NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
396944 | 1spw | 6263 | cing | 4-filtered-FRED | STAR | entry | full | 2 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1spw # This FRED archive file contains, for PDB entry <1spw>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1spw _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1spw _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all free" _Assembly.Molecular_mass 4373.80 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $Rubredoxin A . 1 1 stop_ save_ save_Rubredoxin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name Rubredoxin _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code MDIYVCTVCGYEYDPAFEDLPDDWACPVCGASKDAFEKQ _Entity.Number_of_monomers 39 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 MET . 1 1 2 ASP . 1 1 3 ILE . 1 1 4 TYR . 1 1 5 VAL . 1 1 6 CYS . 1 1 7 THR . 1 1 8 VAL . 1 1 9 CYS . 1 1 10 GLY . 1 1 11 TYR . 1 1 12 GLU . 1 1 13 TYR . 1 1 14 ASP . 1 1 15 PRO . 1 1 16 ALA . 1 1 17 PHE . 1 1 18 GLU . 1 1 19 ASP . 1 1 20 LEU . 1 1 21 PRO . 1 1 22 ASP . 1 1 23 ASP . 1 1 24 TRP . 1 1 25 ALA . 1 1 26 CYS . 1 1 27 PRO . 1 1 28 VAL . 1 1 29 CYS . 1 1 30 GLY . 1 1 31 ALA . 1 1 32 SER . 1 1 33 LYS . 1 1 34 ASP . 1 1 35 ALA . 1 1 36 PHE . 1 1 37 GLU . 1 1 38 LYS . 1 1 39 GLN . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID MET 1 1 1 1 ASP 2 2 1 1 ILE 3 3 1 1 TYR 4 4 1 1 VAL 5 5 1 1 CYS 6 6 1 1 THR 7 7 1 1 VAL 8 8 1 1 CYS 9 9 1 1 GLY 10 10 1 1 TYR 11 11 1 1 GLU 12 12 1 1 TYR 13 13 1 1 ASP 14 14 1 1 PRO 15 15 1 1 ALA 16 16 1 1 PHE 17 17 1 1 GLU 18 18 1 1 ASP 19 19 1 1 LEU 20 20 1 1 PRO 21 21 1 1 ASP 22 22 1 1 ASP 23 23 1 1 TRP 24 24 1 1 ALA 25 25 1 1 CYS 26 26 1 1 PRO 27 27 1 1 VAL 28 28 1 1 CYS 29 29 1 1 GLY 30 30 1 1 ALA 31 31 1 1 SER 32 32 1 1 LYS 33 33 1 1 ASP 34 34 1 1 ALA 35 35 1 1 PHE 36 36 1 1 GLU 37 37 1 1 LYS 38 38 1 1 GLN 39 39 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 24 TRP HE3 . 24 TRP HE3 1 1 1 1 2 1 1 33 LYS HG3 . 33 LYS HG3 1 1 2 1 1 1 1 27 PRO HA . 27 FPR HA 1 1 2 1 2 1 1 28 VAL H . 28 VAL HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 14.8 1 1 2 1 . . . . . . . 3.89 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 MET C C 3.518 0.448 -1.017 1.00 . A A . 1 MET C 1 1 1 2 1 1 1 MET CA C 2.073 0.000 -1.245 1.00 . A A . 1 MET CA 1 1 1 3 1 1 1 MET CB C 1.399 0.940 -2.246 1.00 . A A . 1 MET CB 1 1 1 4 1 1 1 MET CE C 0.545 0.324 -6.221 1.00 . A A . 1 MET CE 1 1 1 5 1 1 1 MET CG C 1.540 0.412 -3.675 1.00 . A A . 1 MET CG 1 1 1 6 1 1 1 MET H1 H 1.884 0.000 0.829 1.00 . A A . 1 MET H1 1 1 1 7 1 1 1 MET HA H 2.057 -1.032 -1.597 1.00 . A A . 1 MET HA 1 1 1 8 1 1 1 MET HB2 H 0.343 1.047 -1.997 1.00 . A A . 1 MET HB2 1 1 1 9 1 1 1 MET HB3 H 1.845 1.933 -2.176 1.00 . A A . 1 MET HB3 1 1 1 10 1 1 1 MET HE1 H -0.481 0.132 -6.534 1.00 . A A . 1 MET HE1 1 1 1 11 1 1 1 MET HE2 H 1.087 0.810 -7.033 1.00 . A A . 1 MET HE2 1 1 1 12 1 1 1 MET HE3 H 1.032 -0.619 -5.973 1.00 . A A . 1 MET HE3 1 1 1 13 1 1 1 MET HG2 H 2.584 0.449 -3.984 1.00 . A A . 1 MET HG2 1 1 1 14 1 1 1 MET HG3 H 1.231 -0.632 -3.718 1.00 . A A . 1 MET HG3 1 1 1 15 1 1 1 MET N N 1.325 0.000 0.000 1.00 . A A . 1 MET N 1 1 1 16 1 1 1 MET O O 4.456 -0.278 -1.341 1.00 . A A . 1 MET O 1 1 1 17 1 1 1 MET SD S 0.541 1.388 -4.788 1.00 . A A . 1 MET SD 1 1 1 18 1 1 2 ASP C C 4.836 3.696 0.093 1.00 . A A . 2 ASP C 1 1 1 19 1 1 2 ASP CA C 4.967 2.197 -0.184 1.00 . A A . 2 ASP CA 1 1 1 20 1 1 2 ASP CB C 5.903 2.017 -1.382 1.00 . A A . 2 ASP CB 1 1 1 21 1 1 2 ASP CG C 5.279 2.335 -2.743 1.00 . A A . 2 ASP CG 1 1 1 22 1 1 2 ASP H H 2.884 2.228 -0.199 1.00 . A A . 2 ASP H 1 1 1 23 1 1 2 ASP HA H 5.336 1.643 0.679 1.00 . A A . 2 ASP HA 1 1 1 24 1 1 2 ASP HB2 H 6.775 2.655 -1.241 1.00 . A A . 2 ASP HB2 1 1 1 25 1 1 2 ASP HB3 H 6.259 0.988 -1.394 1.00 . A A . 2 ASP HB3 1 1 1 26 1 1 2 ASP HD2 H 4.908 4.123 -3.203 1.00 . A A . 2 ASP HD2 1 1 1 27 1 1 2 ASP N N 3.652 1.643 -0.460 1.00 . A A . 2 ASP N 1 1 1 28 1 1 2 ASP O O 5.469 4.512 -0.575 1.00 . A A . 2 ASP O 1 1 1 29 1 1 2 ASP OD1 O 4.481 1.552 -3.278 1.00 . A A . 2 ASP OD1 1 1 1 30 1 1 2 ASP OD2 O 5.650 3.455 -3.264 1.00 . A A . 2 ASP OD2 1 1 1 31 1 1 3 ILE C C 3.490 5.477 2.952 1.00 . A A . 3 ILE C 1 1 1 32 1 1 3 ILE CA C 3.789 5.399 1.454 1.00 . A A . 3 ILE CA 1 1 1 33 1 1 3 ILE CB C 2.703 6.024 0.576 1.00 . A A . 3 ILE CB 1 1 1 34 1 1 3 ILE CD1 C 4.338 7.132 -0.991 1.00 . A A . 3 ILE CD1 1 1 1 35 1 1 3 ILE CG1 C 3.174 6.147 -0.875 1.00 . A A . 3 ILE CG1 1 1 1 36 1 1 3 ILE CG2 C 2.243 7.367 1.145 1.00 . A A . 3 ILE CG2 1 1 1 37 1 1 3 ILE H H 3.500 3.343 1.618 1.00 . A A . 3 ILE H 1 1 1 38 1 1 3 ILE HA H 4.714 5.942 1.258 1.00 . A A . 3 ILE HA 1 1 1 39 1 1 3 ILE HB H 1.838 5.360 0.579 1.00 . A A . 3 ILE HB 1 1 1 40 1 1 3 ILE HD11 H 5.229 6.697 -0.538 1.00 . A A . 3 ILE HD11 1 1 1 41 1 1 3 ILE HD12 H 4.532 7.343 -2.043 1.00 . A A . 3 ILE HD12 1 1 1 42 1 1 3 ILE HD13 H 4.084 8.058 -0.476 1.00 . A A . 3 ILE HD13 1 1 1 43 1 1 3 ILE HG12 H 3.481 5.169 -1.245 1.00 . A A . 