.011 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -64.52 -40.64 95.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.409 . . . . 0.0 110.703 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.889 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 14.5 m-85 -57.19 -28.93 63.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.795 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.456 ' HD2' HG13 ' A' ' 668' ' ' ILE . 8.2 mmt85 -73.65 -6.81 49.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.259 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.8 t -133.68 24.23 4.01 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.597 HG22 ' HA ' ' A' ' 662' ' ' TYR . 32.9 m -140.71 28.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.114 0.483 . . . . 0.0 109.975 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.5 27.01 72.09 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.764 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.508 ' HB2' HG23 ' A' ' 665' ' ' VAL . 1.2 mptt -125.7 16.02 8.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.984 0.421 . . . . 0.0 110.954 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.456 HG13 ' HD2' ' A' ' 663' ' ' ARG . 10.3 tt -48.19 -30.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.409 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -83.89 -37.05 22.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.129 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.29 -25.64 62.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.083 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.889 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -62.06 -34.12 75.68 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.397 179.272 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -52.26 -35.25 49.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.927 0.394 . . . . 0.0 110.467 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -68.3 0.37 Allowed 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.462 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.888 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -58.02 -22.58 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.718 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.788 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 2.3 mm-40 -64.58 -24.61 67.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.173 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.39 59.09 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.211 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.662 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -86.54 -15.03 41.22 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.677 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.732 HD22 ' HB2' ' A' ' 656' ' ' ALA . 21.7 tp -61.2 -31.77 71.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.291 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.157 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.449 179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.491 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 120.645 0.26 . . . . 0.0 111.672 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.5 OUTLIER -98.27 26.96 4.95 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.721 0.772 . . . . 0.0 109.753 178.803 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 1.031 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.33 -34.34 6.58 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.981 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.472 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -65.31 -37.78 88.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . . . . . . . . . 3.2 m-90 -79.89 -38.41 32.68 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.542 ' HB2' HG23 ' A' ' 674' ' ' ILE . . . -62.4 -18.97 62.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.222 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -75.32 -35.66 61.18 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 70.3 m-85 -66.49 -42.43 87.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.97 0.414 . . . . 0.0 110.843 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.791 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 22.2 m-85 -57.5 -30.53 65.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.869 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.532 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm180 -68.97 -12.59 61.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.274 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -120.84 -24.49 5.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.635 HG22 ' HA ' ' A' ' 662' ' ' TYR . 25.7 m -91.32 30.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.911 0.386 . . . . 0.0 110.617 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.84 36.6 80.66 Favored Glycine 0 CA--C 1.505 -0.564 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.217 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 12.4 mmtt -128.1 16.48 6.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.02 0.438 . . . . 0.0 111.047 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.84 -30.31 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.418 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.66 -60.96 1.98 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.065 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.87 -22.7 59.68 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.791 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -59.3 -36.38 75.49 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.132 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.58 -36.9 11.33 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.16 -69.15 0.3 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.362 0.601 . . . . 0.0 110.263 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.892 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -55.97 -23.55 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.254 179.444 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 678' ' ' LEU . 9.4 tt0 -76.6 -14.86 59.96 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.971 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -81.71 -21.8 37.75 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.907 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.505 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -73.16 -17.76 61.34 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.22 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.031 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -50.67 -37.47 41.11 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.06 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.211 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.917 178.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.443 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.7 p90 . . . . . 0 CA--C 1.515 -0.379 0 CA-C-O 120.838 0.351 . . . . 0.0 110.781 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.849 ' HA ' HD11 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -84.59 21.11 1.56 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.436 0.636 . . . . 0.0 110.388 179.12 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.52 ' HB2' HD11 ' A' ' 678' ' ' LEU . . . -112.74 -36.1 5.28 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.234 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.443 ' O ' ' CD2' ' A' ' 661' ' ' TYR . 1.4 tt0 -67.75 -34.81 77.56 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.702 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.473 ' O ' ' CD2' ' A' ' 662' ' ' TYR . 2.4 m-90 -83.09 -40.73 19.44 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.678 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -71.0 -12.49 61.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.939 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -95.37 -30.83 13.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 120.897 0.38 . . . . 0.0 110.234 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.719 ' O ' HG13 ' A' ' 665' ' ' VAL . 22.3 m-30 -79.59 -30.88 41.69 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.19 179.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.763 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 15.7 m-85 -65.85 -33.82 76.72 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.684 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 38.3 mmm-85 -68.46 -12.62 61.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.424 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.8 m -124.06 -21.16 5.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.719 HG13 ' O ' ' A' ' 661' ' ' TYR . 11.8 m -93.31 28.04 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.878 0.371 . . . . 0.0 110.735 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.25 38.15 95.73 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 121.144 -0.55 . . . . 0.0 112.498 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.493 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 6.2 mttp -133.09 18.32 4.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.123 0.487 . . . . 0.0 110.395 178.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.65 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.96 -30.15 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.418 179.356 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -77.81 -50.41 12.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.406 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.62 -17.75 65.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.763 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -64.88 -36.65 85.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.523 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.53 -33.45 31.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.821 0.344 . . . . 0.0 110.479 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.6 -68.66 0.36 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.849 HD11 ' HA ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -54.19 -24.05 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.315 179.625 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.97 73.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -74.45 -21.81 59.42 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.826 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.5 -20.98 62.8 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 656' ' ' ALA . 1.8 tp -50.17 -32.82 17.19 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.648 178.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.213 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.045 179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.457 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.2 p90 . . . . . 0 CA--C 1.512 -0.505 0 CA-C-O 120.958 0.408 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.5 ' HB3' ' N ' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -79.31 22.84 0.41 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.422 0.629 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.759 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -108.67 -37.89 5.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.057 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.496 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.1 tt0 -67.41 -22.03 65.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.809 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.558 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.5 m-90 -92.72 -34.17 14.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 109.247 178.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.829 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.26 -6.42 57.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.696 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.14 -39.93 10.31 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.326 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.558 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.5 p90 -77.72 -19.32 55.42 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.089 179.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.659 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.2 m-85 -68.21 -33.96 75.37 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.441 ' HA ' ' HB ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -61.3 -14.1 24.18 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.667 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 42.4 p -108.62 -25.27 10.97 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.806 HG13 ' HG3' ' A' ' 667' ' ' LYS . 13.4 p -95.82 34.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.26 30.59 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.911 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.806 ' HG3' HG13 ' A' ' 665' ' ' VAL . 13.7 mttt -119.6 16.65 12.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.08 0.467 . . . . 0.0 111.302 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.441 ' HB ' ' HA ' ' A' ' 663' ' ' ARG . 7.6 tt -49.69 -41.35 16.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.832 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.64 -57.85 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.507 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -22.49 64.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.399 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.659 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -66.21 -39.92 89.98 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.583 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.36 -34.2 32.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.15 -67.36 0.44 Allowed 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.363 0.601 . . . . 0.0 110.54 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.829 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -56.04 -25.31 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.36 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.792 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -60.05 -37.46 79.91 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.637 179.087 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.17 -19.09 62.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.876 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.417 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.74 -13.57 47.94 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.209 179.142 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.759 HD13 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -79.12 -22.77 44.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.859 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.906 0.384 . . . . 0.0 110.596 179.687 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.197 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.47 ' OG ' ' OG1' ' A' ' 677' ' ' THR . 0.4 OUTLIER -97.6 26.44 5.01 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.924 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -111.72 -36.74 5.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.362 178.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -30.52 70.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.128 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.55 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.2 m-90 -86.4 -34.55 20.15 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.561 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -81.45 -2.91 51.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.431 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -96.7 -42.77 7.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.925 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.55 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 2.8 p90 -75.51 -23.94 56.78 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.767 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.0 m-85 -65.47 -29.69 70.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.947 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 668' ' ' ILE . 20.8 mmm-85 -69.32 -9.98 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.563 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -118.67 -22.79 7.31 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.625 HG12 ' HA ' ' A' ' 662' ' ' TYR . 14.6 p -94.35 33.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.04 0.448 . . . . 0.0 110.53 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.77 28.61 63.29 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.923 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.617 ' HB2' HG13 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -120.17 18.16 12.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 179.673 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.543 HD13 ' C ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -51.52 -32.8 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.722 179.441 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.95 -54.36 8.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.166 179.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -22.66 66.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.083 179.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.767 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -64.42 -34.26 77.78 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.577 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -53.26 -33.16 51.95 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.874 0.368 . . . . 0.0 110.454 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.75 -69.11 0.33 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.268 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.632 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -56.8 -23.21 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.803 179.197 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 678' ' ' LEU . 43.2 tt0 -66.92 -26.8 67.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.657 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -68.06 -20.81 64.99 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.484 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.47 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.05 -15.09 52.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.648 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.924 ' CD1' ' HB2' ' A' ' 656' ' ' ALA . 10.8 tp -55.22 -37.46 67.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.195 178.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 mptt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.777 178.591 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.392 0 CA-C-O 121.015 0.436 . . . . 0.0 111.001 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.607 ' HB3' ' HG1' ' A' ' 677' ' ' THR . 0.1 OUTLIER -124.79 19.6 8.55 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.51 0.671 . . . . 0.0 110.715 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.21 -31.55 5.28 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.51 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.489 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -74.87 -24.41 58.56 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.43 -179.599 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.685 ' HB2' HD13 ' A' ' 674' ' ' ILE . 1.6 m-90 -92.69 -33.15 14.46 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 1.003 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -75.48 -13.37 60.37 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.34 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.68 -33.36 47.07 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.43 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.557 ' O ' HG22 ' A' ' 665' ' ' VAL . 59.4 m-85 -73.47 -45.44 54.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.676 0.274 . . . . 0.0 111.015 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 1.026 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 13.3 m-85 -64.43 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.946 0.403 . . . . 0.0 110.143 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.417 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.8 OUTLIER -67.51 -11.87 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.197 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 87.1 p -121.36 -24.15 5.51 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.628 HG22 ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -91.86 30.27 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.772 0.32 . . . . 0.0 110.892 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.86 29.3 70.12 Favored Glycine 0 CA--C 1.505 -0.576 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.133 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.499 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 3.6 mtpp -121.67 19.55 11.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.179 0.514 . . . . 0.0 110.27 178.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.417 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 1.5 mp -46.58 -30.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.463 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -65.62 -57.33 8.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.926 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.74 -29.25 69.99 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 1.026 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -57.14 -29.78 63.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.783 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -48.94 -49.67 39.17 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.618 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.12 -65.67 0.56 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.887 0.851 . . . . 0.0 109.713 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 1.003 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -49.35 -35.5 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.841 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.24 -27.27 67.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -76.91 -11.81 59.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.943 179.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.607 ' HG1' ' HB3' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.6 -20.88 53.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 678' ' ' LEU . 0.3 OUTLIER -52.24 -33.25 40.65 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.741 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.258 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.966 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.193 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 4.6 m -100.48 27.03 6.07 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.573 0.701 . . . . 0.0 109.644 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.684 ' HB2' HD23 ' A' ' 678' ' ' LEU . . . -108.72 -38.66 5.58 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.789 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.443 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.8 OUTLIER -59.15 -29.44 67.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.487 -179.61 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 2.0 m-90 -88.54 -33.55 17.69 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 1.002 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -67.57 -24.17 65.48 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.493 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -33.09 72.77 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.782 0.325 . . . . 0.0 111.59 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.835 ' O ' HG23 ' A' ' 665' ' ' VAL . 62.8 m-85 -66.8 -46.86 73.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.893 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 23.9 m-85 -56.8 -30.88 64.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.942 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 10.2 mmm180 -61.38 -22.04 64.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.631 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.5 m -117.2 -16.14 10.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.824 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.835 HG23 ' O ' ' A' ' 661' ' ' TYR . 18.5 t -92.53 27.41 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.814 0.34 . . . . 0.0 110.297 179.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.19 29.34 62.65 Favored Glycine 0 CA--C 1.505 -0.571 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.794 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.418 ' C ' ' HB3' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -124.48 14.94 8.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.091 0.472 . . . . 0.0 110.954 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 5.4 tt -44.95 -31.87 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.566 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -70.14 -62.42 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.193 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.53 -23.99 53.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.893 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -60.63 -26.62 67.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.489 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -49.36 -44.49 44.78 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -59.5 -67.14 0.41 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.495 0.664 . . . . 0.0 109.896 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 1.002 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -51.03 -32.26 11.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.331 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 12.2 tt0 -72.49 -10.78 60.21 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.881 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.35 -13.63 37.44 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.607 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.474 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.19 -17.61 36.59 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 177.732 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.684 HD23 ' HB2' ' A' ' 656' ' ' ALA . 3.3 tm? -55.74 -34.66 65.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.41 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.853 178.464 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.46 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.9 OUTLIER . . . . . 0 CA--C 1.515 -0.398 0 CA-C-O 120.914 0.388 . . . . 0.0 110.804 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.42 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.2 OUTLIER -83.86 19.39 1.73 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 110.394 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.605 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -113.66 -43.46 3.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.934 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -63.28 -34.86 78.61 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.5 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -80.23 -29.8 38.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.159 179.435 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.909 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -79.22 -13.36 59.