3 ILE HG12 1 1 1 44 1 1 3 ILE HG13 H 2.347 6.480 -1.502 1.00 . A A . 3 ILE HG13 1 1 1 45 1 1 3 ILE HG21 H 1.540 7.195 1.960 1.00 . A A . 3 ILE HG21 1 1 1 46 1 1 3 ILE HG22 H 3.106 7.918 1.520 1.00 . A A . 3 ILE HG22 1 1 1 47 1 1 3 ILE HG23 H 1.755 7.946 0.361 1.00 . A A . 3 ILE HG23 1 1 1 48 1 1 3 ILE N N 4.011 4.013 1.080 1.00 . A A . 3 ILE N 1 1 1 49 1 1 3 ILE O O 2.827 4.619 3.531 1.00 . A A . 3 ILE O 1 1 1 50 1 1 4 TYR C C 3.216 8.143 5.228 1.00 . A A . 4 TYR C 1 1 1 51 1 1 4 TYR CA C 3.808 6.760 4.994 1.00 . A A . 4 TYR CA 1 1 1 52 1 1 4 TYR CB C 5.144 6.616 5.716 1.00 . A A . 4 TYR CB 1 1 1 53 1 1 4 TYR CD1 C 4.883 4.413 6.914 1.00 . A A . 4 TYR CD1 1 1 1 54 1 1 4 TYR CD2 C 6.592 4.616 5.206 1.00 . A A . 4 TYR CD2 1 1 1 55 1 1 4 TYR CE1 C 5.259 3.082 7.132 1.00 . A A . 4 TYR CE1 1 1 1 56 1 1 4 TYR CE2 C 6.968 3.285 5.424 1.00 . A A . 4 TYR CE2 1 1 1 57 1 1 4 TYR CG C 5.550 5.180 5.951 1.00 . A A . 4 TYR CG 1 1 1 58 1 1 4 TYR CZ C 6.301 2.518 6.387 1.00 . A A . 4 TYR CZ 1 1 1 59 1 1 4 TYR H H 4.538 7.219 3.053 1.00 . A A . 4 TYR H 1 1 1 60 1 1 4 TYR HA H 3.116 6.010 5.377 1.00 . A A . 4 TYR HA 1 1 1 61 1 1 4 TYR HB2 H 5.917 7.102 5.120 1.00 . A A . 4 TYR HB2 1 1 1 62 1 1 4 TYR HB3 H 5.077 7.120 6.680 1.00 . A A . 4 TYR HB3 1 1 1 63 1 1 4 TYR HD1 H 4.079 4.849 7.489 1.00 . A A . 4 TYR HD1 1 1 1 64 1 1 4 TYR HD2 H 7.107 5.208 4.463 1.00 . A A . 4 TYR HD2 1 1 1 65 1 1 4 TYR HE1 H 4.745 2.491 7.875 1.00 . A A . 4 TYR HE1 1 1 1 66 1 1 4 TYR HE2 H 7.772 2.850 4.849 1.00 . A A . 4 TYR HE2 1 1 1 67 1 1 4 TYR HH H 7.487 1.138 7.091 1.00 . A A . 4 TYR HH 1 1 1 68 1 1 4 TYR N N 4.000 6.542 3.575 1.00 . A A . 4 TYR N 1 1 1 69 1 1 4 TYR O O 3.957 9.053 5.595 1.00 . A A . 4 TYR O 1 1 1 70 1 1 4 TYR OH O 6.667 1.221 6.599 1.00 . A A . 4 TYR OH 1 1 1 71 1 1 5 VAL C C 0.743 9.645 6.650 1.00 . A A . 5 VAL C 1 1 1 72 1 1 5 VAL CA C 1.250 9.552 5.210 1.00 . A A . 5 VAL CA 1 1 1 73 1 1 5 VAL CB C 0.139 9.727 4.173 1.00 . A A . 5 VAL CB 1 1 1 74 1 1 5 VAL CG1 C -0.724 10.949 4.494 1.00 . A A . 5 VAL CG1 1 1 1 75 1 1 5 VAL CG2 C 0.718 9.822 2.760 1.00 . A A . 5 VAL CG2 1 1 1 76 1 1 5 VAL H H 1.318 7.530 4.717 1.00 . A A . 5 VAL H 1 1 1 77 1 1 5 VAL HA H 1.990 10.336 5.047 1.00 . A A . 5 VAL HA 1 1 1 78 1 1 5 VAL HB H -0.500 8.846 4.214 1.00 . A A . 5 VAL HB 1 1 1 79 1 1 5 VAL HG11 H -0.410 11.375 5.448 1.00 . A A . 5 VAL HG11 1 1 1 80 1 1 5 VAL HG12 H -0.606 11.695 3.708 1.00 . A A . 5 VAL HG12 1 1 1 81 1 1 5 VAL HG13 H -1.770 10.649 4.557 1.00 . A A . 5 VAL HG13 1 1 1 82 1 1 5 VAL HG21 H 1.104 10.827 2.591 1.00 . A A . 5 VAL HG21 1 1 1 83 1 1 5 VAL HG22 H 1.527 9.099 2.649 1.00 . A A . 5 VAL HG22 1 1 1 84 1 1 5 VAL HG23 H -0.064 9.606 2.031 1.00 . A A . 5 VAL HG23 1 1 1 85 1 1 5 VAL N N 1.914 8.275 5.016 1.00 . A A . 5 VAL N 1 1 1 86 1 1 5 VAL O O -0.085 8.840 7.074 1.00 . A A . 5 VAL O 1 1 1 87 1 1 6 CYS C C -0.656 10.872 8.818 1.00 . A A . 6 CYS C 1 1 1 88 1 1 6 CYS CA C 0.872 10.842 8.748 1.00 . A A . 6 CYS CA 1 1 1 89 1 1 6 CYS CB C 1.495 12.114 9.326 1.00 . A A . 6 CYS CB 1 1 1 90 1 1 6 CYS H H 1.935 11.284 7.012 1.00 . A A . 6 CYS H 1 1 1 91 1 1 6 CYS HA H 1.269 10.000 9.315 1.00 . A A . 6 CYS HA 1 1 1 92 1 1 6 CYS HB2 H 2.527 12.185 8.983 1.00 . A A . 6 CYS HB2 1 1 1 93 1 1 6 CYS HB3 H 0.965 12.977 8.922 1.00 . A A . 6 CYS HB3 1 1 1 94 1 1 6 CYS N N 1.262 10.634 7.364 1.00 . A A . 6 CYS N 1 1 1 95 1 1 6 CYS O O -1.314 11.334 7.887 1.00 . A A . 6 CYS O 1 1 1 96 1 1 6 CYS SG S 1.476 12.216 11.153 1.00 . A A . 6 CYS SG 1 1 1 97 1 1 7 THR C C -3.035 11.395 11.155 1.00 . A A . 7 THR C 1 1 1 98 1 1 7 THR CA C -2.614 10.338 10.133 1.00 . A A . 7 THR CA 1 1 1 99 1 1 7 THR CB C -2.999 8.914 10.538 1.00 . A A . 7 THR CB 1 1 1 100 1 1 7 THR CG2 C -2.427 7.859 9.589 1.00 . A A . 7 THR CG2 1 1 1 101 1 1 7 THR H H -0.633 10.000 10.682 1.00 . A A . 7 THR H 1 1 1 102 1 1 7 THR HA H -3.101 10.592 9.191 1.00 . A A . 7 THR HA 1 1 1 103 1 1 7 THR HB H -4.081 8.813 10.625 1.00 . A A . 7 THR HB 1 1 1 104 1 1 7 THR HG1 H -2.613 9.345 12.454 1.00 . A A . 7 THR HG1 1 1 1 105 1 1 7 THR HG21 H -2.818 6.878 9.856 1.00 . A A . 7 THR HG21 1 1 1 106 1 1 7 THR HG22 H -2.714 8.099 8.565 1.00 . A A . 7 THR HG22 1 1 1 107 1 1 7 THR HG23 H -1.339 7.851 9.668 1.00 . A A . 7 THR HG23 1 1 1 108 1 1 7 THR N N -1.176 10.374 9.930 1.00 . A A . 7 THR N 1 1 1 109 1 1 7 THR O O -4.108 11.298 11.749 1.00 . A A . 7 THR O 1 1 1 110 1 1 7 THR OG1 O -2.297 8.698 11.759 1.00 . A A . 7 THR OG1 1 1 1 111 1 1 8 VAL C C -2.574 14.774 11.507 1.00 . A A . 8 VAL C 1 1 1 112 1 1 8 VAL CA C -2.436 13.456 12.271 1.00 . A A . 8 VAL CA 1 1 1 113 1 1 8 VAL CB C -1.345 13.498 13.343 1.00 . A A . 8 VAL CB 1 1 1 114 1 1 8 VAL CG1 C -1.344 14.843 14.072 1.00 . A A . 8 VAL CG1 1 1 1 115 1 1 8 VAL CG2 C -1.501 12.339 14.330 1.00 . A A . 8 VAL CG2 1 1 1 116 1 1 8 VAL H H -1.297 12.453 10.844 1.00 . A A . 8 VAL H 1 1 1 117 1 1 8 VAL HA H -3.383 13.234 12.762 1.00 . A A . 8 VAL HA 1 1 1 118 1 1 8 VAL HB H -0.382 13.386 12.845 1.00 . A A . 8 VAL HB 1 1 1 119 1 1 8 VAL HG11 H -2.235 15.406 13.796 1.00 . A A . 8 VAL HG11 1 1 1 120 1 1 8 VAL HG12 H -1.340 14.672 15.149 1.00 . A A . 8 VAL HG12 1 1 1 121 1 1 8 VAL HG13 H -0.455 15.408 13.791 1.00 . A A . 8 VAL HG13 1 1 1 122 1 1 8 VAL HG21 H -0.750 12.426 15.115 1.00 . A A . 8 VAL HG21 1 1 1 123 1 1 8 VAL HG22 H -2.497 12.372 14.773 1.00 . A A . 8 VAL HG22 1 1 1 124 1 1 8 VAL HG23 H -1.369 11.393 13.804 1.00 . A A . 8 VAL HG23 1 1 1 125 1 1 8 VAL N N -2.168 12.381 11.330 1.00 . A A . 8 VAL N 1 1 1 126 1 1 8 VAL O O -3.556 15.495 11.677 1.00 . A A . 8 VAL O 1 1 1 127 1 1 9 CYS C C -1.825 15.894 8.428 1.00 . A A . 9 CYS C 1 1 1 128 1 1 9 CYS CA C -1.572 16.269 9.890 1.00 . A A . 9 CYS CA 1 1 1 129 1 1 9 CYS CB C -0.269 17.051 10.061 1.00 . A A . 9 CYS CB 1 1 1 130 1 1 9 CYS H H -0.780 14.458 10.548 1.00 . A A . 9 CYS H 1 1 1 131 1 1 9 CYS HA H -2.379 16.893 10.274 1.00 . A A . 9 CYS HA 1 1 1 132 1 1 9 CYS HB2 H -0.117 17.675 9.180 1.00 . A A . 9 CYS HB2 1 1 1 133 1 1 9 CYS HB3 H -0.374 17.723 10.913 1.00 . A A . 9 CYS HB3 1 1 1 134 1 1 9 CYS N N -1.575 15.050 10.681 1.00 . A A . 9 CYS N 1 1 1 135 1 1 9 CYS O O -2.254 16.729 7.634 1.00 . A A . 9 CYS O 1 1 1 136 1 1 9 CYS SG S 1.220 16.017 10.311 1.00 . A A . 9 CYS SG 1 1 1 137 1 1 10 GLY C C -0.479 14.341 5.923 1.00 . A A . 10 GLY C 1 1 1 138 1 1 10 GLY CA C -1.740 14.140 6.765 1.00 . A A . 10 GLY CA 1 1 1 139 1 1 10 GLY H H -1.200 13.962 8.769 1.00 . A A . 10 GLY H 1 1 1 140 1 1 10 GLY HA2 H -1.997 13.081 6.795 1.00 . A A . 10 GLY HA2 1 1 1 141 1 1 10 GLY HA3 H -2.579 14.657 6.300 1.00 . A A . 10 GLY HA3 1 1 1 142 1 1 10 GLY N N -1.548 14.636 8.117 1.00 . A A . 10 GLY N 1 1 1 143 1 1 10 GLY O O -0.516 14.403 4.696 1.00 . A A . 10 GLY O 1 1 1 144 1 1 11 TYR C C 2.155 13.552 4.927 1.00 . A A . 11 TYR C 1 1 1 145 1 1 11 TYR CA C 1.935 14.638 5.971 1.00 . A A . 11 TYR CA 1 1 1 146 1 1 11 TYR CB C 3.044 14.615 7.019 1.00 . A A . 11 TYR CB 1 1 1 147 1 1 11 TYR CD1 C 4.377 16.372 5.799 1.00 . A A . 11 TYR CD1 1 1 1 148 1 1 11 TYR CD2 C 5.551 14.492 6.782 1.00 . A A . 11 TYR CD2 1 1 1 149 1 1 11 TYR CE1 C 5.593 16.890 5.337 1.00 . A A . 11 TYR CE1 1 1 1 150 1 1 11 TYR CE2 C 6.767 15.010 6.320 1.00 . A A . 11 TYR CE2 1 1 1 151 1 1 11 TYR CG C 4.356 15.173 6.521 1.00 . A A . 11 TYR CG 1 1 1 152 1 1 11 TYR CZ C 6.788 16.209 5.598 1.00 . A A . 11 TYR CZ 1 1 1 153 1 1 11 TYR H H 0.631 14.386 7.628 1.00 . A A . 11 TYR H 1 1 1 154 1 1 11 TYR HA H 1.937 15.610 5.476 1.00 . A A . 11 TYR HA 1 1 1 155 1 1 11 TYR HB2 H 2.722 15.199 7.880 1.00 . A A . 11 TYR HB2 1 1 1 156 1 1 11 TYR HB3 H 3.203 13.584 7.335 1.00 . A A . 11 TYR HB3 1 1 1 157 1 1 11 TYR HD1 H 3.455 16.898 5.598 1.00 . A A . 11 TYR HD1 1 1 1 158 1 1 11 TYR HD2 H 5.535 13.567 7.339 1.00 . A A . 11 TYR HD2 1 1 1 159 1 1 11 TYR HE1 H 5.609 17.815 4.780 1.00 . A A . 11 TYR HE1 1 1 1 160 1 1 11 TYR HE2 H 7.689 14.484 6.521 1.00 . A A . 11 TYR HE2 1 1 1 161 1 1 11 TYR HH H 7.959 16.924 4.211 1.00 . A A . 11 TYR HH 1 1 1 162 1 1 11 TYR N N 0.655 14.443 6.620 1.00 . A A . 11 TYR N 1 1 1 163 1 1 11 TYR O O 1.471 12.531 4.978 1.00 . A A . 11 TYR O 1 1 1 164 1 1 11 TYR OH O 7.973 16.713 5.148 1.00 . A A . 11 TYR OH 1 1 1 165 1 1 12 GLU C C 4.865 12.453 2.985 1.00 . A A . 12 GLU C 1 1 1 166 1 1 12 GLU CA C 3.378 12.814 2.976 1.00 . A A . 12 GLU CA 1 1 1 167 1 1 12 GLU CB C 2.950 13.336 1.603 1.00 . A A . 12 GLU CB 1 1 1 168 1 1 12 GLU CD C 1.707 12.758 -0.513 1.00 . A A . 12 GLU CD 1 1 1 169 1 1 12 GLU CG C 1.917 12.407 0.961 1.00 . A A . 12 GLU CG 1 1 1 170 1 1 12 GLU H H 3.641 14.619 3.982 1.00 . A A . 12 GLU H 1 1 1 171 1 1 12 GLU HA H 2.783 11.936 3.226 1.00 . A A . 12 GLU HA 1 1 1 172 1 1 12 GLU HB2 H 2.530 14.337 1.706 1.00 . A A . 12 GLU HB2 1 1 1 173 1 1 12 GLU HB3 H 3.821 13.421 0.954 1.00 . A A . 12 GLU HB3 1 1 1 174 1 1 12 GLU HE2 H -0.104 12.403 -0.892 1.00 . A A . 12 GLU HE2 1 1 1 175 1 1 12 GLU HG2 H 2.249 11.373 1.049 1.00 . A A . 12 GLU HG2 1 1 1 176 1 1 12 GLU HG3 H 0.971 12.485 1.496 1.00 . A A . 12 GLU HG3 1 1 1 177 1 1 12 GLU N N 3.089 13.786 4.016 1.00 . A A . 12 GLU N 1 1 1 178 1 1 12 GLU O O 5.746 13.310 2.937 1.00 . A A . 12 GLU O 1 1 1 179 1 1 12 GLU OE1 O 2.639 12.628 -1.321 1.00 . A A . 12 GLU OE1 1 1 1 180 1 1 12 GLU OE2 O 0.523 13.177 -0.810 1.00 . A A . 12 GLU OE2 1 1 1 181 1 1 13 TYR C C 6.578 9.373 2.232 1.00 . A A . 13 TYR C 1 1 1 182 1 1 13 TYR CA C 6.487 10.641 3.069 1.00 . A A . 13 TYR CA 1 1 1 183 1 1 13 TYR CB C 6.906 10.369 4.511 1.00 . A A . 13 TYR CB 1 1 1 184 1 1 13 TYR CD1 C 8.551 8.460 4.443 1.00 . A A . 13 TYR CD1 1 1 1 185 1 1 13 TYR CD2 C 9.367 10.686 4.952 1.00 . A A . 13 TYR CD2 1 1 1 186 1 1 13 TYR CE1 C 9.851 7.956 4.560 1.00 . A A . 13 TYR CE1 1 1 1 187 1 1 13 TYR CE2 C 10.668 10.181 5.069 1.00 . A A . 13 TYR CE2 1 1 1 188 1 1 13 TYR CG C 8.309 9.825 4.638 1.00 . A A . 13 TYR CG 1 1 1 189 1 1 13 TYR CZ C 10.910 8.816 4.873 1.00 . A A . 13 TYR CZ 1 1 1 190 1 1 13 TYR H H 4.368 10.482 3.088 1.00 . A A . 13 TYR H 1 1 1 191 1 1 13 TYR HA H 7.150 11.394 2.644 1.00 . A A . 