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.189 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 663' ' ' ARG . 22.3 mt-10 -76.23 -36.7 58.42 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -67.53 -23.42 65.44 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.263 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.803 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.0 m-85 -67.76 -58.07 5.25 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.062 0.458 . . . . 0.0 110.588 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.608 ' CB ' HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -60.02 -7.65 1.9 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.812 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.1 m -90.96 -35.92 14.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.699 0.285 . . . . 0.0 111.368 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 665' ' ' VAL . 22.3 t -99.36 37.06 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.095 0.474 . . . . 0.0 110.127 179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.69 26.33 68.41 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.647 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.95 19.69 20.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 0.0 110.727 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.608 HG22 ' CB ' ' A' ' 663' ' ' ARG . 22.5 pt -45.85 -37.93 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.806 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . 0.435 ' N ' HG13 ' A' ' 668' ' ' ILE . 9.4 tt0 -67.25 -58.12 5.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -60.06 -23.0 63.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.684 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.803 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -67.73 -38.3 83.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.72 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -52.3 -32.85 39.55 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.954 0.406 . . . . 0.0 110.499 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.64 -67.7 0.41 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.874 179.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.909 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -61.47 -19.54 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.912 179.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.739 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 2.5 mt-10 -68.59 -27.1 65.75 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -71.5 -13.41 61.8 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.228 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.65 -23.24 56.27 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.041 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.605 HD22 ' HB2' ' A' ' 656' ' ' ALA . 12.7 tp -51.59 -30.04 19.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.049 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt . . . . . 0 CA--C 1.534 0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.565 179.485 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.417 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.4 p90 . . . . . 0 CA--C 1.514 -0.423 0 CA-C-O 120.693 0.282 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.522 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -76.72 11.66 1.61 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.186 0.517 . . . . 0.0 110.63 179.246 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.794 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -92.51 -44.21 8.75 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -32.81 70.98 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.676 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -82.21 -23.52 35.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.044 179.017 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.879 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -89.09 0.07 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.45 -39.24 16.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.548 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -70.29 -30.21 67.17 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.715 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.849 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.4 m-85 -62.81 -35.49 80.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.13 0.49 . . . . 0.0 109.956 178.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.731 ' HA ' HG22 ' A' ' 668' ' ' ILE . 2.6 mpt_? -71.11 -2.76 16.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.935 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.6 m -109.93 -28.9 8.51 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.673 HG23 ' HB2' ' A' ' 667' ' ' LYS . 4.7 m -97.57 36.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.024 0.44 . . . . 0.0 110.311 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.7 27.08 61.02 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.569 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.673 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.3 OUTLIER -111.31 19.41 18.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.04 0.448 . . . . 0.0 110.864 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.731 HG22 ' HA ' ' A' ' 663' ' ' ARG . 24.3 pt -47.18 -35.25 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.539 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -70.54 -49.57 46.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.765 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.68 -29.71 70.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.537 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.849 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.81 -33.27 75.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.187 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.528 ' HA ' ' HG2' ' A' ' 675' ' ' GLU . 2.8 mt-10 -58.93 -22.18 59.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.132 -179.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -81.8 -61.47 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.44 0.638 . . . . 0.0 110.319 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.879 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.8 OUTLIER -62.5 -25.51 38.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.047 -179.567 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.704 ' HB3' ' CB ' ' A' ' 659' ' ' ALA . 1.5 pp20? -69.82 -29.52 66.82 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.276 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -24.1 12.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.856 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.86 -20.22 59.83 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.556 179.387 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.794 HD22 ' HB2' ' A' ' 656' ' ' ALA . 1.1 pp -73.54 -19.56 60.88 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.109 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 pttt . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.821 0.343 . . . . 0.0 111.548 -179.898 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.276 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.572 ' HB2' ' HB ' ' A' ' 677' ' ' THR . 0.1 OUTLIER -100.33 23.0 10.72 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.494 0.664 . . . . 0.0 110.336 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -108.9 -37.67 5.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.289 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.456 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.1 OUTLIER -64.78 -28.9 69.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.543 -179.745 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.542 ' HB2' HD13 ' A' ' 674' ' ' ILE . 1.7 m-90 -88.37 -29.46 20.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 1.065 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -79.48 -7.18 58.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.443 179.004 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.17 -44.32 9.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.506 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.79 ' O ' HG23 ' A' ' 665' ' ' VAL . 3.8 p90 -74.6 -18.83 60.51 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.691 179.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.767 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.9 m-85 -72.07 -29.72 64.41 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.396 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 1.012 ' HA ' HG22 ' A' ' 668' ' ' ILE . 5.8 mmt180 -66.9 -10.06 44.64 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.374 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.18 -22.24 6.69 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.44 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 661' ' ' TYR . 18.7 t -92.65 31.94 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.899 0.38 . . . . 0.0 110.391 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.33 27.17 52.57 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.577 -179.168 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.448 ' HB2' ' CD1' ' A' ' 662' ' ' TYR . 2.4 mttt -115.37 16.73 16.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.111 0.481 . . . . 0.0 110.968 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 1.012 HG22 ' HA ' ' A' ' 663' ' ' ARG . 12.9 pt -47.25 -38.46 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.0 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.17 -64.34 0.91 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.578 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.42 -23.67 50.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.382 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.767 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.8 -31.37 72.52 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -50.01 -51.12 44.43 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.806 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -58.07 -62.47 1.8 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.741 0.781 . . . . 0.0 109.895 178.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 1.065 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -51.96 -25.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.342 179.835 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.564 ' HA ' HD23 ' A' ' 678' ' ' LEU . 2.8 tt0 -76.14 -11.76 59.99 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.233 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.1 -10.73 40.91 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.696 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.572 ' HB ' ' HB2' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.81 -22.09 22.27 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.202 178.833 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.564 HD23 ' HA ' ' A' ' 675' ' ' GLU . 3.8 pp -65.3 -25.96 67.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.812 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 CA--C 1.532 0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 178.562 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.522 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 . . . . . 0 CA--C 1.511 -0.528 0 CA-C-O 120.815 0.34 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.787 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -74.74 20.2 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.168 0.508 . . . . 0.0 110.346 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 1.04 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -103.04 -42.58 5.75 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.07 178.781 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -48.34 77.52 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.504 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -72.45 -10.53 59.91 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.704 178.449 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.919 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -86.23 -19.51 29.87 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.319 -179.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.43 -20.19 48.12 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.174 -0.611 . . . . 0.0 110.62 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.848 ' O ' HG22 ' A' ' 665' ' ' VAL . 71.8 m-85 -86.73 -14.13 43.32 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.616 178.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.919 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -72.64 -35.01 67.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.301 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.865 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -82.09 10.91 5.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.374 179.977 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -128.03 -33.08 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.879 HG23 ' HG2' ' A' ' 667' ' ' LYS . 27.5 m -93.82 32.54 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.29 32.58 84.21 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.879 ' HG2' HG23 ' A' ' 665' ' ' VAL . 29.5 mmtm -113.15 20.57 16.15 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.017 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 663' ' ' ARG . 2.1 mp -51.57 -25.63 5.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.127 179.684 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.22 -54.49 4.18 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.657 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 8.2 mt-10 -61.11 -18.42 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 177.048 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.812 ' HB1' ' CE1' ' A' ' 662' ' ' TYR . . . -53.1 -48.96 67.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.106 179.277 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.94 -19.27 6.34 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.599 -179.719 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -82.13 -58.24 3.04 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 120.778 0.323 . . . . 0.0 111.451 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.685 HG23 ' HD2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -76.53 -3.63 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.05 179.807 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.469 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 20.5 tt0 -87.52 -26.54 23.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.856 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -80.11 -11.35 59.77 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.534 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -26.73 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.972 0.415 . . . . 0.0 110.093 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.04 HD13 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -70.04 -21.47 63.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.361 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.54 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 . . . . . 0 CA--C 1.509 -0.624 0 CA-C-O 120.82 0.343 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.722 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -77.07 26.5 0.15 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.538 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.931 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.81 -42.5 4.24 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.329 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -63.59 -38.87 92.78 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.141 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.508 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -83.39 -14.54 52.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.703 178.465 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.877 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -83.98 -21.33 31.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -76.27 -20.5 57.3 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.95 179.441 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.851 ' O ' HG22 ' A' ' 665' ' ' VAL . 19.7 m-85 -84.89 -11.4 55.68 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.367 179.557 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.877 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.38 -34.9 41.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.139 179.386 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.831 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -81.83 9.51 7.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.372 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.81 -32.13 3.1 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.851 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.851 HG22 ' O ' ' A' ' 661' ' ' TYR . 35.0 m -96.89 35.37 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.961 0.41 . . . . 0.0 110.536 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.84 31.79 72.9 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.498 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.697 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -106.39 16.62 24.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.907 0.384 . . . . 0.0 111.45 -179.637 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.793 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -52.13 -24.12 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.991 -179.602 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -85.73 -59.48 2.3 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 0.3 OUTLIER -59.59 -19.3 47.82 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.156 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.736 ' HB1' ' CE1' ' A' ' 662' ' ' TYR . . . -51.26 -47.63 62.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.886 178.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -53.54 -19.43 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.393 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -79.13 -61.15 2.1 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.638 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -76.82 -5.01 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.986 179.731 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.471 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 68.4 tt0 -86.05 -25.36 25.94 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.632 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 4.7 mtpt -74.36 -19.47 60.43 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.787 179.4 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.05 -16.67 52.6 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.931 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -60.31 -39.51 87.26 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.966 178.868 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.781 179.826 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.458 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.343 0 CA-C-O 120.981 0.42 . . . . 0.0 111.214 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.613 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -126.04 20.82 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.629 0.728 . . . . 0.0 109.886 179.127 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.438 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -115.17 -37.43 4.1 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.16 178.732 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.519 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 2.6 tp60 -74.41 -36.84 63.47 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.401 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.519 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 2.7 m-90 -83.63 -21.32 32.55 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.989 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.813 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -71.87 -22.2 61.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.796 -179.583 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -80.69 -13.86 58.64 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.165 179.231 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.862 ' O ' HG22 ' A' ' 665' ' ' VAL . 91.1 m-85 -91.95 -14.31 29.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.422 178.833 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.825 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -74.65 -37.16 62.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.114 179.6 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.825 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.03 11.23 5.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.481 179.996 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 t -127.05 -34.96 2.29 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.862 HG22 ' O ' ' A' ' 661' ' ' TYR . 33.8 m -95.56 34.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.926 0.393 . . . . 0.0 110.473 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.17 31.9 74.63 Favored Glycine 0 CA--C 1.507 -0.447 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.527 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.643 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.29 18.75 21.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 111.37 179.957 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 9.6 tt -50.14 -27.07 3.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -86.51 -51.64 6.06 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . 0.537 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 0.0 OUTLIER -62.57 -18.6 62.42 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 177.207 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.723 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -53.21 -47.98 68.48 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.059 179.126 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -52.52 -19.83 2.53 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.912 179.827 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -75.28 -67.26 0.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.832 0.348 . . . . 0.0 111.553 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.696 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -71.81 -13.0 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 22.4 tt0 -79.28 -27.36 42.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.05 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.55 -8.27 59.61 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.691 179.029 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.475 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.86 -23.12 33.81 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 178.017 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.438 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -52.51 -34.05 47.81 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.613 179.052 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.256 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.372 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.465 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.1 p90 . . . . . 0 CA--C 1.513 -0.469 0 CA-C-O 120.76 0.314 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.702 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.52 26.61 0.29 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.177 179.162 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.499 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -112.13 -46.22 3.22 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.038 178.705 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.05 -38.79 86.46 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.464 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -86.97 5.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.937 178.553 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.909 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -104.29 -19.11 14.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.91 178.638 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -77.35 -22.0 52.44 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.378 178.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.863 ' O ' HG22 ' A' ' 665' ' ' VAL . 66.9 m-85 -82.72 -13.75 55.8 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.236 179.304 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.909 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -75.92 -37.23 58.96 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.363 179.49 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.865 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.54 10.74 6.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.609 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.12 -32.73 2.96 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.863 HG22 ' O ' ' A' ' 661' ' ' TYR . 34.7 m -97.99 36.08 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.984 0.421 . . . . 0.0 110.416 179.688 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.05 31.5 72.93 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.561 -179.374 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -106.97 17.87 22.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.891 0.377 . . . . 0.0 111.487 -179.783 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.47 -29.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.395 -179.88 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -83.34 -51.36 7.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . 0.41 ' HB3' ' HG2' ' A' ' 667' ' ' LYS . 8.4 tt0 -63.0 -18.41 63.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.63 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.696 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -55.47 -43.77 75.83 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.736 178.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -47.35 -31.83 4.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.48 -179.711 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -76.38 -51.94 10.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 111.16 179.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.734 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -72.82 -18.28 18.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.62 -179.035 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 671' ' ' ALA . 0.7 OUTLIER -86.03 -21.16 27.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 110.309 178.913 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -79.55 -16.0 56.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.85 179.516 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.432 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.56 -3.28 58.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.991 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 656' ' ' ALA . 1.1 tt -80.18 -24.26 40.45 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.487 179.182 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.348 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.625 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.497 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 . . . . . 