13 TYR HA 1 1 1 192 1 1 13 TYR HB2 H 6.841 11.300 5.074 1.00 . A A . 13 TYR HB2 1 1 1 193 1 1 13 TYR HB3 H 6.213 9.648 4.945 1.00 . A A . 13 TYR HB3 1 1 1 194 1 1 13 TYR HD1 H 7.734 7.796 4.201 1.00 . A A . 13 TYR HD1 1 1 1 195 1 1 13 TYR HD2 H 9.181 11.739 5.103 1.00 . A A . 13 TYR HD2 1 1 1 196 1 1 13 TYR HE1 H 10.038 6.903 4.409 1.00 . A A . 13 TYR HE1 1 1 1 197 1 1 13 TYR HE2 H 11.485 10.845 5.311 1.00 . A A . 13 TYR HE2 1 1 1 198 1 1 13 TYR HH H 12.850 8.953 4.714 1.00 . A A . 13 TYR HH 1 1 1 199 1 1 13 TYR N N 5.128 11.146 3.050 1.00 . A A . 13 TYR N 1 1 1 200 1 1 13 TYR O O 5.588 8.649 2.139 1.00 . A A . 13 TYR O 1 1 1 201 1 1 13 TYR OH O 12.177 8.325 4.987 1.00 . A A . 13 TYR OH 1 1 1 202 1 1 14 ASP C C 9.032 7.077 1.445 1.00 . A A . 14 ASP C 1 1 1 203 1 1 14 ASP CA C 7.936 7.948 0.827 1.00 . A A . 14 ASP CA 1 1 1 204 1 1 14 ASP CB C 8.374 8.325 -0.589 1.00 . A A . 14 ASP CB 1 1 1 205 1 1 14 ASP CG C 7.767 7.471 -1.704 1.00 . A A . 14 ASP CG 1 1 1 206 1 1 14 ASP H H 8.543 9.725 1.729 1.00 . A A . 14 ASP H 1 1 1 207 1 1 14 ASP HA H 6.967 7.449 0.811 1.00 . A A . 14 ASP HA 1 1 1 208 1 1 14 ASP HB2 H 8.113 9.369 -0.768 1.00 . A A . 14 ASP HB2 1 1 1 209 1 1 14 ASP HB3 H 9.460 8.254 -0.648 1.00 . A A . 14 ASP HB3 1 1 1 210 1 1 14 ASP HD2 H 6.204 8.515 -1.581 1.00 . A A . 14 ASP HD2 1 1 1 211 1 1 14 ASP N N 7.742 9.131 1.648 1.00 . A A . 14 ASP N 1 1 1 212 1 1 14 ASP O O 10.048 7.560 1.939 1.00 . A A . 14 ASP O 1 1 1 213 1 1 14 ASP OD1 O 8.284 6.395 -2.037 1.00 . A A . 14 ASP OD1 1 1 1 214 1 1 14 ASP OD2 O 6.702 7.959 -2.246 1.00 . A A . 14 ASP OD2 1 1 1 215 1 1 15 PRO C C 10.821 4.509 0.932 1.00 . A A . 15 PRO C 1 1 1 216 1 1 15 PRO CA C 9.698 4.759 1.929 1.00 . A A . 15 PRO CA 1 1 1 217 1 1 15 PRO CB C 8.834 3.511 2.104 1.00 . A A . 15 PRO CB 1 1 1 218 1 1 15 PRO CD C 7.614 5.161 0.833 1.00 . A A . 15 PRO CD 1 1 1 219 1 1 15 PRO CG C 7.771 3.664 1.085 1.00 . A A . 15 PRO CG 1 1 1 220 1 1 15 PRO HA H 10.117 5.068 2.887 1.00 . A A . 15 PRO HA 1 1 1 221 1 1 15 PRO HB2 H 9.407 2.591 1.990 1.00 . A A . 15 PRO HB2 1 1 1 222 1 1 15 PRO HB3 H 8.349 3.546 3.079 1.00 . A A . 15 PRO HB3 1 1 1 223 1 1 15 PRO HD2 H 7.534 5.369 -0.234 1.00 . A A . 15 PRO HD2 1 1 1 224 1 1 15 PRO HD3 H 6.734 5.534 1.358 1.00 . A A . 15 PRO HD3 1 1 1 225 1 1 15 PRO HG2 H 8.210 3.195 0.204 1.00 . A A . 15 PRO HG2 1 1 1 226 1 1 15 PRO HG3 H 6.827 3.186 1.347 1.00 . A A . 15 PRO HG3 1 1 1 227 1 1 15 PRO N N 8.798 5.763 1.406 1.00 . A A . 15 PRO N 1 1 1 228 1 1 15 PRO O O 10.847 3.441 0.322 1.00 . A A . 15 PRO O 1 1 1 229 1 1 16 ALA C C 14.090 5.901 0.500 1.00 . A A . 16 ALA C 1 1 1 230 1 1 16 ALA CA C 12.820 5.343 -0.145 1.00 . A A . 16 ALA CA 1 1 1 231 1 1 16 ALA CB C 12.476 6.046 -1.459 1.00 . A A . 16 ALA CB 1 1 1 232 1 1 16 ALA H H 11.682 6.345 1.283 1.00 . A A . 16 ALA H 1 1 1 233 1 1 16 ALA HA H 12.959 4.280 -0.341 1.00 . A A . 16 ALA HA 1 1 1 234 1 1 16 ALA HB1 H 13.296 5.918 -2.165 1.00 . A A . 16 ALA HB1 1 1 1 235 1 1 16 ALA HB2 H 11.566 5.614 -1.875 1.00 . A A . 16 ALA HB2 1 1 1 236 1 1 16 ALA HB3 H 12.320 7.109 -1.272 1.00 . A A . 16 ALA HB3 1 1 1 237 1 1 16 ALA N N 11.710 5.480 0.784 1.00 . A A . 16 ALA N 1 1 1 238 1 1 16 ALA O O 14.903 6.537 -0.169 1.00 . A A . 16 ALA O 1 1 1 239 1 1 17 PHE C C 16.374 4.973 2.776 1.00 . A A . 17 PHE C 1 1 1 240 1 1 17 PHE CA C 15.380 6.111 2.536 1.00 . A A . 17 PHE CA 1 1 1 241 1 1 17 PHE CB C 14.869 6.619 3.885 1.00 . A A . 17 PHE CB 1 1 1 242 1 1 17 PHE CD1 C 14.346 4.704 5.412 1.00 . A A . 17 PHE CD1 1 1 1 243 1 1 17 PHE CD2 C 12.550 5.800 4.353 1.00 . A A . 17 PHE CD2 1 1 1 244 1 1 17 PHE CE1 C 13.433 3.826 6.052 1.00 . A A . 17 PHE CE1 1 1 1 245 1 1 17 PHE CE2 C 11.636 4.922 4.994 1.00 . A A . 17 PHE CE2 1 1 1 246 1 1 17 PHE CG C 13.885 5.673 4.576 1.00 . A A . 17 PHE CG 1 1 1 247 1 1 17 PHE CZ C 12.097 3.953 5.830 1.00 . A A . 17 PHE CZ 1 1 1 248 1 1 17 PHE H H 13.556 5.124 2.330 1.00 . A A . 17 PHE H 1 1 1 249 1 1 17 PHE HA H 15.856 6.887 1.937 1.00 . A A . 17 PHE HA 1 1 1 250 1 1 17 PHE HB2 H 15.721 6.786 4.545 1.00 . A A . 17 PHE HB2 1 1 1 251 1 1 17 PHE HB3 H 14.386 7.586 3.739 1.00 . A A . 17 PHE HB3 1 1 1 252 1 1 17 PHE HD1 H 15.417 4.602 5.590 1.00 . A A . 17 PHE HD1 1 1 1 253 1 1 17 PHE HD2 H 12.180 6.577 3.683 1.00 . A A . 17 PHE HD2 1 1 1 254 1 1 17 PHE HE1 H 13.802 3.049 6.722 1.00 . A A . 17 PHE HE1 1 1 1 255 1 1 17 PHE HE2 H 10.566 5.024 4.815 1.00 . A A . 17 PHE HE2 1 1 1 256 1 1 17 PHE HZ H 11.396 3.279 6.321 1.00 . A A . 17 PHE HZ 1 1 1 257 1 1 17 PHE N N 14.222 5.642 1.793 1.00 . A A . 17 PHE N 1 1 1 258 1 1 17 PHE O O 16.221 3.883 2.226 1.00 . A A . 17 PHE O 1 1 1 259 1 1 18 GLU C C 18.678 4.282 5.420 1.00 . A A . 18 GLU C 1 1 1 260 1 1 18 GLU CA C 18.391 4.280 3.917 1.00 . A A . 18 GLU CA 1 1 1 261 1 1 18 GLU CB C 19.668 4.533 3.114 1.00 . A A . 18 GLU CB 1 1 1 262 1 1 18 GLU CD C 22.010 3.624 3.343 1.00 . A A . 18 GLU CD 1 1 1 263 1 1 18 GLU CG C 20.544 3.279 3.069 1.00 . A A . 18 GLU CG 1 1 1 264 1 1 18 GLU H H 17.489 6.154 4.040 1.00 . A A . 18 GLU H 1 1 1 265 1 1 18 GLU HA H 17.968 3.320 3.623 1.00 . A A . 18 GLU HA 1 1 1 266 1 1 18 GLU HB2 H 19.410 4.838 2.100 1.00 . A A . 18 GLU HB2 1 1 1 267 1 1 18 GLU HB3 H 20.227 5.355 3.562 1.00 . A A . 18 GLU HB3 1 1 1 268 1 1 18 GLU HE2 H 22.083 4.495 1.675 1.00 . A A . 18 GLU HE2 1 1 1 269 1 1 18 GLU HG2 H 20.192 2.558 3.806 1.00 . A A . 18 GLU HG2 1 1 1 270 1 1 18 GLU HG3 H 20.456 2.805 2.092 1.00 . A A . 18 GLU HG3 1 1 1 271 1 1 18 GLU N N 17.372 5.265 3.598 1.00 . A A . 18 GLU N 1 1 1 272 1 1 18 GLU O O 18.766 3.224 6.040 1.00 . A A . 18 GLU O 1 1 1 273 1 1 18 GLU OE1 O 22.466 3.522 4.492 1.00 . A A . 18 GLU OE1 1 1 1 274 1 1 18 GLU OE2 O 22.682 4.009 2.312 1.00 . A A . 18 GLU OE2 1 1 1 275 1 1 19 ASP C C 17.828 6.122 8.092 1.00 . A A . 19 ASP C 1 1 1 276 1 1 19 ASP CA C 19.093 5.637 7.380 1.00 . A A . 19 ASP CA 1 1 1 277 1 1 19 ASP CB C 20.195 6.671 7.618 1.00 . A A . 19 ASP CB 1 1 1 278 1 1 19 ASP CG C 21.097 6.390 8.821 1.00 . A A . 19 ASP CG 1 1 1 279 1 1 19 ASP H H 18.744 6.339 5.450 1.00 . A A . 19 ASP H 1 1 1 280 1 1 19 ASP HA H 19.409 4.651 7.719 1.00 . A A . 19 ASP HA 1 1 1 281 1 1 19 ASP HB2 H 20.815 6.732 6.724 1.00 . A A . 19 ASP HB2 1 1 1 282 1 1 19 ASP HB3 H 19.732 7.649 7.751 1.00 . A A . 19 ASP HB3 1 1 1 283 1 1 19 ASP HD2 H 21.973 8.057 8.830 1.00 . A A . 19 ASP HD2 1 1 1 284 1 1 19 ASP N N 18.817 5.483 5.962 1.00 . A A . 19 ASP N 1 1 1 285 1 1 19 ASP O O 17.551 7.320 8.126 1.00 . A A . 19 ASP O 1 1 1 286 1 1 19 ASP OD1 O 20.776 5.553 9.678 1.00 . A A . 19 ASP OD1 1 1 1 287 1 1 19 ASP OD2 O 22.186 7.080 8.859 1.00 . A A . 19 ASP OD2 1 1 1 288 1 1 20 LEU C C 16.019 5.100 10.824 1.00 . A A . 20 LEU C 1 1 1 289 1 1 20 LEU CA C 15.864 5.481 9.350 1.00 . A A . 20 LEU CA 1 1 1 290 1 1 20 LEU CB C 14.667 4.818 8.666 1.00 . A A . 20 LEU CB 1 1 1 291 1 1 20 LEU CD1 C 12.639 5.698 9.880 1.00 . A A . 20 LEU CD1 1 1 1 292 1 1 20 LEU CD2 C 13.732 7.079 8.054 1.00 . A A . 20 LEU CD2 1 1 1 293 1 1 20 LEU CG C 13.402 5.672 8.554 1.00 . A A . 20 LEU CG 1 1 1 294 1 1 20 LEU H H 17.325 4.194 8.609 1.00 . A A . 20 LEU H 1 1 1 295 1 1 20 LEU HA H 15.717 6.559 9.285 1.00 . A A . 20 LEU HA 1 1 1 296 1 1 20 LEU HB2 H 14.968 4.517 7.662 1.00 . A A . 20 LEU HB2 1 1 1 297 1 1 20 LEU HB3 H 14.420 3.908 9.212 1.00 . A A . 20 LEU HB3 1 1 1 298 1 1 20 LEU HD11 H 11.711 5.135 9.777 1.00 . A A . 20 LEU HD11 1 1 1 299 1 1 20 LEU HD12 H 13.253 5.248 10.661 1.00 . A A . 20 LEU HD12 1 1 1 300 1 1 20 LEU HD13 H 12.411 6.730 10.148 1.00 . A A . 20 LEU HD13 1 1 1 301 1 1 20 LEU HD21 H 12.955 7.413 7.367 1.00 . A A . 20 LEU HD21 1 1 1 302 1 1 20 LEU HD22 H 13.785 7.762 8.902 1.00 . A A . 20 LEU HD22 1 1 1 303 1 1 20 LEU HD23 H 14.692 7.066 7.538 1.00 . A A . 20 LEU HD23 1 1 1 304 1 1 20 LEU HG H 12.745 5.213 7.814 1.00 . A A . 20 LEU HG 1 1 1 305 1 1 20 LEU N N 17.093 5.166 8.642 1.00 . A A . 20 LEU N 1 1 1 306 1 1 20 LEU O O 15.667 4.004 11.255 1.00 . A A . 20 LEU O 1 1 1 307 1 1 21 PRO C C 15.553 5.334 13.686 1.00 . A A . 21 PRO C 1 1 1 308 1 1 21 PRO CA C 16.797 5.900 13.017 1.00 . A A . 21 PRO CA 1 1 1 309 1 1 21 PRO CB C 17.089 7.315 13.511 1.00 . A A . 21 PRO CB 1 1 1 310 1 1 21 PRO CD C 16.985 7.344 11.122 1.00 . A A . 21 PRO CD 1 1 1 311 1 1 21 PRO CG C 17.654 8.003 12.326 1.00 . A A . 21 PRO CG 1 1 1 312 1 1 21 PRO HA H 17.649 5.247 13.208 1.00 . A A . 21 PRO HA 1 1 1 313 1 1 21 PRO HB2 H 16.192 7.823 13.866 1.00 . A A . 21 PRO HB2 1 1 1 314 1 1 21 PRO HB3 H 17.844 7.272 14.297 1.00 . A A . 21 PRO HB3 1 1 1 315 1 1 21 PRO HD2 H 16.141 7.939 10.773 1.00 . A A . 21 PRO HD2 1 1 1 316 1 1 21 PRO HD3 H 17.713 7.211 10.322 1.00 . A A . 21 PRO HD3 1 1 1 317 1 1 21 PRO HG2 H 17.526 9.084 12.260 1.00 . A A . 21 PRO HG2 1 1 1 318 1 1 21 PRO HG3 H 18.709 7.744 12.407 1.00 . A A . 21 PRO HG3 1 1 1 319 1 1 21 PRO N N 16.560 6.045 11.597 1.00 . A A . 21 PRO N 1 1 1 320 1 1 21 PRO O O 14.536 5.174 13.012 1.00 . A A . 21 PRO O 1 1 1 321 1 1 22 ASP C C 13.919 5.589 16.595 1.00 . A A . 22 ASP C 1 1 1 322 1 1 22 ASP CA C 14.522 4.498 15.709 1.00 . A A . 22 ASP CA 1 1 1 323 1 1 22 ASP CB C 14.959 3.343 16.612 1.00 . A A . 22 ASP CB 1 1 1 324 1 1 22 ASP CG C 16.344 3.503 17.243 1.00 . A A . 22 ASP CG 1 1 1 325 1 1 22 ASP H H 16.482 5.178 15.517 1.00 . A A . 22 ASP H 1 1 1 326 1 1 22 ASP HA H 13.827 4.149 14.945 1.00 . A A . 22 ASP HA 1 1 1 327 1 1 22 ASP HB2 H 14.225 3.227 17.409 1.00 . A A . 22 ASP HB2 1 1 1 328 1 1 22 ASP HB3 H 14.946 2.421 16.030 1.00 . A A . 22 ASP HB3 1 1 1 329 1 1 22 ASP HD2 H 15.911 4.963 18.351 1.00 . A A . 22 ASP HD2 1 1 1 330 1 1 22 ASP N N 15.651 5.045 14.976 1.00 . A A . 22 ASP N 1 1 1 331 1 1 22 ASP O O 13.828 5.427 17.811 1.00 . A A . 22 ASP O 1 1 1 332 1 1 22 ASP OD1 O 17.363 3.109 16.656 1.00 . A A . 22 ASP OD1 1 1 1 333 1 1 22 ASP OD2 O 16.353 4.068 18.403 1.00 . A A . 22 ASP OD2 1 1 1 334 1 1 23 ASP C C 12.719 8.961 15.698 1.00 . A A . 23 ASP C 1 1 1 335 1 1 23 ASP CA C 12.929 7.795 16.667 1.00 . A A . 23 ASP CA 1 1 1 336 1 1 23 ASP CB C 13.845 8.275 17.794 1.00 . A A . 23 ASP CB 1 1 1 337 1 1 23 ASP CG C 13.485 9.641 18.382 1.00 . A A . 