0 CA--C 1.511 -0.54 0 CA-C-O 120.821 0.344 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.803 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -76.67 19.85 0.26 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.237 0.542 . . . . 0.0 110.329 178.978 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -100.35 -44.34 5.95 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.025 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -64.93 -39.75 93.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.592 ' C ' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -85.75 8.95 17.93 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.795 178.365 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.903 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -104.46 -25.29 12.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.836 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -73.74 -16.86 61.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.211 178.573 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.837 ' O ' HG22 ' A' ' 665' ' ' VAL . 20.1 m-30 -85.21 -17.41 37.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.017 179.123 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.903 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -71.84 -36.6 70.22 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.264 -0.575 . . . . 0.0 110.588 179.606 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.84 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 2.8 ptt180 -77.84 5.28 9.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.48 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 91.6 p -128.67 -30.97 2.26 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.847 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 661' ' ' TYR . 18.6 m -94.29 33.59 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.888 0.375 . . . . 0.0 110.517 179.602 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.56 32.14 72.64 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.788 -179.337 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.699 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 2.6 ttpt -112.13 19.13 18.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.907 0.384 . . . . 0.0 111.295 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.458 ' O ' HD12 ' A' ' 668' ' ' ILE . 2.3 tp -51.5 -32.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -82.48 -50.02 9.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.059 179.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . 0.416 ' HB2' ' HG2' ' A' ' 667' ' ' LYS . 0.3 OUTLIER -64.48 -17.07 63.52 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 177.295 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.749 ' HA ' HG23 ' A' ' 674' ' ' ILE . . . -54.88 -44.99 74.59 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.672 179.018 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -45.79 -35.73 4.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.622 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.76 15.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.549 0.69 . . . . 0.0 110.904 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 671' ' ' ALA . 0.1 OUTLIER -71.92 -10.92 14.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.675 -179.253 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.587 ' OE2' HD21 ' A' ' 678' ' ' LEU . 2.0 tm-20 -94.91 -13.44 25.41 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.746 0.308 . . . . 0.0 110.648 178.76 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.83 -8.42 40.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.777 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.423 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -87.67 -27.27 22.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.32 179.332 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.587 HD21 ' OE2' ' A' ' 675' ' ' GLU . 3.7 pp -70.25 -20.51 63.06 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.009 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 13.5 mttm . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.934 0.397 . . . . 0.0 110.636 179.752 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.49 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.8 p90 . . . . . 0 CA--C 1.51 -0.57 0 CA-C-O 120.799 0.333 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.562 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -78.98 26.09 0.26 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.791 178.899 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.661 ' HB2' ' CD2' ' A' ' 678' ' ' LEU . . . -108.87 -41.21 4.81 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.643 178.461 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.476 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 2.8 tt0 -60.94 -49.46 77.38 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.587 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -73.0 -5.24 37.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.181 177.531 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.716 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . . . -106.72 9.36 31.18 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.497 178.467 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -109.9 -34.24 6.49 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.643 178.375 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 658' ' ' TRP . 20.9 p90 -100.6 13.0 36.17 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.025 177.573 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.969 ' CZ ' ' HB1' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -102.98 -26.21 13.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.757 177.996 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.775 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -81.69 -0.56 43.31 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.715 178.924 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 t -124.31 -19.56 5.47 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.604 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.59 HG22 ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -93.65 28.51 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 111.343 179.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 78.5 10.23 86.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.922 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.682 ' O ' ' HB2' ' A' ' 671' ' ' ALA . 5.0 mmmt -105.32 20.75 18.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.003 0.401 . . . . 0.0 110.814 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' A' ' 671' ' ' ALA . 2.3 tp -55.99 -39.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.01 -179.627 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -75.18 -56.92 4.24 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.628 -0.429 . . . . 0.0 109.902 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.08 -16.43 59.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.788 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.969 ' HB1' ' CZ ' ' A' ' 662' ' ' TYR . . . -60.33 -41.25 93.14 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.125 179.253 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -49.49 -25.34 2.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.404 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -72.62 -62.39 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.766 HG23 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -70.03 -7.1 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.909 179.494 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 5.1 tm-20 -75.83 -32.24 59.72 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.482 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -75.1 -4.13 36.78 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.69 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.562 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.7 OUTLIER -96.21 -13.34 23.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.552 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.702 HD22 ' O ' ' A' ' 678' ' ' LEU . 1.2 tm? -75.68 -26.58 57.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.27 179.379 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? . . . . . 0 C--O 1.232 0.169 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.016 179.99 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.483 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.625 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.3 OUTLIER -94.8 26.24 3.66 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 121.147 0.498 . . . . 0.0 110.254 178.937 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . . . -110.17 -38.57 5.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.536 178.817 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.436 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 7.9 tt0 -67.13 -39.11 86.55 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.677 -179.556 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.436 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 3.6 m-90 -84.6 -20.64 31.1 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.727 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -74.31 -35.59 63.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -179.425 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -76.31 -3.67 38.0 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.837 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 1.017 ' O ' HG23 ' A' ' 665' ' ' VAL . 21.8 m-85 -94.98 -34.94 12.17 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.79 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.3 OUTLIER -56.18 -39.26 72.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.655 179.196 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.79 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 3.1 ptm85 -62.09 -8.2 5.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.689 -179.557 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.97 -18.58 1.81 Allowed 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 1.017 HG23 ' O ' ' A' ' 661' ' ' TYR . 7.5 t -89.76 19.19 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.606 0.241 . . . . 0.0 110.469 179.181 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.52 29.22 74.44 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.504 -0.855 . . . . 0.0 111.199 -178.763 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.715 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.7 OUTLIER -114.8 14.46 17.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 179.582 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.76 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -49.03 -25.81 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.031 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -86.39 -56.91 3.22 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.662 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . 0.507 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 1.1 tp10 -62.24 -15.99 50.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 176.612 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.731 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -50.48 -47.03 57.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.678 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -51.16 -21.67 2.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.986 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -74.89 -67.55 0.63 Allowed 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.027 0.442 . . . . 0.0 111.456 179.47 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -67.84 -13.16 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -80.4 -24.21 39.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.258 178.502 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -82.05 -15.77 52.41 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.586 179.943 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.505 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.93 -16.39 47.56 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.925 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.446 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -55.88 -33.8 64.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.284 178.137 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.235 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.316 178.754 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 654' ' ' TYR . . . . . 0.488 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 655' ' ' SER . . . . . 0.587 ' OG ' HG12 ' A' ' 674' ' ' ILE . 0.4 OUTLIER -96.55 24.49 5.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.145 178.958 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 656' ' ' ALA . . . . . 0.538 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.16 -41.96 4.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.771 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 657' ' ' GLN . . . . . 0.47 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.7 OUTLIER -66.25 -31.21 71.89 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.221 -179.944 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 658' ' ' TRP . . . . . 0.587 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 1.7 m-90 -87.14 -20.07 27.57 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 177.462 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 659' ' ' ALA . . . . . 0.756 ' O ' ' CE1' ' A' ' 662' ' ' TYR . . . -89.93 5.42 46.5 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.317 179.527 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.35 -12.2 13.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.99 178.273 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 661' ' ' TYR . . . . . 0.611 ' O ' HG22 ' A' ' 665' ' ' VAL . 1.6 p90 -111.72 1.11 16.53 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.725 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 662' ' ' TYR . . . . . 0.853 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -95.64 -27.04 15.5 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.36 179.334 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 663' ' ' ARG . . . . . 0.853 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 19.4 mtp180 -81.54 -1.41 46.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.563 178.847 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.6 m -119.9 -26.0 5.71 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.755 -179.52 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 665' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 661' ' ' TYR . 24.1 m -92.73 31.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 67.0 23.52 72.86 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.318 -179.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 671' ' ' ALA . 0.4 OUTLIER -107.83 15.59 24.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.773 0.32 . . . . 0.0 111.261 179.665 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 668' ' ' ILE . . . . . 0.411 HG13 ' HA ' ' A' ' 663' ' ' ARG . 2.8 mt -51.5 -32.26 13.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.197 -179.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -79.89 -59.67 2.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.223 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -61.9 -16.41 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.592 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 671' ' ' ALA . . . . . 0.826 ' HB1' ' CZ ' ' A' ' 662' ' ' TYR . . . -58.87 -40.88 85.66 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.034 179.158 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -48.87 -23.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.616 -0.433 . . . . 0.0 111.194 179.308 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -70.8 -68.35 0.44 Allowed 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 674' ' ' ILE . . . . . 0.696 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -68.0 -8.81 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.503 -0.479 . . . . 0.0 109.834 179.93 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 675' ' ' GLU . . . . . 0.455 ' HB2' ' OH ' ' A' ' 662' ' ' TYR . 16.5 tm-20 -77.0 -29.89 55.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.05 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -9.32 58.69 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.398 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 677' ' ' THR . . . . . 0.486 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -91.06 -15.94 28.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.87 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.538 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.6 OUTLIER -59.53 -33.55 71.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.277 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt . . . . . 0 CA--C 1.531 0.23 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.551 178.859 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.489 -0.245 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . 0.448 ' HB3' ' CB ' ' A' ' 680' ' ' ASN . . . -69.47 -79.14 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.898 0.38 . . . . 0.0 111.112 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.516 ' OD1' HD13 ' A' ' 678' ' ' LEU . 21.1 t70 63.32 100.57 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.765 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.477 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 -133.32 -53.71 0.9 Allowed 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.163 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.4 OUTLIER -76.15 19.21 0.24 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.636 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.765 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -104.18 -42.05 5.63 Favored 'General case' 0 CA--C 1.506 -0.712 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -58.83 -38.9 79.7 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.571 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.57 -35.94 60.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.8 179.086 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.667 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -71.05 -16.04 62.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.567 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -72.02 -37.97 69.66 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.257 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.702 ' O ' HG23 ' A' ' 665' ' ' VAL . 32.1 m-85 -62.65 -46.07 89.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.888 0.375 . . . . 0.0 110.753 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.786 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 10.0 m-85 -54.86 -28.83 53.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.601 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 7.3 mmt85 -63.24 -20.08 65.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.877 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -119.03 -15.6 9.25 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 661' ' ' TYR . 20.4 t -91.71 25.83 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.858 0.361 . . . . 0.0 110.341 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.96 27.88 65.28 Favored Glycine 0 CA--C 1.505 -0.546 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.72 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.478 ' HB3' ' CD1' ' A' ' 662' ' ' TYR . 3.0 mttt -124.36 16.24 9.0 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.94 0.4 . . . . 0.0 110.825 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.604 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.16 -31.58 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.214 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.32 -60.04 2.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.931 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -22.64 57.3 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.786 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.62 -32.27 72.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.352 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -52.44 -36.12 53.87 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.943 0.402 . . . . 0.0 110.489 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.56 -67.95 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.317 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.767 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -59.6 -17.58 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.712 179.436 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.563 ' O ' HD23 ' A' ' 678' ' ' LEU . 72.7 tt0 -78.79 -26.13 44.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.368 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -71.6 -19.14 62.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.309 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.431 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -76.21 -23.47 54.61 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.729 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.765 HD22 ' HB2' ' A' ' 656' ' ' ALA . 0.9 OUTLIER -68.36 -28.49 67.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.126 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -48.53 92.46 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.102 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.448 ' CB ' ' HB3' ' A' ' 652' ' ' ALA . 2.6 t30 -122.06 52.37 1.28 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.801 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -104.39 -41.75 5.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.88 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -63.8 -57.29 10.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.863 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.1 0 N-CA-C 112.547 -0.221 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . 0.423 ' HB1' ' HB3' ' A' ' 680' ' ' ASN . . . 66.42 103.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.976 0.417 . . . . 0.0 111.006 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.471 ' HA ' ' CD2' ' A' ' 678' ' ' LEU . 5.0 p-10 -153.97 92.6 1.56 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.545 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.478 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 -116.53 -53.24 2.53 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.578 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.608 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.7 OUTLIER -77.26 23.46 0.2 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.34 0.591 . . . . 0.0 110.685 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.634 ' HB2' ' CD2' ' A' ' 678' ' ' LEU . . . -108.38 -37.1 6.07 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.23 -0.896 . . . . 0.0 108.875 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.457 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -63.0 -34.32 77.31 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.399 -0.818 . . . . 0.0 110.993 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.498 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . 2.4 m-90 -84.04 -35.43 23.83 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.5 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -67.16 -18.78 65.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.84 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -70.56 -43.79 68.75 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-O 121.001 0.429 . . . . 0.0 110.749 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.586 ' O ' HG22 ' A' ' 665' ' ' VAL . 71.8 m-85 -62.64 -48.89 77.37 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.818 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 13.8 m-85 -54.18 -37.61 64.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.675 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.787 ' HG3' HG23 ' A' ' 668' ' ' ILE . 1.1 mpt_? -68.98 -9.73 53.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.684 -179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 4.2 m -122.04 -22.86 5.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.586 HG22 ' O ' ' A' ' 661' ' ' TYR . 35.6 m -93.44 31.65 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.85 0.357 . . . . 0.0 110.715 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.87 28.11 65.41 Favored Glycine 0 CA--C 1.506 -0.505 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.037 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.581 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -120.04 19.64 12.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.201 0.524 . . . . 0.0 110.444 179.151 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.787 HG23 ' HG3' ' A' ' 663' ' ' ARG . 1.4 mp -47.83 -32.01 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.611 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -70.28 -60.75 2.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.308 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -59.14 -22.19 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.136 178.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.818 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.9 -37.85 86.17 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.207 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.09 -30.89 7.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.825 0.345 . . . . 0.0 110.476 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.78 -69.81 0.28 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.185 0.517 . . . . 0.0 110.484 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.638 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -62.2 -17.51 18.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.27 179.471 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -76.2 -28.96 57.45 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -73.13 -9.97 59.29 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.147 179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.542 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.2 OUTLIER -91.26 -9.51 44.9 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.716 HD13 ' O ' ' A' ' 678' ' ' LEU . 3.4 tm? -73.03 -29.91 63.35 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.428 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.7 tptp -59.92 76.84 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.876 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.494 ' N ' ' O ' ' A' ' 678' ' ' LEU . 8.8 t-20 -105.5 88.77 2.92 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.822 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 17.9 mttp -148.72 31.62 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -111.39 108.33 17.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.825 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 48.9 t30 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.937 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -127.44 -44.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.46 100.12 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.779 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.505 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.8 p90 -126.16 -54.43 1.49 Allowed 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.154 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.632 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -75.26 21.22 0.