23 ASP CG 1 1 1 338 1 1 23 ASP H H 13.598 6.801 14.962 1.00 . A A . 23 ASP H 1 1 1 339 1 1 23 ASP HA H 11.990 7.413 17.069 1.00 . A A . 23 ASP HA 1 1 1 340 1 1 23 ASP HB2 H 13.829 7.536 18.595 1.00 . A A . 23 ASP HB2 1 1 1 341 1 1 23 ASP HB3 H 14.867 8.316 17.419 1.00 . A A . 23 ASP HB3 1 1 1 342 1 1 23 ASP HD2 H 14.897 9.842 19.611 1.00 . A A . 23 ASP HD2 1 1 1 343 1 1 23 ASP N N 13.521 6.677 15.952 1.00 . A A . 23 ASP N 1 1 1 344 1 1 23 ASP O O 13.425 9.966 15.769 1.00 . A A . 23 ASP O 1 1 1 345 1 1 23 ASP OD1 O 12.310 10.037 18.404 1.00 . A A . 23 ASP OD1 1 1 1 346 1 1 23 ASP OD2 O 14.483 10.320 18.836 1.00 . A A . 23 ASP OD2 1 1 1 347 1 1 24 TRP C C 10.103 10.454 14.226 1.00 . A A . 24 TRP C 1 1 1 348 1 1 24 TRP CA C 11.436 9.813 13.834 1.00 . A A . 24 TRP CA 1 1 1 349 1 1 24 TRP CB C 11.425 9.232 12.418 1.00 . A A . 24 TRP CB 1 1 1 350 1 1 24 TRP CD1 C 12.782 11.036 11.167 1.00 . A A . 24 TRP CD1 1 1 1 351 1 1 24 TRP CD2 C 10.826 10.600 10.222 1.00 . A A . 24 TRP CD2 1 1 1 352 1 1 24 TRP CE2 C 11.444 11.572 9.462 1.00 . A A . 24 TRP CE2 1 1 1 353 1 1 24 TRP CE3 C 9.556 10.102 9.882 1.00 . A A . 24 TRP CE3 1 1 1 354 1 1 24 TRP CG C 11.699 10.262 11.321 1.00 . A A . 24 TRP CG 1 1 1 355 1 1 24 TRP CH2 C 9.603 11.648 7.957 1.00 . A A . 24 TRP CH2 1 1 1 356 1 1 24 TRP CZ2 C 10.868 12.129 8.314 1.00 . A A . 24 TRP CZ2 1 1 1 357 1 1 24 TRP CZ3 C 8.994 10.669 8.733 1.00 . A A . 24 TRP CZ3 1 1 1 358 1 1 24 TRP H H 11.177 7.967 14.764 1.00 . A A . 24 TRP H 1 1 1 359 1 1 24 TRP HA H 12.231 10.557 13.866 1.00 . A A . 24 TRP HA 1 1 1 360 1 1 24 TRP HB2 H 12.174 8.441 12.356 1.00 . A A . 24 TRP HB2 1 1 1 361 1 1 24 TRP HB3 H 10.456 8.768 12.234 1.00 . A A . 24 TRP HB3 1 1 1 362 1 1 24 TRP HD1 H 13.642 11.027 11.837 1.00 . A A . 24 TRP HD1 1 1 1 363 1 1 24 TRP HE1 H 13.410 12.567 9.706 1.00 . A A . 24 TRP HE1 1 1 1 364 1 1 24 TRP HE3 H 9.047 9.335 10.466 1.00 . A A . 24 TRP HE3 1 1 1 365 1 1 24 TRP HH2 H 9.098 12.039 7.073 1.00 . A A . 24 TRP HH2 1 1 1 366 1 1 24 TRP HZ2 H 11.377 12.896 7.731 1.00 . A A . 24 TRP HZ2 1 1 1 367 1 1 24 TRP HZ3 H 8.009 10.318 8.424 1.00 . A A . 24 TRP HZ3 1 1 1 368 1 1 24 TRP N N 11.747 8.787 14.815 1.00 . A A . 24 TRP N 1 1 1 369 1 1 24 TRP NE1 N 12.671 11.846 10.055 1.00 . A A . 24 TRP NE1 1 1 1 370 1 1 24 TRP O O 9.127 9.754 14.491 1.00 . A A . 24 TRP O 1 1 1 371 1 1 25 ALA C C 8.528 13.450 13.451 1.00 . A A . 25 ALA C 1 1 1 372 1 1 25 ALA CA C 8.909 12.523 14.607 1.00 . A A . 25 ALA CA 1 1 1 373 1 1 25 ALA CB C 9.150 13.285 15.911 1.00 . A A . 25 ALA CB 1 1 1 374 1 1 25 ALA H H 10.903 12.341 14.034 1.00 . A A . 25 ALA H 1 1 1 375 1 1 25 ALA HA H 8.105 11.803 14.764 1.00 . A A . 25 ALA HA 1 1 1 376 1 1 25 ALA HB1 H 9.529 14.282 15.685 1.00 . A A . 25 ALA HB1 1 1 1 377 1 1 25 ALA HB2 H 8.214 13.368 16.462 1.00 . A A . 25 ALA HB2 1 1 1 378 1 1 25 ALA HB3 H 9.881 12.748 16.516 1.00 . A A . 25 ALA HB3 1 1 1 379 1 1 25 ALA N N 10.105 11.779 14.251 1.00 . A A . 25 ALA N 1 1 1 380 1 1 25 ALA O O 9.395 14.061 12.829 1.00 . A A . 25 ALA O 1 1 1 381 1 1 26 CYS C C 7.337 15.762 12.283 1.00 . A A . 26 CYS C 1 1 1 382 1 1 26 CYS CA C 6.723 14.369 12.129 1.00 . A A . 26 CYS CA 1 1 1 383 1 1 26 CYS CB C 5.194 14.417 12.123 1.00 . A A . 26 CYS CB 1 1 1 384 1 1 26 CYS H H 6.530 13.026 13.710 1.00 . A A . 26 CYS H 1 1 1 385 1 1 26 CYS HA H 7.037 13.908 11.193 1.00 . A A . 26 CYS HA 1 1 1 386 1 1 26 CYS HB2 H 4.813 13.479 12.526 1.00 . A A . 26 CYS HB2 1 1 1 387 1 1 26 CYS HB3 H 4.866 15.209 12.797 1.00 . A A . 26 CYS HB3 1 1 1 388 1 1 26 CYS N N 7.229 13.526 13.199 1.00 . A A . 26 CYS N 1 1 1 389 1 1 26 CYS O O 7.407 16.327 13.372 1.00 . A A . 26 CYS O 1 1 1 390 1 1 26 CYS SG S 4.441 14.698 10.479 1.00 . A A . 26 CYS SG 1 1 1 391 1 1 27 PRO C C 7.321 18.683 10.974 1.00 . A A . 27 PRO C 1 1 1 392 1 1 27 PRO CA C 8.402 17.615 11.064 1.00 . A A . 27 PRO CA 1 1 1 393 1 1 27 PRO CB C 9.236 17.571 9.786 1.00 . A A . 27 PRO CB 1 1 1 394 1 1 27 PRO CD C 7.720 15.671 9.854 1.00 . A A . 27 PRO CD 1 1 1 395 1 1 27 PRO CG C 8.401 16.649 8.899 1.00 . A A . 27 PRO CG 1 1 1 396 1 1 27 PRO HA H 9.040 17.806 11.927 1.00 . A A . 27 PRO HA 1 1 1 397 1 1 27 PRO HB2 H 9.352 18.556 9.333 1.00 . A A . 27 PRO HB2 1 1 1 398 1 1 27 PRO HB3 H 10.208 17.131 10.007 1.00 . A A . 27 PRO HB3 1 1 1 399 1 1 27 PRO HD2 H 6.690 15.485 9.551 1.00 . A A . 27 PRO HD2 1 1 1 400 1 1 27 PRO HD3 H 8.280 14.736 9.887 1.00 . A A . 27 PRO HD3 1 1 1 401 1 1 27 PRO HG2 H 7.641 17.243 8.391 1.00 . A A . 27 PRO HG2 1 1 1 402 1 1 27 PRO HG3 H 9.043 16.144 8.177 1.00 . A A . 27 PRO HG3 1 1 1 403 1 1 27 PRO N N 7.787 16.308 11.151 1.00 . A A . 27 PRO N 1 1 1 404 1 1 27 PRO O O 7.618 19.793 10.536 1.00 . A A . 27 PRO O 1 1 1 405 1 1 28 VAL C C 4.249 19.240 12.666 1.00 . A A . 28 VAL C 1 1 1 406 1 1 28 VAL CA C 5.006 19.281 11.336 1.00 . A A . 28 VAL CA 1 1 1 407 1 1 28 VAL CB C 4.112 18.984 10.130 1.00 . A A . 28 VAL CB 1 1 1 408 1 1 28 VAL CG1 C 3.319 20.226 9.717 1.00 . A A . 28 VAL CG1 1 1 1 409 1 1 28 VAL CG2 C 4.934 18.443 8.959 1.00 . A A . 28 VAL CG2 1 1 1 410 1 1 28 VAL H H 5.876 17.432 11.738 1.00 . A A . 28 VAL H 1 1 1 411 1 1 28 VAL HA H 5.430 20.277 11.205 1.00 . A A . 28 VAL HA 1 1 1 412 1 1 28 VAL HB H 3.399 18.214 10.424 1.00 . A A . 28 VAL HB 1 1 1 413 1 1 28 VAL HG11 H 2.767 20.015 8.801 1.00 . A A . 28 VAL HG11 1 1 1 414 1 1 28 VAL HG12 H 2.620 20.491 10.510 1.00 . A A . 28 VAL HG12 1 1 1 415 1 1 28 VAL HG13 H 4.005 21.055 9.545 1.00 . A A . 28 VAL HG13 1 1 1 416 1 1 28 VAL HG21 H 5.088 17.372 9.088 1.00 . A A . 28 VAL HG21 1 1 1 417 1 1 28 VAL HG22 H 4.399 18.624 8.026 1.00 . A A . 28 VAL HG22 1 1 1 418 1 1 28 VAL HG23 H 5.899 18.948 8.928 1.00 . A A . 28 VAL HG23 1 1 1 419 1 1 28 VAL N N 6.109 18.337 11.382 1.00 . A A . 28 VAL N 1 1 1 420 1 1 28 VAL O O 4.352 20.164 13.471 1.00 . A A . 28 VAL O 1 1 1 421 1 1 29 CYS C C 3.704 17.721 15.224 1.00 . A A . 29 CYS C 1 1 1 422 1 1 29 CYS CA C 2.733 17.986 14.072 1.00 . A A . 29 CYS CA 1 1 1 423 1 1 29 CYS CB C 1.697 16.869 13.930 1.00 . A A . 29 CYS CB 1 1 1 424 1 1 29 CYS H H 3.428 17.413 12.194 1.00 . A A . 29 CYS H 1 1 1 425 1 1 29 CYS HA H 2.188 18.916 14.232 1.00 . A A . 29 CYS HA 1 1 1 426 1 1 29 CYS HB2 H 1.141 16.787 14.864 1.00 . A A . 29 CYS HB2 1 1 1 427 1 1 29 CYS HB3 H 0.982 17.152 13.157 1.00 . A A . 29 CYS HB3 1 1 1 428 1 1 29 CYS N N 3.506 18.160 12.854 1.00 . A A . 29 CYS N 1 1 1 429 1 1 29 CYS O O 3.446 18.113 16.361 1.00 . A A . 29 CYS O 1 1 1 430 1 1 29 CYS SG S 2.391 15.227 13.515 1.00 . A A . 29 CYS SG 1 1 1 431 1 1 30 GLY C C 5.534 15.375 16.527 1.00 . A A . 30 GLY C 1 1 1 432 1 1 30 GLY CA C 5.812 16.735 15.882 1.00 . A A . 30 GLY CA 1 1 1 433 1 1 30 GLY H H 5.004 16.742 13.963 1.00 . A A . 30 GLY H 1 1 1 434 1 1 30 GLY HA2 H 6.797 16.725 15.414 1.00 . A A . 30 GLY HA2 1 1 1 435 1 1 30 GLY HA3 H 5.832 17.508 16.650 1.00 . A A . 30 GLY HA3 1 1 1 436 1 1 30 GLY N N 4.801 17.057 14.890 1.00 . A A . 30 GLY N 1 1 1 437 1 1 30 GLY O O 6.392 14.823 17.213 1.00 . A A . 30 GLY O 1 1 1 438 1 1 31 ALA C C 4.936 12.521 16.402 1.00 . A A . 31 ALA C 1 1 1 439 1 1 31 ALA CA C 3.930 13.591 16.831 1.00 . A A . 31 ALA CA 1 1 1 440 1 1 31 ALA CB C 2.505 13.266 16.378 1.00 . A A . 31 ALA CB 1 1 1 441 1 1 31 ALA H H 3.639 15.332 15.724 1.00 . A A . 31 ALA H 1 1 1 442 1 1 31 ALA HA H 3.943 13.675 17.918 1.00 . A A . 31 ALA HA 1 1 1 443 1 1 31 ALA HB1 H 2.444 13.333 15.292 1.00 . A A . 31 ALA HB1 1 1 1 444 1 1 31 ALA HB2 H 2.244 12.256 16.695 1.00 . A A . 31 ALA HB2 1 1 1 445 1 1 31 ALA HB3 H 1.811 13.978 16.826 1.00 . A A . 31 ALA HB3 1 1 1 446 1 1 31 ALA N N 4.332 14.875 16.283 1.00 . A A . 31 ALA N 1 1 1 447 1 1 31 ALA O O 5.674 12.710 15.436 1.00 . A A . 31 ALA O 1 1 1 448 1 1 32 SER C C 5.444 9.658 15.528 1.00 . A A . 32 SER C 1 1 1 449 1 1 32 SER CA C 5.837 10.322 16.849 1.00 . A A . 32 SER CA 1 1 1 450 1 1 32 SER CB C 5.835 9.292 17.981 1.00 . A A . 32 SER CB 1 1 1 451 1 1 32 SER H H 4.330 11.276 17.925 1.00 . A A . 32 SER H 1 1 1 452 1 1 32 SER HA H 6.826 10.773 16.771 1.00 . A A . 32 SER HA 1 1 1 453 1 1 32 SER HB2 H 6.358 8.393 17.654 1.00 . A A . 32 SER HB2 1 1 1 454 1 1 32 SER HB3 H 6.387 9.689 18.833 1.00 . A A . 32 SER HB3 1 1 1 455 1 1 32 SER HG H 4.506 8.035 18.793 1.00 . A A . 32 SER HG 1 1 1 456 1 1 32 SER N N 4.933 11.422 17.141 1.00 . A A . 32 SER N 1 1 1 457 1 1 32 SER O O 4.345 9.879 15.021 1.00 . A A . 32 SER O 1 1 1 458 1 1 32 SER OG O 4.513 8.950 18.390 1.00 . A A . 32 SER OG 1 1 1 459 1 1 33 LYS C C 5.406 6.841 14.040 1.00 . A A . 33 LYS C 1 1 1 460 1 1 33 LYS CA C 6.126 8.160 13.755 1.00 . A A . 33 LYS CA 1 1 1 461 1 1 33 LYS CB C 7.434 7.992 12.980 1.00 . A A . 33 LYS CB 1 1 1 462 1 1 33 LYS CD C 8.561 5.737 13.046 1.00 . A A . 33 LYS CD 1 1 1 463 1 1 33 LYS CE C 8.373 4.589 14.040 1.00 . A A . 33 LYS CE 1 1 1 464 1 1 33 LYS CG C 8.410 7.093 13.740 1.00 . A A . 33 LYS CG 1 1 1 465 1 1 33 LYS H H 7.254 8.683 15.427 1.00 . A A . 33 LYS H 1 1 1 466 1 1 33 LYS HA H 5.471 8.788 13.151 1.00 . A A . 33 LYS HA 1 1 1 467 1 1 33 LYS HB2 H 7.227 7.564 11.999 1.00 . A A . 33 LYS HB2 1 1 1 468 1 1 33 LYS HB3 H 7.889 8.969 12.811 1.00 . A A . 33 LYS HB3 1 1 1 469 1 1 33 LYS HD2 H 7.828 5.652 12.244 1.00 . A A . 33 LYS HD2 1 1 1 470 1 1 33 LYS HD3 H 9.546 5.667 12.587 1.00 . A A . 33 LYS HD3 1 1 1 471 1 1 33 LYS HE2 H 9.315 4.381 14.547 1.00 . A A . 33 LYS HE2 1 1 1 472 1 1 33 LYS HE3 H 7.655 4.878 14.807 1.00 . A A . 33 LYS HE3 1 1 1 473 1 1 33 LYS HG2 H 9.383 7.581 13.807 1.00 . A A . 33 LYS HG2 1 1 1 474 1 1 33 LYS HG3 H 8.056 6.946 14.760 1.00 . A A . 33 LYS HG3 1 1 1 475 1 1 33 LYS HZ1 H 7.355 2.773 13.952 1.00 . A A . 33 LYS HZ1 1 1 1 476 1 1 33 LYS HZ2 H 7.310 3.595 12.548 1.00 . A A . 33 LYS HZ2 1 1 1 477 1 1 33 LYS N N 6.363 8.858 15.008 1.00 . A A . 33 LYS N 1 1 1 478 1 1 33 LYS NZ N 7.899 3.373 13.343 1.00 . A A . 33 LYS NZ 1 1 1 479 1 1 33 LYS O O 5.781 5.797 13.507 1.00 . A A . 33 LYS O 1 1 1 480 1 1 34 ASP C C 2.231 5.836 14.577 1.00 . A A . 34 ASP C 1 1 1 481 1 1 34 ASP CA C 3.607 5.756 15.239 1.00 . A A . 