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.705 179.551 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.92 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -105.93 -42.29 5.17 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.76 -0.829 . . . . 0.0 108.76 178.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -61.12 -37.3 82.31 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.592 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.55 -36.52 63.1 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.825 179.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.818 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -71.16 -13.05 61.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.663 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.38 -38.04 63.26 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.956 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.864 ' O ' HG23 ' A' ' 665' ' ' VAL . 35.5 m-85 -65.38 -50.52 65.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.859 0.361 . . . . 0.0 110.372 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.815 ' CE2' HG21 ' A' ' 674' ' ' ILE . 16.3 m-85 -52.87 -32.91 47.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.32 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.959 ' HA ' HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -66.29 -12.06 54.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.297 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 5.1 p -134.91 20.04 3.49 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.826 0.346 . . . . 0.0 111.62 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.864 HG23 ' O ' ' A' ' 661' ' ' TYR . 22.0 t -128.56 22.81 2.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.808 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.71 24.69 72.79 Favored Glycine 0 CA--C 1.504 -0.612 0 C-N-CA 120.778 -0.725 . . . . 0.0 111.493 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.426 ' HB3' ' CB ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -124.15 15.7 9.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.232 0.539 . . . . 0.0 110.643 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.959 HG22 ' HA ' ' A' ' 663' ' ' ARG . 10.0 pt -45.59 -33.81 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.559 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -67.98 -61.95 1.63 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.307 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . 0.4 ' HB3' ' CG ' ' A' ' 667' ' ' LYS . 3.0 tm-20 -58.37 -22.35 53.39 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.809 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -63.94 -35.73 81.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.476 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.07 -39.55 59.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.837 0.351 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.87 -63.2 1.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.416 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.818 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -61.8 -13.79 10.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.805 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.549 ' HG2' HD23 ' A' ' 678' ' ' LEU . 2.4 tm-20 -82.35 -27.89 31.9 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 110.486 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.3 tptm -76.74 -10.33 59.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.126 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.632 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -80.2 -25.14 39.81 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.008 178.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.92 HD22 ' HB2' ' A' ' 656' ' ' ALA . 2.4 pp -60.91 -27.95 68.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.717 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.7 tttt -59.57 82.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.559 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.437 ' N ' ' O ' ' A' ' 678' ' ' LEU . 0.4 OUTLIER -68.56 -67.71 0.45 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.064 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.64 159.92 19.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 47.1 mm-40 59.9 168.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.799 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 17.3 t30 . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.979 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -71.75 -78.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.839 0.352 . . . . 0.0 111.061 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.718 ' OD2' ' HB3' ' A' ' 656' ' ' ALA . 13.9 t70 64.23 100.87 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.843 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.485 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.6 p90 -126.76 -49.61 1.49 Allowed 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.189 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.608 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -77.75 25.63 0.2 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.543 0.687 . . . . 0.0 110.32 179.297 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.718 ' HB3' ' OD2' ' A' ' 653' ' ' ASP . . . -109.19 -36.63 5.99 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.447 ' NE2' ' CZ3' ' A' ' 658' ' ' TRP . 10.0 tt0 -63.22 -29.81 71.07 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.643 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.518 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -87.47 -35.09 18.43 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.73 ' HB2' HG23 ' A' ' 674' ' ' ILE . . . -77.06 -8.63 57.78 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.098 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -88.11 -47.59 8.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.285 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.1 p90 -72.84 -21.95 60.87 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.199 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.783 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.2 m-85 -67.44 -32.72 73.78 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.829 ' HG3' HG23 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -67.4 -8.16 30.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.758 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.0 m -116.38 -22.73 8.65 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.527 HG23 ' HG3' ' A' ' 667' ' ' LYS . 31.2 m -96.44 35.42 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.982 0.42 . . . . 0.0 110.398 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.03 23.2 56.86 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.777 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.527 ' HG3' HG23 ' A' ' 665' ' ' VAL . 0.6 OUTLIER -111.87 19.0 18.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.001 0.429 . . . . 0.0 110.656 179.636 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.829 HG23 ' HG3' ' A' ' 663' ' ' ARG . 3.3 mt -49.21 -42.02 14.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.941 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -68.22 -54.74 15.62 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.471 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -23.25 66.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.433 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.783 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -65.23 -43.04 92.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.426 179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -47.87 -35.22 10.03 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.745 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.74 -67.74 0.4 Allowed 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.317 0.58 . . . . 0.0 110.3 179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.73 HG23 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -55.0 -31.52 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.924 179.676 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.485 ' CD ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -60.31 -32.69 71.46 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.949 179.07 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -63.16 -23.19 67.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.626 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.418 ' O ' ' CZ ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -80.9 -16.7 52.9 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.386 179.146 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.669 ' O ' HD12 ' A' ' 678' ' ' LEU . 0.2 OUTLIER -75.12 -23.29 57.86 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.1 mttp -67.17 66.84 0.07 Allowed 'General case' 0 CA--C 1.528 0.11 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.461 ' N ' ' O ' ' A' ' 678' ' ' LEU . 29.1 t-20 -65.77 131.54 46.56 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.074 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -164.7 155.0 14.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.829 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -126.5 -178.68 4.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 1.2 t30 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.892 179.955 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.146 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -147.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.897 0.38 . . . . 0.0 111.106 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.43 102.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.652 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.456 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.4 p90 -134.42 -50.58 0.8 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.287 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.645 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -75.96 17.33 0.34 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.938 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.589 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -102.61 -45.24 5.1 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.6 -36.67 79.12 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.517 ' HB3' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.74 -30.58 59.25 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.972 179.164 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.632 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -80.48 -4.91 55.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.256 -0.429 . . . . 0.0 109.848 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -81.68 -38.08 26.4 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.771 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -66.86 -26.67 67.01 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.754 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.774 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.7 m-85 -66.62 -37.35 84.67 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.072 0.463 . . . . 0.0 110.12 179.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -64.57 -11.12 31.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.795 -179.782 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.69 -26.34 11.37 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 665' ' ' VAL . 19.6 t -96.28 35.17 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.037 0.446 . . . . 0.0 110.288 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.81 28.32 57.13 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.696 -0.764 . . . . 0.0 111.536 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HD3' ' CD1' ' A' ' 662' ' ' TYR . 12.2 mttm -116.59 18.09 15.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 111.14 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.588 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -49.71 -30.05 5.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.609 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.71 -56.76 4.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.09 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.05 -23.34 65.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.002 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.774 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -61.47 -40.82 95.89 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.174 179.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.52 -33.19 3.86 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.726 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.07 -68.29 0.37 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.481 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.679 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -59.72 -19.1 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.472 179.534 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.647 ' O ' HD23 ' A' ' 678' ' ' LEU . 1.4 tt0 -72.91 -30.02 63.59 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -23.57 67.48 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.271 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.441 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -77.22 -15.22 59.57 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.695 179.524 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.647 HD23 ' O ' ' A' ' 675' ' ' GLU . 0.5 OUTLIER -76.25 -23.78 54.52 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.889 179.732 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.54 -32.03 0.51 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.875 0.369 . . . . 0.0 111.199 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 47.74 83.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.287 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -163.83 -69.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.98 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -106.85 162.77 13.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.945 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.865 179.966 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -148.15 -61.1 0.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.995 0.426 . . . . 0.0 111.186 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.76 101.59 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.629 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -175.71 34.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.059 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.74 ' HA ' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -127.14 18.08 7.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.495 0.664 . . . . 0.0 110.559 179.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.03 -35.58 4.05 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.739 -1.119 . . . . 0.0 109.3 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.543 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.6 tt0 -76.53 -12.38 60.02 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.279 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.543 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 1.6 m-90 -106.03 -31.88 8.54 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.804 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -79.83 -15.06 58.14 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.294 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.419 ' HG3' ' CD1' ' A' ' 661' ' ' TYR . 11.4 pt-20 -78.81 -34.18 45.56 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 120.723 0.297 . . . . 0.0 110.857 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.792 ' O ' HG23 ' A' ' 665' ' ' VAL . 45.9 m-85 -70.85 -47.05 61.45 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.56 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.915 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 21.9 m-85 -60.43 -35.33 75.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.194 179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.821 ' HA ' HG22 ' A' ' 668' ' ' ILE . 0.1 OUTLIER -65.8 -13.8 60.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.342 -179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 36.3 p -118.86 -20.82 8.04 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.792 HG23 ' O ' ' A' ' 661' ' ' TYR . 20.2 t -93.83 32.19 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.45 24.43 56.12 Favored Glycine 0 CA--C 1.507 -0.462 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.847 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.476 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 2.3 mmpt? -116.67 19.37 14.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.072 0.463 . . . . 0.0 110.346 179.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.821 HG22 ' HA ' ' A' ' 663' ' ' ARG . 15.3 pt -44.16 -33.21 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.14 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -67.76 -59.92 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.168 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -57.33 -25.94 60.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.116 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.915 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -59.33 -38.89 81.46 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.13 179.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.73 -32.14 5.52 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.445 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -69.73 0.27 Allowed 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.756 -0.657 . . . . 0.0 110.339 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.804 HD12 ' N ' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -57.06 -23.51 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.029 179.364 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.41 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 1.4 mm-40 -64.88 -29.55 70.5 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.1 mtpt -69.41 -15.88 63.38 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.926 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.467 ' HB ' ' HB3' ' A' ' 655' ' ' SER . 0.2 OUTLIER -73.54 -21.02 60.49 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.317 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -54.03 -29.54 44.17 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.72 178.829 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -77.14 7.92 4.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.116 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -45.62 -29.74 1.31 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 120.818 0.342 . . . . 0.0 111.305 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 1.3 ptmm? -57.83 102.03 0.09 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.961 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 61.25 100.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.949 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 41.4 t30 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.901 -179.94 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.424 -0.271 . . . . 0.0 112.424 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . 64.03 102.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 0.0 110.928 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 656' ' ' ALA . 1.3 m-20 -151.33 92.04 1.74 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.335 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.414 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 4.5 p90 -103.45 -46.11 4.66 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.08 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.552 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.6 OUTLIER -84.91 23.51 1.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.073 179.178 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.645 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -112.0 -38.15 4.88 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.097 178.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.455 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.8 tt0 -65.84 -26.9 67.87 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.542 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.0 m-90 -90.18 -35.75 15.19 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.91 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.51 -2.77 47.45 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.335 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -94.22 -42.59 8.87 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.081 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.752 ' O ' HG23 ' A' ' 665' ' ' VAL . 4.1 p90 -76.62 -15.35 59.85 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.393 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.756 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 8.6 m-85 -73.79 -30.2 62.62 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.459 ' HD2' HG13 ' A' ' 668' ' ' ILE . 6.4 mmt85 -69.94 -9.08 53.8 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.575 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 16.2 m -126.46 14.44 7.66 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.752 HG23 ' O ' ' A' ' 661' ' ' TYR . 26.0 t -132.57 34.16 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.221 0.534 . . . . 0.0 109.714 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.85 26.03 64.71 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.625 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.442 ' HD3' ' CE1' ' A' ' 662' ' ' TYR . 14.0 mttp -122.42 16.05 10.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.115 0.483 . . . . 0.0 111.315 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.459 HG13 ' HD2' ' A' ' 663' ' ' ARG . 5.0 tt -51.0 -36.03 15.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.743 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -75.76 -45.97 33.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.475 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.73 -25.99 66.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.231 179.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.756 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -63.18 -33.22 75.0 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.331 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -51.96 -35.53 46.5 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.552 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -63.22 -67.47 0.42 Allowed 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.794 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.91 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.7 OUTLIER -59.8 -19.14 16.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.487 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.819 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 1.0 OUTLIER -65.31 -33.78 76.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.596 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -17.55 64.51 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.323 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.552 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.23 -11.37 57.87 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 177.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.645 ' CD1' ' HB2' ' A' ' 656' ' ' ALA . 21.8 tp -65.72 -30.95 71.69 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.337 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.4 80.39 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.548 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 678' ' ' LEU . 10.0 p30 -96.68 22.95 7.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.148 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 -38.65 0.78 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.257 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -119.92 166.0 13.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.913 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.889 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -155.4 -68.65 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.989 0.424 . . . . 0.0 111.096 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 60.18 97.86 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.899 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.646 ' HE2' ' HB2' ' A' ' 680' ' ' ASN . 1.1 p90 -131.1 -56.75 1.03 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.759 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.413 ' OG ' ' CD2' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -85.22 20.43 1.96 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.393 0.616 . . . . 0.0 110.114 178.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -114.23 -37.44 4.39 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.088 178.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.491 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 1.3 tt0 -66.8 -26.58 67.01 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.149 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.647 ' HB2' HD13 ' A' ' 674' ' ' ILE . 2.0 m-90 -90.53 -31.59 16.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 1.026 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.61 -6.49 58.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.847 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.25 -37.28 11.61 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.598 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.522 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.7 p90 -79.71 -17.41 53.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.449 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.781 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 6.7 m-85 -73.32 -29.45 62.7 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.979 0.419 . . . . 0.0 109.909 178.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm-85 -69.32 -9.93 55.56 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.412 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 6.2 t -116.67 -23.43 8.18 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.71 HG23 ' HB2' ' A' ' 667' ' ' LYS . 29.9 m -94.4 33.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.002 0.43 . . . . 0.0 110.353 179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 55.48 29.29 53.22 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.807 -0.711 . . . . 0.0 111.608 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.71 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -119.41 17.62 12.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.134 0.492 . . . . 0.0 111.185 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 4.8 tt -50.0 -30.57 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.643 179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.43 -61.42 1.79 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.532 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -58.27 -24.49 59.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.813 0.339 . . . . 0.0 110.124 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.781 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -62.33 -29.15 70.24 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.314 -0.403 . . . . 0.0 109.944 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -51.32 -49.88 60.5 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.04 -65.01 0.67 Allowed 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.852 0.835 . . . . 0.0 109.838 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 1.026 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -50.49 -28.88 5.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.026 -1.443 . . . . 0.0 110.776 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.51 ' CG ' ' HB1' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -71.44 -24.99 62.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.523 179.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -81.24 -14.98 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.874 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 680' ' ' ASN . 0.0 OUTLIER -76.15 -26.65 56.48 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.35 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.457 ' HA ' HD12 ' A' ' 678' ' ' LEU . 12.3 tp -51.57 -29.82 18.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.999 178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -68.08 -7.61 30.95 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.456 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.646 ' HB2' ' HE2' ' A' ' 654' ' ' TYR . 1.2 m-20 -46.36 -29.25 1.6 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.726 0.298 . . . . 0.0 111.251 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.32 166.26 23.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.796 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.4 140.38 33.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.944 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.873 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 652' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . 0.786 ' HB3' ' ND2' ' A' ' 680' ' ' ASN . . . 175.0 105.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.943 0.401 . . . . 0.0 110.833 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.667 ' OD2' HD21 ' A' ' 678' ' ' LEU . 0.6 OUTLIER -121.82 79.05 1.52 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.404 0.621 . . . . 0.0 110.327 179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.429 ' C ' ' H ' ' A' ' 656' ' ' ALA . 7.3 p90 -79.0 -47.25 16.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.621 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.564 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -79.52 22.23 0.46 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.794 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -109.43 -44.36 3.91 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.024 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -61.97 -27.02 68.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.539 ' HB3' ' CD1' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -91.2 -22.84 20.43 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.085 179.214 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.791 ' HB2' HD13 ' A' ' 674' ' ' ILE . . . -89.05 -6.09 57.39 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.6 -35.51 27.01 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.895 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.2 OUTLIER -70.99 -30.05 66.19 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.685 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.799 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.8 m-85 -63.18 -34.56 77.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.237 0.541 . . . . 0.0 109.969 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.822 ' HG3' HG23 ' A' ' 668' ' ' ILE . 0.7 OUTLIER -72.57 -1.95 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 -179.446 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.71 -27.03 7.2 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.629 HG22 ' O ' ' A' ' 665' ' ' VAL . 13.2 p -97.95 35.91 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.041 0.448 . . . . 0.0 110.486 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.23 27.05 66.87 Favored Glycine 0 CA--C 1.508 -0.365 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.209 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.588 ' HD2' HG13 ' A' ' 665' ' ' VAL . 3.6 mttt -114.67 20.97 14.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.074 0.464 . . . . 0.0 110.696 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.822 HG23 ' HG3' ' A' ' 663' ' ' ARG . 5.5 mt -48.26 -32.33 3.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.371 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.4 -39.42 28.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.495 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -25.49 62.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.252 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.799 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.53 -33.41 75.54 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.177 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -51.21 -31.68 21.28 Favored 'General case' 0 N--CA 1.457 -0.09 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.477 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.91 -69.78 0.27 Allowed 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.437 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.791 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -58.77 -21.99 20.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.558 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -67.85 -24.67 65.29 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 178.074 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -17.6 64.99 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.298 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.564 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.4 OUTLIER -89.93 -1.7 58.02 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.839 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.837 ' O ' HD23 ' A' ' 678' ' ' LEU . 6.1 tt -79.72 -30.2 40.89 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.583 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.95 -44.2 0.49 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.281 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.786 ' ND2' ' HB3' ' A' ' 652' ' ' ALA . 64.1 t-20 38.14 52.06 1.56 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.752 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.67 171.47 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.013 0.435 . . . . 0.0 110.981 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -157.96 128.27 6.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 35.6 m120 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.279 -0.867 . . . . 0.0 110.883 -179.977 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . 0.4 ' O ' ' HB3' ' A' ' 652' ' ' ALA . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . 0.46 ' HB1' ' CB ' ' A' ' 680' ' ' ASN . . . 67.25 103.68 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.044 0.45 . . . . 0.0 111.018 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.434 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . 8.3 p-10 -154.57 92.67 1.51 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.415 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.431 ' C ' ' H ' ' A' ' 656' ' ' ALA . 3.5 p90 -114.45 -46.01 2.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.545 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -80.07 23.73 0.45 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.119 0.485 . . . . 0.0 110.607 179.317 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.731 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -109.79 -44.52 3.81 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -63.26 -35.94 82.02 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.711 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -77.46 -35.22 54.05 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.52 178.74 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.867 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -71.32 -13.81 62.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.553 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -76.59 -38.72 54.41 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -64.53 -41.85 96.12 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.835 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 15.5 m-85 -57.78 -28.1 63.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.681 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.888 ' HD2' HG23 ' A' ' 668' ' ' ILE . 0.5 OUTLIER -71.44 -8.72 55.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.358 179.666 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 p -121.7 -23.76 5.46 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.651 HG23 ' CG ' ' A' ' 667' ' ' LYS . 29.7 m -92.78 31.48 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.831 0.348 . . . . 0.0 110.741 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.76 29.44 67.33 Favored Glycine 0 CA--C 1.506 -0.508 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.092 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.651 ' CG ' HG23 ' A' ' 665' ' ' VAL . 6.4 mmtt -119.82 18.35 12.59 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.1 0.476 . . . . 0.0 110.723 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.888 HG23 ' HD2' ' A' ' 663' ' ' ARG . 2.2 mt -46.66 -32.75 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.564 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.5 -47.96 18.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.359 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -65.59 -24.12 67.0 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.165 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.835 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -62.72 -38.03 88.87 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.451 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -51.01 -32.07 20.12 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.939 0.4 . . . . 0.0 110.497 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.93 -69.26 0.31 Allowed 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.542 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.867 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -57.67 -24.46 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.757 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.661 179.284 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.699 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 6.2 mt-10 -63.36 -25.38 68.27 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.699 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -5.45 44.86 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.384 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.419 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -93.25 -15.14 26.19 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.731 HD13 ' HB2' ' A' ' 656' ' ' ALA . 19.1 tp -64.64 -31.78 73.14 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.817 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 6.9 mttp -67.6 66.86 0.09 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.497 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.46 ' CB ' ' HB1' ' A' ' 652' ' ' ALA . 35.2 t30 -57.28 128.78 38.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.07 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -122.45 -68.98 0.85 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 61.57 96.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.934 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 3.5 t30 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.903 179.98 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 112.398 -0.281 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -80.39 -50.54 9.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.996 0.427 . . . . 0.0 111.139 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.74 99.19 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.855 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.436 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.3 p90 -134.03 -43.78 0.8 Allowed 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.307 -179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.488 ' OG ' ' C ' ' A' ' 677' ' ' THR . 0.3 OUTLIER -80.16 24.69 0.41 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.411 0.624 . . . . 0.0 110.719 179.752 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.436 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -110.78 -39.36 4.87 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.194 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.2 OUTLIER -68.34 -22.14 64.7 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.771 -179.778 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.572 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.1 m-90 -93.78 -36.41 12.29 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.624 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -77.79 -7.5 56.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.159 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -90.06 -46.3 8.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.15 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.572 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.4 p90 -73.88 -21.77 59.97 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.031 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.795 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.9 m-85 -66.88 -32.61 73.99 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.429 ' HG3' HG13 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -71.93 -4.27 27.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.634 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.3 18.54 4.88 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 665' ' ' VAL . 14.8 p -136.74 32.88 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.043 0.449 . . . . 0.0 109.82 178.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 61.73 26.14 66.5 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.746 -0.74 . . . . 0.0 111.542 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.598 ' HB2' HG13 ' A' ' 665' ' ' VAL . 2.1 tptt -123.71 17.47 9.51 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.112 0.482 . . . . 0.0 111.18 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.429 HG13 ' HG3' ' A' ' 663' ' ' ARG . 4.8 tt -52.25 -35.35 19.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.569 179.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.5 -48.73 30.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.494 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.64 -24.71 67.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.146 179.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.795 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.26 -37.83 88.79 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.509 179.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -51.49 -33.76 32.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.996 0.427 . . . . 0.0 110.534 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.12 -67.58 0.43 Allowed 'General case' 0 CA--C 1.51 -0.596 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.714 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.656 HG21 ' HE2' ' A' ' 662' ' ' TYR . 0.6 OUTLIER -58.34 -22.8 20.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.275 179.546 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.512 ' CG ' ' HB1' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -61.69 -34.24 75.4 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.988 178.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 tppt? -74.3 -7.26 52.18 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.659 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.488 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -88.39 -19.91 25.97 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 177.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.847 HD13 ' O ' ' A' ' 678' ' ' LEU . 3.1 tm? -60.39 -28.95 68.63 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.564 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 70.22 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.038 0.447 . . . . 0.0 110.381 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.538 ' N ' ' O ' ' A' ' 678' ' ' LEU . 59.6 t30 -74.77 115.13 14.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.007 -179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -137.46 98.55 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.861 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -68.07 125.58 26.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 71.0 m-20 . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.851 179.919 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -122.44 -80.92 0.63 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.814 0.34 . . . . 0.0 111.256 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.4 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . 8.5 m-20 64.22 102.22 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.762 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.405 ' CD2' ' OG ' ' A' ' 655' ' ' SER . 5.6 p90 -123.83 -43.77 2.11 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.447 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.662 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.8 OUTLIER -82.16 22.13 0.84 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.771 179.854 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.732 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -110.63 -44.33 3.69 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.911 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -62.97 -38.19 90.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.626 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.61 -33.01 62.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.397 178.572 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.888 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -74.58 -9.07 58.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.76 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -82.0 -37.56 26.4 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-O 120.731 0.3 . . . . 0.0 111.011 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -64.52 -40.64 95.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.409 . . . . 0.0 110.703 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.889 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 14.5 m-85 -57.19 -28.93 63.26 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.795 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.456 ' HD2' HG13 ' A' ' 668' ' ' ILE . 8.2 mmt85 -73.65 -6.81 49.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.259 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.8 t -133.68 24.23 4.01 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.597 HG22 ' HA ' ' A' ' 662' ' ' TYR . 32.9 m -140.71 28.9 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.114 0.483 . . . . 0.0 109.975 178.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.5 27.01 72.09 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.764 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.508 ' HB2' HG23 ' A' ' 665' ' ' VAL . 1.2 mptt -125.7 16.02 8.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.984 0.421 . . . . 0.0 110.954 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.456 HG13 ' HD2' ' A' ' 663' ' ' ARG . 10.3 tt -48.19 -30.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.409 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -83.89 -37.05 22.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.129 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.29 -25.64 62.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.083 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.889 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -62.06 -34.12 75.68 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.397 179.272 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 73.6 mt-10 -52.26 -35.25 49.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.927 0.394 . . . . 0.0 110.467 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.47 -68.3 0.37 Allowed 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.462 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.888 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -58.02 -22.58 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.718 179.285 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.788 ' HG2' ' HB1' ' A' ' 659' ' ' ALA . 2.3 mm-40 -64.58 -24.61 67.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.173 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.39 59.09 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.211 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.662 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -86.54 -15.03 41.22 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.677 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.732 HD22 ' HB2' ' A' ' 656' ' ' ALA . 21.7 tp -61.2 -31.77 71.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.291 179.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.25 72.46 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.449 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.501 ' N ' ' O ' ' A' ' 678' ' ' LEU . 55.1 t-20 -64.31 -63.05 1.24 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.013 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 123.27 26.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.984 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -129.03 153.05 47.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.927 179.983 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -140.37 -47.87 0.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.851 0.358 . . . . 0.0 111.095 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 63.3 105.52 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.467 0.651 . . . . 0.0 110.839 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.491 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -135.85 -11.02 2.04 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.672 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.5 OUTLIER -98.27 26.96 4.95 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.721 0.772 . . . . 0.0 109.753 178.803 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 1.031 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.33 -34.34 6.58 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.981 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.472 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -65.31 -37.78 88.2 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.653 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . . . . . . . . . 3.2 m-90 -79.89 -38.41 32.68 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.542 ' HB2' HG23 ' A' ' 674' ' ' ILE . . . -62.4 -18.97 62.9 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.222 179.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -75.32 -35.66 61.18 Favored 'General case' 0 C--N 1.337 0.059 0 CA-C-O 120.761 0.315 . . . . 0.0 111.365 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 657' ' ' GLN . 70.3 m-85 -66.49 -42.43 87.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.97 0.414 . . . . 0.0 110.843 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.791 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 22.2 m-85 -57.5 -30.53 65.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.869 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.532 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 2.9 mmm180 -68.97 -12.59 61.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.274 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -120.84 -24.49 5.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.635 HG22 ' HA ' ' A' ' 662' ' ' TYR . 25.7 m -91.32 30.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.911 0.386 . . . . 0.0 110.617 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.84 36.6 80.66 Favored Glycine 0 CA--C 1.505 -0.564 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.217 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 12.4 mmtt -128.1 16.48 6.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.02 0.438 . . . . 0.0 111.047 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.534 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.84 -30.31 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.418 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -72.66 -60.96 1.98 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.065 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.87 -22.7 59.68 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 178.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.791 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -59.3 -36.38 75.49 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.132 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -47.58 -36.9 11.33 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.783 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.16 -69.15 0.3 Allowed 'General case' 0 CA--C 1.514 -0.424 0 CA-C-O 121.362 0.601 . . . . 0.0 110.263 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.892 ' O ' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -55.97 -23.55 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.254 179.444 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' A' ' 678' ' ' LEU . 9.4 tt0 -76.6 -14.86 59.96 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.971 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -81.71 -21.8 37.75 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.996 -0.282 . . . . 0.0 110.907 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.505 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -73.16 -17.76 61.34 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.22 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.031 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -50.67 -37.47 41.11 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.06 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.7 49.67 1.22 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.917 178.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -58.02 127.21 30.93 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.178 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.02 -46.6 0.12 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.819 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.97 -45.23 14.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.312 -0.851 . . . . 0.0 110.871 -179.954 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -174.76 -81.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.795 0.331 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -171.83 97.82 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.153 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.443 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.7 p90 -153.59 -51.51 0.1 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.781 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.849 ' HA ' HD11 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -84.59 21.11 1.56 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.436 0.636 . . . . 0.0 110.388 179.12 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.52 ' HB2' HD11 ' A' ' 678' ' ' LEU . . . -112.74 -36.1 5.28 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.234 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.443 ' O ' ' CD2' ' A' ' 661' ' ' TYR . 1.4 tt0 -67.75 -34.81 77.56 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.702 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.473 ' O ' ' CD2' ' A' ' 662' ' ' TYR . 2.4 m-90 -83.09 -40.73 19.44 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.678 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -71.0 -12.49 61.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.939 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -95.37 -30.83 13.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 120.897 0.38 . . . . 0.0 110.234 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.719 ' O ' HG13 ' A' ' 665' ' ' VAL . 22.3 m-30 -79.59 -30.88 41.69 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.19 179.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.763 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 15.7 m-85 -65.85 -33.82 76.72 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.684 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 38.3 mmm-85 -68.46 -12.62 61.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.424 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.8 m -124.06 -21.16 5.13 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.719 HG13 ' O ' ' A' ' 661' ' ' TYR . 11.8 m -93.31 28.04 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.878 0.371 . . . . 0.0 110.735 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.25 38.15 95.73 Favored Glycine 0 CA--C 1.504 -0.638 0 C-N-CA 121.144 -0.55 . . . . 0.0 112.498 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.493 ' O ' ' HB3' ' A' ' 662' ' ' TYR . 6.2 mttp -133.09 18.32 4.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.123 0.487 . . . . 0.0 110.395 178.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.65 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -46.96 -30.15 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.418 179.356 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -77.81 -50.41 12.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.406 179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.62 -17.75 65.0 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.763 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -64.88 -36.65 85.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.523 179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -51.53 -33.45 31.97 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.821 0.344 . . . . 0.0 110.479 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.6 -68.66 0.36 Allowed 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.849 HD11 ' HA ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -54.19 -24.05 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.315 179.625 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.97 73.39 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -74.45 -21.81 59.42 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.826 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.63 ' O ' ' HB2' ' A' ' 680' ' ' ASN . 0.0 OUTLIER -70.5 -20.98 62.8 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 656' ' ' ALA . 1.8 tp -50.17 -32.82 17.19 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.648 178.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.89 36.71 1.02 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.045 179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.63 ' HB2' ' O ' ' A' ' 677' ' ' THR . 1.2 t-20 -77.99 -161.62 0.27 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.489 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 2.6 mttt 69.68 82.7 0.16 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.871 0.367 . . . . 0.0 110.868 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -122.07 -42.97 2.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.854 179.948 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -109.01 -31.1 7.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.758 0.313 . . . . 0.0 111.083 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 61.77 99.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.791 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.457 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.2 p90 -133.66 -48.9 0.82 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.993 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.5 ' HB3' ' N ' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -79.31 22.84 0.41 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.422 0.629 . . . . 0.0 110.482 179.328 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.759 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -108.67 -37.89 5.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.057 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.496 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 1.1 tt0 -67.41 -22.03 65.56 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.809 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.558 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.5 m-90 -92.72 -34.17 14.04 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 109.247 178.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.829 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -80.26 -6.42 57.84 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.696 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.14 -39.93 10.31 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.326 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.558 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 3.5 p90 -77.72 -19.32 55.42 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.089 179.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.659 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.2 m-85 -68.21 -33.96 75.37 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.441 ' HA ' ' HB ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -61.3 -14.1 24.18 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.667 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 42.4 p -108.62 -25.27 10.97 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.806 HG13 ' HG3' ' A' ' 667' ' ' LYS . 13.4 p -95.82 34.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 0.0 110.378 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 57.26 30.59 61.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.911 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.806 ' HG3' HG13 ' A' ' 665' ' ' VAL . 13.7 mttt -119.6 16.65 12.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.08 0.467 . . . . 0.0 111.302 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.441 ' HB ' ' HA ' ' A' ' 663' ' ' ARG . 7.6 tt -49.69 -41.35 16.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.832 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -65.64 -57.85 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.507 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -22.49 64.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.399 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.659 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -66.21 -39.92 89.98 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.583 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.36 -34.2 32.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.966 0.412 . . . . 0.0 110.516 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -65.15 -67.36 0.44 Allowed 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 121.363 0.601 . . . . 0.0 110.54 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.829 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -56.04 -25.31 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.607 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.36 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.792 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -60.05 -37.46 79.91 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.637 179.087 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.17 -19.09 62.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.876 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.417 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.74 -13.57 47.94 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.209 179.142 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.759 HD13 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -79.12 -22.77 44.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.859 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 24.1 mmtm -67.15 66.77 0.07 Allowed 'General case' 0 CA--C 1.528 0.118 0 CA-C-O 120.906 0.384 . . . . 0.0 110.596 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.445 ' N ' ' O ' ' A' ' 678' ' ' LEU . 6.8 t-20 -74.32 -66.79 0.68 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.084 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 9.5 mttp -150.62 133.33 15.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.846 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.48 151.88 25.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 60.2 m-20 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.871 -179.923 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -116.51 -50.87 2.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.001 0.429 . . . . 0.0 111.172 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.401 ' HA ' ' ND2' ' A' ' 680' ' ' ASN . 7.2 t70 68.58 106.68 0.05 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -148.59 -11.01 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.204 -0.907 . . . . 0.0 112.034 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.47 ' OG ' ' OG1' ' A' ' 677' ' ' THR . 0.4 OUTLIER -97.6 26.44 5.01 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.441 0.639 . . . . 0.0 110.234 178.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.924 ' HB2' ' CD1' ' A' ' 678' ' ' LEU . . . -111.72 -36.74 5.37 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.362 178.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -30.52 70.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.128 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.55 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 2.2 m-90 -86.4 -34.55 20.15 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.561 ' N ' HD12 ' A' ' 674' ' ' ILE . . . -81.45 -2.91 51.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.431 179.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -96.7 -42.77 7.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.925 179.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.55 ' CE1' ' HA ' ' A' ' 658' ' ' TRP . 2.8 p90 -75.51 -23.94 56.78 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.767 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.0 m-85 -65.47 -29.69 70.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 109.947 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 668' ' ' ILE . 20.8 mmm-85 -69.32 -9.98 55.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.563 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -118.67 -22.79 7.31 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.625 HG12 ' HA ' ' A' ' 662' ' ' TYR . 14.6 p -94.35 33.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.04 0.448 . . . . 0.0 110.53 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.77 28.61 63.29 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.79 -0.719 . . . . 0.0 111.923 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.617 ' HB2' HG13 ' A' ' 665' ' ' VAL . 0.0 OUTLIER -120.17 18.16 12.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 179.673 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.543 HD13 ' C ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -51.52 -32.8 13.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.722 179.441 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.95 -54.36 8.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.166 179.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -22.66 66.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.083 179.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.767 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -64.42 -34.26 77.78 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.577 179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -53.26 -33.16 51.95 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.874 0.368 . . . . 0.0 110.454 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -66.75 -69.11 0.33 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.268 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.632 HG21 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -56.8 -23.21 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.803 179.197 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 678' ' ' LEU . 43.2 tt0 -66.92 -26.8 67.04 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.657 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -68.06 -20.81 64.99 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 120.916 -0.313 . . . . 0.0 111.484 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.47 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -83.05 -15.09 52.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.648 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.924 ' CD1' ' HB2' ' A' ' 656' ' ' ALA . 10.8 tp -55.22 -37.46 67.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.195 178.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 mptt -79.32 52.47 1.35 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.777 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.401 ' ND2' ' HA ' ' A' ' 653' ' ' ASP . 7.6 p30 -73.06 115.06 11.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.017 -179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.53 -69.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.935 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 177.87 89.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.817 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.885 179.998 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -131.52 -45.78 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.876 0.369 . . . . 0.0 111.128 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 16.6 t70 69.15 106.61 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.642 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -169.3 32.24 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.001 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.607 ' HB3' ' HG1' ' A' ' 677' ' ' THR . 0.1 OUTLIER -124.79 19.6 8.55 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.51 0.671 . . . . 0.0 110.715 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -117.21 -31.55 5.28 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.51 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.489 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -74.87 -24.41 58.56 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.43 -179.599 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.685 ' HB2' HD13 ' A' ' 674' ' ' ILE . 1.6 m-90 -92.69 -33.15 14.46 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 1.003 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -75.48 -13.37 60.37 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.34 179.18 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -78.68 -33.36 47.07 Favored 'General case' 0 N--CA 1.456 -0.125 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.43 179.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.557 ' O ' HG22 ' A' ' 665' ' ' VAL . 59.4 m-85 -73.47 -45.44 54.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.676 0.274 . . . . 0.0 111.015 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 1.026 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 13.3 m-85 -64.43 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.946 0.403 . . . . 0.0 110.143 179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.417 ' HA ' ' CG1' ' A' ' 668' ' ' ILE . 0.8 OUTLIER -67.51 -11.87 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.197 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 87.1 p -121.36 -24.15 5.51 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.628 HG22 ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -91.86 30.27 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.772 0.32 . . . . 0.0 110.892 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.86 29.3 70.12 Favored Glycine 0 CA--C 1.505 -0.576 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.133 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.499 ' HB2' ' HA ' ' A' ' 662' ' ' TYR . 3.6 mtpp -121.67 19.55 11.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.179 0.514 . . . . 0.0 110.27 178.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.417 ' CG1' ' HA ' ' A' ' 663' ' ' ARG . 1.5 mp -46.58 -30.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.463 179.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -65.62 -57.33 8.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.926 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -61.74 -29.25 69.99 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 1.026 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -57.14 -29.78 63.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.783 178.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -48.94 -49.67 39.17 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.618 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -56.12 -65.67 0.56 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.887 0.851 . . . . 0.0 109.713 178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 1.003 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -49.35 -35.5 8.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 114.113 -1.403 . . . . 0.0 110.841 179.657 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -66.24 -27.27 67.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -76.91 -11.81 59.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.943 179.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.661 HG22 ' OD1' ' A' ' 680' ' ' ASN . 0.0 OUTLIER -77.6 -20.88 53.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.489 HD13 ' O ' ' A' ' 678' ' ' LEU . 0.3 OUTLIER -52.24 -33.25 40.65 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.741 179.045 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -13.78 35.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.966 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.661 ' OD1' HG22 ' A' ' 677' ' ' THR . 2.8 m120 -44.63 146.63 0.71 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.972 0.415 . . . . 0.0 111.354 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -160.61 79.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.862 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 104.82 2.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.289 -0.863 . . . . 0.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . 0.904 ' HB3' ' HB3' ' A' ' 680' ' ' ASN . . . -92.0 -70.11 0.71 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.92 0.39 . . . . 0.0 111.175 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.446 ' HA ' HD22 ' A' ' 678' ' ' LEU . 0.9 OUTLIER 60.77 100.62 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.389 -179.535 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -162.57 -4.55 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.611 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 4.6 m -100.48 27.03 6.07 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.573 0.701 . . . . 0.0 109.644 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.684 ' HB2' HD23 ' A' ' 678' ' ' LEU . . . -108.72 -38.66 5.58 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.789 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.443 ' HB3' ' CZ3' ' A' ' 658' ' ' TRP . 0.8 OUTLIER -59.15 -29.44 67.43 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.28 -0.873 . . . . 0.0 110.487 -179.61 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.443 ' CZ3' ' HB3' ' A' ' 657' ' ' GLN . 2.0 m-90 -88.54 -33.55 17.69 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 1.002 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -67.57 -24.17 65.48 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.493 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -33.09 72.77 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.782 0.325 . . . . 0.0 111.59 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.835 ' O ' HG23 ' A' ' 665' ' ' VAL . 62.8 m-85 -66.8 -46.86 73.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.989 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.893 ' HB2' ' HB2' ' A' ' 671' ' ' ALA . 23.9 m-85 -56.8 -30.88 64.12 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.942 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 659' ' ' ALA . 10.2 mmm180 -61.38 -22.04 64.61 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.631 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.5 m -117.2 -16.14 10.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.824 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.835 HG23 ' O ' ' A' ' 661' ' ' TYR . 18.5 t -92.53 27.41 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.814 0.34 . . . . 0.0 110.297 179.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.19 29.34 62.65 Favored Glycine 0 CA--C 1.505 -0.571 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.794 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.418 ' C ' ' HB3' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -124.48 14.94 8.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.091 0.472 . . . . 0.0 110.954 179.403 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 5.4 tt -44.95 -31.87 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.566 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -70.14 -62.42 1.39 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.193 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.53 -23.99 53.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.893 ' HB2' ' HB2' ' A' ' 662' ' ' TYR . . . -60.63 -26.62 67.16 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.489 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -49.36 -44.49 44.78 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.725 179.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -59.5 -67.14 0.41 Allowed 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.495 0.664 . . . . 0.0 109.896 178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 1.002 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -51.03 -32.26 11.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.331 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 12.2 tt0 -72.49 -10.78 60.21 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.881 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.35 -13.63 37.44 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.607 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.474 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -85.19 -17.61 36.59 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 177.732 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.684 HD23 ' HB2' ' A' ' 656' ' ' ALA . 3.3 tm? -55.74 -34.66 65.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.41 178.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -77.62 53.91 1.14 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.853 178.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.904 ' HB3' ' HB3' ' A' ' 652' ' ' ALA . 0.4 OUTLIER -91.97 113.83 26.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.985 -179.442 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 5.7 tttm 61.04 154.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.922 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.56 88.22 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.806 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 1.9 m120 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.149 -0.929 . . . . 0.0 110.915 179.892 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -175.96 -81.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.748 0.309 . . . . 0.0 111.107 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -172.6 98.25 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.112 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.472 ' CE2' ' HB3' ' A' ' 680' ' ' ASN . 0.9 OUTLIER -150.82 -55.36 0.15 Allowed 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.804 179.72 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.42 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.2 OUTLIER -83.86 19.39 1.73 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.276 0.56 . . . . 0.0 110.394 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.605 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -113.66 -43.46 3.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.934 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -63.28 -34.86 78.61 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.5 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -80.23 -29.8 38.49 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.159 179.435 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.909 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -79.22 -13.36 59.74 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.189 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 663' ' ' ARG . 22.3 mt-10 -76.23 -36.7 58.42 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -67.53 -23.42 65.44 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.68 -0.808 . . . . 0.0 110.263 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.803 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.0 m-85 -67.76 -58.07 5.25 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.062 0.458 . . . . 0.0 110.588 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.608 ' CB ' HG22 ' A' ' 668' ' ' ILE . 0.0 OUTLIER -60.02 -7.65 1.9 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.812 -179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 3.1 m -90.96 -35.92 14.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.699 0.285 . . . . 0.0 111.368 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 665' ' ' VAL . 22.3 t -99.36 37.06 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.095 0.474 . . . . 0.0 110.127 179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 62.69 26.33 68.41 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.647 -179.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.95 19.69 20.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 0.0 110.727 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.608 HG22 ' CB ' ' A' ' 663' ' ' ARG . 22.5 pt -45.85 -37.93 2.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.806 179.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . 0.435 ' N ' HG13 ' A' ' 668' ' ' ILE . 9.4 tt0 -67.25 -58.12 5.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.675 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -60.06 -23.0 63.42 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.684 179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.803 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -67.73 -38.3 83.37 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.72 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -52.3 -32.85 39.55 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.954 0.406 . . . . 0.0 110.499 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -64.64 -67.7 0.41 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.874 179.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.909 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.6 OUTLIER -61.47 -19.54 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.912 179.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.739 ' HG3' ' HB1' ' A' ' 659' ' ' ALA . 2.5 mt-10 -68.59 -27.1 65.75 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -71.5 -13.41 61.8 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.228 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -75.65 -23.24 56.27 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 178.041 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.605 HD22 ' HB2' ' A' ' 656' ' ' ALA . 12.7 tp -51.59 -30.04 19.52 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.049 178.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -75.49 2.85 10.51 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.565 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.472 ' HB3' ' CE2' ' A' ' 654' ' ' TYR . 48.9 t-20 -49.06 143.24 5.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.795 0.331 . . . . 0.0 111.194 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp -107.0 -73.68 0.68 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.714 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 57.27 35.24 25.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.971 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.215 -0.897 . . . . 0.0 110.872 179.971 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.17 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -69.77 -53.2 19.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . 0.526 ' CG ' HD13 ' A' ' 678' ' ' LEU . 1.4 m-20 63.24 101.17 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.791 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.417 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 1.4 p90 -118.14 -45.84 2.64 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.089 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.522 ' HB3' ' O ' ' A' ' 674' ' ' ILE . 0.3 OUTLIER -76.72 11.66 1.61 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.186 0.517 . . . . 0.0 110.63 179.246 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.794 ' HB2' HD22 ' A' ' 678' ' ' LEU . . . -92.51 -44.21 8.75 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -32.81 70.98 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.676 ' HB3' HD13 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -82.21 -23.52 35.39 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.044 179.017 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.879 ' N ' HD11 ' A' ' 674' ' ' ILE . . . -89.09 0.07 57.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -86.45 -39.24 16.52 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.548 -179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.463 ' CD1' ' N ' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -70.29 -30.21 67.17 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.715 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.849 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 3.4 m-85 -62.81 -35.49 80.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.13 0.49 . . . . 0.0 109.956 178.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.731 ' HA ' HG22 ' A' ' 668' ' ' ILE . 2.6 mpt_? -71.11 -2.76 16.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.935 -179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.6 m -109.93 -28.9 8.51 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.673 HG23 ' HB2' ' A' ' 667' ' ' LYS . 4.7 m -97.57 36.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.024 0.44 . . . . 0.0 110.311 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 58.7 27.08 61.02 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.569 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.673 ' HB2' HG23 ' A' ' 665' ' ' VAL . 0.3 OUTLIER -111.31 19.41 18.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.04 0.448 . . . . 0.0 110.864 179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.731 HG22 ' HA ' ' A' ' 663' ' ' ARG . 24.3 pt -47.18 -35.25 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.539 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -70.54 -49.57 46.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.765 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.68 -29.71 70.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.537 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.849 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.81 -33.27 75.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.187 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.528 ' HA ' ' HG2' ' A' ' 675' ' ' GLU . 2.8 mt-10 -58.93 -22.18 59.38 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.132 -179.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -81.8 -61.47 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.44 0.638 . . . . 0.0 110.319 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.879 HD11 ' N ' ' A' ' 659' ' ' ALA . 0.8 OUTLIER -62.5 -25.51 38.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.047 -179.567 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.704 ' HB3' ' CB ' ' A' ' 659' ' ' ALA . 1.5 pp20? -69.82 -29.52 66.82 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.276 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.61 -24.1 12.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.856 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 674' ' ' ILE . 0.0 OUTLIER -74.86 -20.22 59.83 Favored 'General case' 0 N--CA 1.461 0.104 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.556 179.387 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.794 HD22 ' HB2' ' A' ' 656' ' ' ALA . 1.1 pp -73.54 -19.56 60.88 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.109 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -39.71 -33.93 0.22 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.821 0.343 . . . . 0.0 111.548 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 49.82 94.2 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.163 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.8 125.72 50.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -171.43 117.53 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 9.2 t30 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.929 179.966 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.439 -0.264 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -160.98 -47.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.04 0.448 . . . . 0.0 111.217 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 51.9 26.18 3.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.033 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -6.06 44.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.762 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.572 ' HB2' ' HB ' ' A' ' 677' ' ' THR . 0.1 OUTLIER -100.33 23.0 10.72 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.494 0.664 . . . . 0.0 110.336 179.329 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . . . . . . . . . . . -108.9 -37.67 5.79 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.289 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.456 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.1 OUTLIER -64.78 -28.9 69.89 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.543 -179.745 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.542 ' HB2' HD13 ' A' ' 674' ' ' ILE . 1.7 m-90 -88.37 -29.46 20.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 1.065 ' HB2' HG13 ' A' ' 674' ' ' ILE . . . -79.48 -7.18 58.25 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.443 179.004 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -90.17 -44.32 9.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.506 -179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.79 ' O ' HG23 ' A' ' 665' ' ' VAL . 3.8 p90 -74.6 -18.83 60.51 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.691 179.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.767 ' CB ' ' HB2' ' A' ' 671' ' ' ALA . 5.9 m-85 -72.07 -29.72 64.41 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.396 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 1.012 ' HA ' HG22 ' A' ' 668' ' ' ILE . 5.8 mmt180 -66.9 -10.06 44.64 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.374 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.18 -22.24 6.69 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.44 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 661' ' ' TYR . 18.7 t -92.65 31.94 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.899 0.38 . . . . 0.0 110.391 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 56.33 27.17 52.57 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.577 -179.168 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.448 ' HB2' ' CD1' ' A' ' 662' ' ' TYR . 2.4 mttt -115.37 16.73 16.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.111 0.481 . . . . 0.0 110.968 179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 1.012 HG22 ' HA ' ' A' ' 663' ' ' ARG . 12.9 pt -47.25 -38.46 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.0 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -64.17 -64.34 0.91 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.578 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.42 -23.67 50.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.382 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.767 ' HB2' ' CB ' ' A' ' 662' ' ' TYR . . . -63.8 -31.37 72.52 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.869 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -50.01 -51.12 44.43 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.806 179.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -58.07 -62.47 1.8 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 121.741 0.781 . . . . 0.0 109.895 178.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 1.065 HG13 ' HB2' ' A' ' 659' ' ' ALA . 0.2 OUTLIER -51.96 -25.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.342 179.835 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.564 ' HA ' HD23 ' A' ' 678' ' ' LEU . 2.8 tt0 -76.14 -11.76 59.99 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.233 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.1 -10.73 40.91 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.696 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.572 ' HB ' ' HB2' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.81 -22.09 22.27 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.202 178.833 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.564 HD23 ' HA ' ' A' ' 675' ' ' GLU . 3.8 pp -65.3 -25.96 67.86 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.812 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 32.6 mttp -61.38 -10.22 6.93 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 178.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -33.34 125.21 0.39 Allowed 'General case' 0 C--N 1.342 0.268 0 C-N-CA 122.848 0.459 . . . . 0.0 112.076 -179.988 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -138.81 149.2 44.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.709 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.08 118.29 19.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.01 -179.959 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 21.7 m120 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.967 179.997 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . 0.426 ' HA3' ' HA ' ' A' ' 682' ' ' GLN . . . . . . . . 0 N--CA 1.489 2.22 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . 0.459 ' HB3' ' CB ' ' A' ' 680' ' ' ASN . . . -165.01 -68.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.365 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 53.97 89.33 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.369 -179.559 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.522 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 -134.54 -56.69 0.84 Allowed 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.596 -179.078 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.787 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -74.74 20.2 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.168 0.508 . . . . 0.0 110.346 179.42 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 1.04 ' HB2' HD13 ' A' ' 678' ' ' LEU . . . -103.04 -42.58 5.75 Favored 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.07 178.781 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -48.34 77.52 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.504 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -72.45 -10.53 59.91 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.704 178.449 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.919 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -86.23 -19.51 29.87 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.319 -179.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.43 -20.19 48.12 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.174 -0.611 . . . . 0.0 110.62 179.218 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.848 ' O ' HG22 ' A' ' 665' ' ' VAL . 71.8 m-85 -86.73 -14.13 43.32 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.616 178.721 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.919 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -72.64 -35.01 67.69 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.301 179.43 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.865 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.1 OUTLIER -82.09 10.91 5.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.374 179.977 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 m -128.03 -33.08 2.24 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.879 HG23 ' HG2' ' A' ' 667' ' ' LYS . 27.5 m -93.82 32.54 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.875 0.369 . . . . 0.0 110.827 179.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 65.29 32.58 84.21 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.879 ' HG2' HG23 ' A' ' 665' ' ' VAL . 29.5 mmtm -113.15 20.57 16.15 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.017 179.299 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 663' ' ' ARG . 2.1 mp -51.57 -25.63 5.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.127 179.684 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.22 -54.49 4.18 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.657 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 8.2 mt-10 -61.11 -18.42 57.89 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 177.048 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.812 ' HB1' ' CE1' ' A' ' 662' ' ' TYR . . . -53.1 -48.96 67.39 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.106 179.277 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -54.94 -19.27 6.34 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.599 -179.719 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -82.13 -58.24 3.04 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-O 120.778 0.323 . . . . 0.0 111.451 179.854 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.685 HG23 ' HD2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -76.53 -3.63 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.742 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.05 179.807 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.469 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 20.5 tt0 -87.52 -26.54 23.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 177.856 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -80.11 -11.35 59.77 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.534 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.0 -26.73 25.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.972 0.415 . . . . 0.0 110.093 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.04 HD13 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -70.04 -21.47 63.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.361 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -52.21 86.88 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 -179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.462 ' N ' ' O ' ' A' ' 678' ' ' LEU . 0.3 OUTLIER -143.86 95.58 2.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.526 -179.923 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.79 140.63 14.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.391 -179.723 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . 0.426 ' HA ' ' HA3' ' A' ' 651' ' ' GLY . 2.0 mt-30 -100.56 -30.25 11.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 39.7 t30 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.842 179.965 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.244 0 N-CA-C 112.488 -0.245 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -119.52 -47.76 2.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.951 0.405 . . . . 0.0 111.067 -179.901 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 59.82 98.27 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.54 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.7 p90 -135.31 -55.35 0.8 Allowed 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.857 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.722 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -77.07 26.5 0.15 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.538 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.931 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.81 -42.5 4.24 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.329 179.213 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -63.59 -38.87 92.78 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.141 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.508 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -83.39 -14.54 52.49 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.703 178.465 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.877 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -83.98 -21.33 31.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.87 179.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -76.27 -20.5 57.3 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.95 179.441 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.851 ' O ' HG22 ' A' ' 665' ' ' VAL . 19.7 m-85 -84.89 -11.4 55.68 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.367 179.557 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.877 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.38 -34.9 41.56 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.002 -0.679 . . . . 0.0 110.139 179.386 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.831 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -81.83 9.51 7.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.372 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -124.81 -32.13 3.1 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.851 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.851 HG22 ' O ' ' A' ' 661' ' ' TYR . 35.0 m -96.89 35.37 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.961 0.41 . . . . 0.0 110.536 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.84 31.79 72.9 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.498 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.697 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.3 OUTLIER -106.39 16.62 24.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.907 0.384 . . . . 0.0 111.45 -179.637 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.793 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -52.13 -24.12 4.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.991 -179.602 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -85.73 -59.48 2.3 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 0.3 OUTLIER -59.59 -19.3 47.82 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.156 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.736 ' HB1' ' CE1' ' A' ' 662' ' ' TYR . . . -51.26 -47.63 62.42 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.886 178.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -53.54 -19.43 3.76 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.393 -179.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -79.13 -61.15 2.1 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.638 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -76.82 -5.01 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.986 179.731 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.471 ' HB2' ' CE2' ' A' ' 662' ' ' TYR . 68.4 tt0 -86.05 -25.36 25.94 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 177.632 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 4.7 mtpt -74.36 -19.47 60.43 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.787 179.4 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.05 -16.67 52.6 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.931 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -60.31 -39.51 87.26 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.966 178.868 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 11.9 mmtt -58.52 86.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.781 179.826 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -82.14 57.38 3.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.778 -179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 5.5 pttt -170.33 -41.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.814 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 61.37 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 179.886 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 30.0 m-20 . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.914 179.955 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -162.02 -44.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.911 0.386 . . . . 0.0 111.108 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 64.78 104.39 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.242 0.544 . . . . 0.0 110.552 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.458 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -163.73 28.13 0.08 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.214 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.613 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -126.04 20.82 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.629 0.728 . . . . 0.0 109.886 179.127 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.438 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -115.17 -37.43 4.1 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.16 178.732 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.519 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 2.6 tp60 -74.41 -36.84 63.47 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.401 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.519 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 2.7 m-90 -83.63 -21.32 32.55 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 177.989 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.813 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -71.87 -22.2 61.55 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.796 -179.583 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -80.69 -13.86 58.64 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.367 -0.533 . . . . 0.0 111.165 179.231 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.862 ' O ' HG22 ' A' ' 665' ' ' VAL . 91.1 m-85 -91.95 -14.31 29.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.422 178.833 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.825 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.1 OUTLIER -74.65 -37.16 62.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.114 179.6 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.825 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.03 11.23 5.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.481 179.996 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.3 t -127.05 -34.96 2.29 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -179.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.862 HG22 ' O ' ' A' ' 661' ' ' TYR . 33.8 m -95.56 34.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.926 0.393 . . . . 0.0 110.473 179.648 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.17 31.9 74.63 Favored Glycine 0 CA--C 1.507 -0.447 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.527 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.643 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -106.29 18.75 21.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.838 0.352 . . . . 0.0 111.37 179.957 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 9.6 tt -50.14 -27.07 3.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.354 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -86.51 -51.64 6.06 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.905 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . 0.537 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 0.0 OUTLIER -62.57 -18.6 62.42 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 177.207 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.723 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -53.21 -47.98 68.48 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.059 179.126 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -52.52 -19.83 2.53 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.912 179.827 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -75.28 -67.26 0.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.832 0.348 . . . . 0.0 111.553 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.696 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -71.81 -13.0 16.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.162 -179.714 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 22.4 tt0 -79.28 -27.36 42.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.05 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.55 -8.27 59.61 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.691 179.029 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.475 ' C ' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.86 -23.12 33.81 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 178.017 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.438 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.2 OUTLIER -52.51 -34.05 47.81 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.613 179.052 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.59 -18.79 21.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.372 178.643 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -43.89 98.0 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.37 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -169.65 70.75 0.07 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.863 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -84.86 121.44 27.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.921 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.921 179.998 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.507 -0.237 . . . . 0.0 112.507 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -153.5 -80.43 0.09 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.91 0.386 . . . . 0.0 111.173 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 56.99 95.1 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.913 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.465 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.1 p90 -137.8 -46.4 0.54 Allowed 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.702 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -79.52 26.61 0.29 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.964 0.411 . . . . 0.0 110.177 179.162 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.499 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -112.13 -46.22 3.22 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.038 178.705 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.05 -38.79 86.46 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 178.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.464 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -86.97 5.43 37.32 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.937 178.553 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.909 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -104.29 -19.11 14.21 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.91 178.638 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -77.35 -22.0 52.44 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.378 178.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.863 ' O ' HG22 ' A' ' 665' ' ' VAL . 66.9 m-85 -82.72 -13.75 55.8 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.236 179.304 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.909 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -75.92 -37.23 58.96 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.363 179.49 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.865 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -82.54 10.74 6.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.609 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.12 -32.73 2.96 Favored 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.749 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.863 HG22 ' O ' ' A' ' 661' ' ' TYR . 34.7 m -97.99 36.08 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 120.984 0.421 . . . . 0.0 110.416 179.688 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 60.05 31.5 72.93 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.561 -179.374 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -106.97 17.87 22.53 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.891 0.377 . . . . 0.0 111.487 -179.783 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.47 -29.49 6.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.395 -179.88 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -83.34 -51.36 7.48 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.102 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . 0.41 ' HB3' ' HG2' ' A' ' 667' ' ' LYS . 8.4 tt0 -63.0 -18.41 63.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.63 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.696 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -55.47 -43.77 75.83 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.736 178.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -47.35 -31.83 4.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.48 -179.711 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -76.38 -51.94 10.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.451 0.643 . . . . 0.0 111.16 179.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.734 ' O ' HD12 ' A' ' 674' ' ' ILE . 0.1 OUTLIER -72.82 -18.28 18.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.62 -179.035 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 671' ' ' ALA . 0.7 OUTLIER -86.03 -21.16 27.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 110.309 178.913 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -79.55 -16.0 56.71 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.85 179.516 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.432 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -89.56 -3.28 58.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.991 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 656' ' ' ALA . 1.1 tt -80.18 -24.26 40.45 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.487 179.182 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.14 -34.41 0.06 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.625 -179.826 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.42 ' O ' ' CB ' ' A' ' 681' ' ' LYS . 4.2 t-20 -54.94 145.94 18.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.694 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 680' ' ' ASN . 0.2 OUTLIER 81.67 -47.99 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.234 -179.821 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 71.31 83.14 0.14 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.868 0.366 . . . . 0.0 110.851 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -99.33 -77.65 0.52 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.952 0.405 . . . . 0.0 111.239 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 64.66 101.44 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.744 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.497 ' C ' ' H ' ' A' ' 656' ' ' ALA . 1.6 p90 -123.08 -50.69 1.91 Allowed 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.179 -179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.803 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.5 OUTLIER -76.67 19.85 0.26 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.237 0.542 . . . . 0.0 110.329 178.978 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 654' ' ' TYR . . . -100.35 -44.34 5.95 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.025 178.589 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -64.93 -39.75 93.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.592 ' C ' HD11 ' A' ' 674' ' ' ILE . 0.0 OUTLIER -85.75 8.95 17.93 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.795 178.365 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.903 ' HB1' ' CE2' ' A' ' 662' ' ' TYR . . . -104.46 -25.29 12.86 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.836 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -73.74 -16.86 61.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.211 178.573 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.837 ' O ' HG22 ' A' ' 665' ' ' VAL . 20.1 m-30 -85.21 -17.41 37.18 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.017 179.123 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.903 ' CE2' ' HB1' ' A' ' 659' ' ' ALA . 0.1 OUTLIER -71.84 -36.6 70.22 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 120.264 -0.575 . . . . 0.0 110.588 179.606 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.84 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 2.8 ptt180 -77.84 5.28 9.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.48 -179.871 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 91.6 p -128.67 -30.97 2.26 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.847 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 661' ' ' TYR . 18.6 m -94.29 33.59 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.888 0.375 . . . . 0.0 110.517 179.602 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 59.56 32.14 72.64 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.788 -179.337 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.699 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 2.6 ttpt -112.13 19.13 18.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.907 0.384 . . . . 0.0 111.295 179.903 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.458 ' O ' HD12 ' A' ' 668' ' ' ILE . 2.3 tp -51.5 -32.69 13.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.387 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -82.48 -50.02 9.3 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.059 179.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . 0.416 ' HB2' ' HG2' ' A' ' 667' ' ' LYS . 0.3 OUTLIER -64.48 -17.07 63.52 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 177.295 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.749 ' HA ' HG23 ' A' ' 674' ' ' ILE . . . -54.88 -44.99 74.59 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.672 179.018 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -45.79 -35.73 4.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.622 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -75.29 -50.76 15.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.549 0.69 . . . . 0.0 110.904 179.425 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.749 HG23 ' HA ' ' A' ' 671' ' ' ALA . 0.1 OUTLIER -71.92 -10.92 14.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.675 -179.253 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.587 ' OE2' HD21 ' A' ' 678' ' ' LEU . 2.0 tm-20 -94.91 -13.44 25.41 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.746 0.308 . . . . 0.0 110.648 178.76 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -93.83 -8.42 40.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.777 179.35 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.423 ' HB ' ' CB ' ' A' ' 655' ' ' SER . 0.1 OUTLIER -87.67 -27.27 22.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.32 179.332 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.587 HD21 ' OE2' ' A' ' 675' ' ' GLU . 3.7 pp -70.25 -20.51 63.06 Favored 'General case' 0 C--N 1.335 -0.055 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.009 179.467 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 13.5 mttm -66.16 67.62 0.05 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.934 0.397 . . . . 0.0 110.636 179.752 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 678' ' ' LEU . 11.5 t-20 -120.8 157.32 30.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.882 -179.781 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -116.78 -66.3 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.956 179.988 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -168.74 -56.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.9 179.999 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.919 -179.988 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.561 -0.216 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . 0.836 ' HB3' ' HB2' ' A' ' 681' ' ' LYS . . . 64.51 102.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.977 0.418 . . . . 0.0 111.0 -179.827 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -148.1 89.73 1.76 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.285 179.762 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.49 ' C ' ' H ' ' A' ' 656' ' ' ALA . 2.8 p90 -104.85 -55.01 2.4 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.039 -179.564 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.562 ' OG ' ' HB ' ' A' ' 677' ' ' THR . 0.7 OUTLIER -78.98 26.09 0.26 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.791 178.899 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.661 ' HB2' ' CD2' ' A' ' 678' ' ' LEU . . . -108.87 -41.21 4.81 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.225 -0.898 . . . . 0.0 108.643 178.461 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.476 ' O ' ' CD1' ' A' ' 661' ' ' TYR . 2.8 tt0 -60.94 -49.46 77.38 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.587 ' O ' ' HE3' ' A' ' 658' ' ' TRP . 0.0 OUTLIER -73.0 -5.24 37.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.181 177.531 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.716 ' HB2' ' CD1' ' A' ' 674' ' ' ILE . . . -106.72 9.36 31.18 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.497 178.467 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 661' ' ' TYR . 0.0 OUTLIER -109.9 -34.24 6.49 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.331 -0.547 . . . . 0.0 110.643 178.375 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 658' ' ' TRP . 20.9 p90 -100.6 13.0 36.17 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.025 177.573 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.969 ' CZ ' ' HB1' ' A' ' 671' ' ' ALA . 0.0 OUTLIER -102.98 -26.21 13.17 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.757 177.996 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.775 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 0.5 OUTLIER -81.69 -0.56 43.31 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.715 178.924 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 1.1 t -124.31 -19.56 5.47 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -179.604 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.59 HG22 ' HA ' ' A' ' 662' ' ' TYR . 28.4 m -93.65 28.51 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.82 0.343 . . . . 0.0 111.343 179.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 78.5 10.23 86.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.922 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.682 ' O ' ' HB2' ' A' ' 671' ' ' ALA . 5.0 mmmt -105.32 20.75 18.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 117.003 0.401 . . . . 0.0 110.814 179.405 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' A' ' 671' ' ' ALA . 2.3 tp -55.99 -39.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.01 -179.627 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -75.18 -56.92 4.24 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.628 -0.429 . . . . 0.0 109.902 179.636 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.08 -16.43 59.91 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.788 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.969 ' HB1' ' CZ ' ' A' ' 662' ' ' TYR . . . -60.33 -41.25 93.14 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.125 179.253 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -49.49 -25.34 2.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.404 179.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -72.62 -62.39 1.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.766 HG23 ' CE2' ' A' ' 662' ' ' TYR . 0.0 OUTLIER -70.03 -7.1 7.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 C-N-CA 120.472 -0.491 . . . . 0.0 109.909 179.494 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 671' ' ' ALA . 5.1 tm-20 -75.83 -32.24 59.72 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.482 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -75.1 -4.13 36.78 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.69 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.562 ' HB ' ' OG ' ' A' ' 655' ' ' SER . 0.7 OUTLIER -96.21 -13.34 23.55 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.552 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.702 HD22 ' O ' ' A' ' 678' ' ' LEU . 1.2 tm? -75.68 -26.58 57.76 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.27 179.379 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 1.2 mtmp? -64.06 69.51 0.02 OUTLIER 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.016 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . 0.559 HD22 ' HB1' ' A' ' 652' ' ' ALA . 62.0 t30 -109.78 -55.64 2.41 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.793 179.88 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . 0.836 ' HB2' ' HB3' ' A' ' 652' ' ' ALA . 39.3 mmtt -149.09 140.69 23.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.807 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -135.69 82.41 1.95 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.931 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 53.8 t30 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.859 179.915 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.522 -0.231 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -106.27 -46.97 3.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.798 0.333 . . . . 0.0 111.204 -179.819 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 3.5 p30 43.61 36.23 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.141 -179.662 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.483 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -62.4 -9.83 9.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.481 -0.781 . . . . 0.0 112.114 179.903 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.625 ' O ' ' HB2' ' A' ' 659' ' ' ALA . 0.3 OUTLIER -94.8 26.24 3.66 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 121.147 0.498 . . . . 0.0 110.254 178.937 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 678' ' ' LEU . . . -110.17 -38.57 5.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.536 178.817 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.436 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 7.9 tt0 -67.13 -39.11 86.55 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.677 -179.556 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.436 ' CE3' ' HB3' ' A' ' 657' ' ' GLN . 3.6 m-90 -84.6 -20.64 31.1 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.727 ' HA ' ' CD2' ' A' ' 662' ' ' TYR . . . -74.31 -35.59 63.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -179.425 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -76.31 -3.67 38.0 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.837 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 1.017 ' O ' HG23 ' A' ' 665' ' ' VAL . 21.8 m-85 -94.98 -34.94 12.17 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 178.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.79 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.3 OUTLIER -56.18 -39.26 72.11 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.655 179.196 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.79 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 3.1 ptm85 -62.09 -8.2 5.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.689 -179.557 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.97 -18.58 1.81 Allowed 'General case' 0 C--O 1.231 0.123 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 1.017 HG23 ' O ' ' A' ' 661' ' ' TYR . 7.5 t -89.76 19.19 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.606 0.241 . . . . 0.0 110.469 179.181 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 66.52 29.22 74.44 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.504 -0.855 . . . . 0.0 111.199 -178.763 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.715 ' HB3' ' HB2' ' A' ' 662' ' ' TYR . 0.7 OUTLIER -114.8 14.46 17.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 179.582 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.76 HD13 ' O ' ' A' ' 668' ' ' ILE . 0.0 OUTLIER -49.03 -25.81 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.031 -179.627 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -86.39 -56.91 3.22 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.662 178.9 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . 0.507 ' O ' ' HB3' ' A' ' 673' ' ' ALA . 1.1 tp10 -62.24 -15.99 50.65 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 176.612 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.731 ' CB ' ' CG ' ' A' ' 662' ' ' TYR . . . -50.48 -47.03 57.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.678 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -51.16 -21.67 2.12 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.352 -0.539 . . . . 0.0 110.986 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 670' ' ' GLU . . . -74.89 -67.55 0.63 Allowed 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.027 0.442 . . . . 0.0 111.456 179.47 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -67.84 -13.16 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.256 -179.64 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -80.4 -24.21 39.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.258 178.502 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 5.2 mtpt -82.05 -15.77 52.41 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.586 179.943 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.505 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -82.93 -16.39 47.56 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 177.925 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.446 ' CD1' ' HA ' ' A' ' 656' ' ' ALA . 0.3 OUTLIER -55.88 -33.8 64.92 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.284 178.137 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.77 38.14 0.62 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.316 178.754 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -59.85 -45.7 91.61 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.964 -179.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 3.2 tptt -98.09 143.9 28.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.855 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -95.37 103.58 15.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.927 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.196 -0.906 . . . . 0.0 110.828 -179.995 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 651' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 652' ' ' ALA . . . . . . . . . . . . . . . -59.0 -59.68 5.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.988 0.423 . . . . 0.0 111.124 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 653' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 66.53 105.71 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.568 -179.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 654' ' ' TYR . . . . . 0.488 ' CD1' ' N ' ' A' ' 654' ' ' TYR . 0.0 OUTLIER -145.79 -7.61 0.57 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.921 -179.622 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 655' ' ' SER . . . . . 0.587 ' OG ' HG12 ' A' ' 674' ' ' ILE . 0.4 OUTLIER -96.55 24.49 5.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.145 178.958 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 656' ' ' ALA . . . . . 0.538 ' HB2' HD21 ' A' ' 678' ' ' LEU . . . -109.16 -41.96 4.54 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.771 179.088 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 657' ' ' GLN . . . . . 0.47 ' HB3' ' CE3' ' A' ' 658' ' ' TRP . 0.7 OUTLIER -66.25 -31.21 71.89 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.221 -179.944 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 658' ' ' TRP . . . . . 0.587 ' HA ' ' CE1' ' A' ' 661' ' ' TYR . 1.7 m-90 -87.14 -20.07 27.57 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 177.462 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 659' ' ' ALA . . . . . 0.756 ' O ' ' CE1' ' A' ' 662' ' ' TYR . . . -89.93 5.42 46.5 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.317 179.527 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.35 -12.2 13.05 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.99 178.273 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 661' ' ' TYR . . . . . 0.611 ' O ' HG22 ' A' ' 665' ' ' VAL . 1.6 p90 -111.72 1.11 16.53 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.725 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 662' ' ' TYR . . . . . 0.853 ' HD1' ' N ' ' A' ' 663' ' ' ARG . 0.0 OUTLIER -95.64 -27.04 15.5 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.36 179.334 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 663' ' ' ARG . . . . . 0.853 ' N ' ' HD1' ' A' ' 662' ' ' TYR . 19.4 mtp180 -81.54 -1.41 46.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.563 178.847 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 664' ' ' SER . . . . . . . . . . . . . 2.6 m -119.9 -26.0 5.71 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.755 -179.52 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 665' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 661' ' ' TYR . 24.1 m -92.73 31.21 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.904 0.383 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 666' ' ' GLY . . . . . . . . . . . . . . . 67.0 23.52 72.86 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.318 -179.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 671' ' ' ALA . 0.4 OUTLIER -107.83 15.59 24.37 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.773 0.32 . . . . 0.0 111.261 179.665 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 668' ' ' ILE . . . . . 0.411 HG13 ' HA ' ' A' ' 663' ' ' ARG . 2.8 mt -51.5 -32.26 13.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.197 -179.618 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 669' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -79.89 -59.67 2.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.223 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 670' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -61.9 -16.41 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.592 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 671' ' ' ALA . . . . . 0.826 ' HB1' ' CZ ' ' A' ' 662' ' ' TYR . . . -58.87 -40.88 85.66 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.034 179.158 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -48.87 -23.78 1.22 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.616 -0.433 . . . . 0.0 111.194 179.308 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 673' ' ' ALA . . . . . . . . . . . . . . . -70.8 -68.35 0.44 Allowed 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 179.855 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 674' ' ' ILE . . . . . 0.696 HD13 ' HB2' ' A' ' 659' ' ' ALA . 0.0 OUTLIER -68.0 -8.81 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.503 -0.479 . . . . 0.0 109.834 179.93 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 675' ' ' GLU . . . . . 0.455 ' HB2' ' OH ' ' A' ' 662' ' ' TYR . 16.5 tm-20 -77.0 -29.89 55.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.05 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -9.32 58.69 Favored 'General case' 0 C--O 1.232 0.132 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.398 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 677' ' ' THR . . . . . 0.486 ' OG1' ' OG ' ' A' ' 655' ' ' SER . 0.0 OUTLIER -91.06 -15.94 28.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 177.87 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.538 HD21 ' HB2' ' A' ' 656' ' ' ALA . 0.6 OUTLIER -59.53 -33.55 71.51 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.277 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 679' ' ' LYS . . . . . . . . . . . . . 3.5 ttmt -57.62 -18.59 20.97 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.551 178.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 680' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -42.8 144.2 0.61 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.486 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 681' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.68 161.73 40.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.81 -179.989 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 682' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.49 -47.83 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.867 -179.98 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 683' ' ' ASN . . . . . . . . . . . . . 53.8 p30 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.855 -179.975 . . . . . . . . 0 0 . 1 stop_ save_