34 ASP CA 1 1 1 482 1 1 34 ASP CB C 3.400 5.677 16.753 1.00 . A A . 34 ASP CB 1 1 1 483 1 1 34 ASP CG C 2.766 6.918 17.384 1.00 . A A . 34 ASP CG 1 1 1 484 1 1 34 ASP H H 4.084 7.782 15.307 1.00 . A A . 34 ASP H 1 1 1 485 1 1 34 ASP HA H 4.192 4.906 14.885 1.00 . A A . 34 ASP HA 1 1 1 486 1 1 34 ASP HB2 H 2.772 4.814 16.974 1.00 . A A . 34 ASP HB2 1 1 1 487 1 1 34 ASP HB3 H 4.365 5.499 17.228 1.00 . A A . 34 ASP HB3 1 1 1 488 1 1 34 ASP HD2 H 2.699 6.934 19.266 1.00 . A A . 34 ASP HD2 1 1 1 489 1 1 34 ASP N N 4.384 6.930 14.878 1.00 . A A . 34 ASP N 1 1 1 490 1 1 34 ASP O O 1.642 4.812 14.233 1.00 . A A . 34 ASP O 1 1 1 491 1 1 34 ASP OD1 O 2.881 8.034 16.855 1.00 . A A . 34 ASP OD1 1 1 1 492 1 1 34 ASP OD2 O 2.123 6.704 18.482 1.00 . A A . 34 ASP OD2 1 1 1 493 1 1 35 ALA C C 0.592 7.167 12.283 1.00 . A A . 35 ALA C 1 1 1 494 1 1 35 ALA CA C 0.460 7.291 13.802 1.00 . A A . 35 ALA CA 1 1 1 495 1 1 35 ALA CB C -0.076 8.658 14.232 1.00 . A A . 35 ALA CB 1 1 1 496 1 1 35 ALA H H 2.241 7.891 14.700 1.00 . A A . 35 ALA H 1 1 1 497 1 1 35 ALA HA H -0.219 6.518 14.164 1.00 . A A . 35 ALA HA 1 1 1 498 1 1 35 ALA HB1 H 0.753 9.288 14.555 1.00 . A A . 35 ALA HB1 1 1 1 499 1 1 35 ALA HB2 H -0.584 9.129 13.390 1.00 . A A . 35 ALA HB2 1 1 1 500 1 1 35 ALA HB3 H -0.779 8.530 15.055 1.00 . A A . 35 ALA HB3 1 1 1 501 1 1 35 ALA N N 1.757 7.063 14.417 1.00 . A A . 35 ALA N 1 1 1 502 1 1 35 ALA O O -0.397 7.273 11.560 1.00 . A A . 35 ALA O 1 1 1 503 1 1 36 PHE C C 1.734 5.402 9.931 1.00 . A A . 36 PHE C 1 1 1 504 1 1 36 PHE CA C 2.097 6.804 10.425 1.00 . A A . 36 PHE CA 1 1 1 505 1 1 36 PHE CB C 3.599 7.025 10.235 1.00 . A A . 36 PHE CB 1 1 1 506 1 1 36 PHE CD1 C 3.687 9.307 11.263 1.00 . A A . 36 PHE CD1 1 1 1 507 1 1 36 PHE CD2 C 4.710 8.998 9.165 1.00 . A A . 36 PHE CD2 1 1 1 508 1 1 36 PHE CE1 C 4.072 10.674 11.250 1.00 . A A . 36 PHE CE1 1 1 1 509 1 1 36 PHE CE2 C 5.095 10.364 9.151 1.00 . A A . 36 PHE CE2 1 1 1 510 1 1 36 PHE CG C 4.014 8.498 10.221 1.00 . A A . 36 PHE CG 1 1 1 511 1 1 36 PHE CZ C 4.768 11.174 10.194 1.00 . A A . 36 PHE CZ 1 1 1 512 1 1 36 PHE H H 2.622 6.858 12.440 1.00 . A A . 36 PHE H 1 1 1 513 1 1 36 PHE HA H 1.486 7.541 9.903 1.00 . A A . 36 PHE HA 1 1 1 514 1 1 36 PHE HB2 H 4.135 6.516 11.036 1.00 . A A . 36 PHE HB2 1 1 1 515 1 1 36 PHE HB3 H 3.909 6.562 9.299 1.00 . A A . 36 PHE HB3 1 1 1 516 1 1 36 PHE HD1 H 3.128 8.907 12.110 1.00 . A A . 36 PHE HD1 1 1 1 517 1 1 36 PHE HD2 H 4.973 8.349 8.329 1.00 . A A . 36 PHE HD2 1 1 1 518 1 1 36 PHE HE1 H 3.809 11.323 12.085 1.00 . A A . 36 PHE HE1 1 1 1 519 1 1 36 PHE HE2 H 5.654 10.765 8.304 1.00 . A A . 36 PHE HE2 1 1 1 520 1 1 36 PHE HZ H 5.064 12.223 10.183 1.00 . A A . 36 PHE HZ 1 1 1 521 1 1 36 PHE N N 1.823 6.944 11.845 1.00 . A A . 36 PHE N 1 1 1 522 1 1 36 PHE O O 2.061 4.409 10.578 1.00 . A A . 36 PHE O 1 1 1 523 1 1 37 GLU C C 0.228 4.308 6.746 1.00 . A A . 37 GLU C 1 1 1 524 1 1 37 GLU CA C 0.652 4.103 8.201 1.00 . A A . 37 GLU CA 1 1 1 525 1 1 37 GLU CB C -0.473 3.461 9.015 1.00 . A A . 37 GLU CB 1 1 1 526 1 1 37 GLU CD C -0.853 1.348 10.338 1.00 . A A . 37 GLU CD 1 1 1 527 1 1 37 GLU CG C -0.343 1.936 9.021 1.00 . A A . 37 GLU CG 1 1 1 528 1 1 37 GLU H H 0.801 6.180 8.269 1.00 . A A . 37 GLU H 1 1 1 529 1 1 37 GLU HA H 1.534 3.464 8.243 1.00 . A A . 37 GLU HA 1 1 1 530 1 1 37 GLU HB2 H -0.447 3.836 10.038 1.00 . A A . 37 GLU HB2 1 1 1 531 1 1 37 GLU HB3 H -1.438 3.745 8.596 1.00 . A A . 37 GLU HB3 1 1 1 532 1 1 37 GLU HE2 H -1.461 -0.407 10.026 1.00 . A A . 37 GLU HE2 1 1 1 533 1 1 37 GLU HG2 H -0.907 1.516 8.188 1.00 . A A . 37 GLU HG2 1 1 1 534 1 1 37 GLU HG3 H 0.700 1.656 8.873 1.00 . A A . 37 GLU HG3 1 1 1 535 1 1 37 GLU N N 1.063 5.367 8.789 1.00 . A A . 37 GLU N 1 1 1 536 1 1 37 GLU O O -0.244 5.383 6.378 1.00 . A A . 37 GLU O 1 1 1 537 1 1 37 GLU OE1 O -0.337 1.691 11.412 1.00 . A A . 37 GLU OE1 1 1 1 538 1 1 37 GLU OE2 O -1.822 0.505 10.220 1.00 . A A . 37 GLU OE2 1 1 1 539 1 1 38 LYS C C -1.267 4.068 4.390 1.00 . A A . 38 LYS C 1 1 1 540 1 1 38 LYS CA C 0.053 3.311 4.549 1.00 . A A . 38 LYS CA 1 1 1 541 1 1 38 LYS CB C 0.030 1.903 3.950 1.00 . A A . 38 LYS CB 1 1 1 542 1 1 38 LYS CD C -1.073 0.794 1.972 1.00 . A A . 38 LYS CD 1 1 1 543 1 1 38 LYS CE C -2.525 1.245 1.800 1.00 . A A . 38 LYS CE 1 1 1 544 1 1 38 LYS CG C -0.191 1.955 2.437 1.00 . A A . 38 LYS CG 1 1 1 545 1 1 38 LYS H H 0.795 2.389 6.263 1.00 . A A . 38 LYS H 1 1 1 546 1 1 38 LYS HA H 0.835 3.868 4.033 1.00 . A A . 38 LYS HA 1 1 1 547 1 1 38 LYS HB2 H 0.971 1.396 4.167 1.00 . A A . 38 LYS HB2 1 1 1 548 1 1 38 LYS HB3 H -0.762 1.318 4.417 1.00 . A A . 38 LYS HB3 1 1 1 549 1 1 38 LYS HD2 H -0.696 0.401 1.028 1.00 . A A . 38 LYS HD2 1 1 1 550 1 1 38 LYS HD3 H -1.024 -0.018 2.698 1.00 . A A . 38 LYS HD3 1 1 1 551 1 1 38 LYS HE2 H -2.863 1.756 2.701 1.00 . A A . 38 LYS HE2 1 1 1 552 1 1 38 LYS HE3 H -2.595 1.961 0.981 1.00 . A A . 38 LYS HE3 1 1 1 553 1 1 38 LYS HG2 H -0.657 2.902 2.166 1.00 . A A . 38 LYS HG2 1 1 1 554 1 1 38 LYS HG3 H 0.770 1.914 1.924 1.00 . A A . 38 LYS HG3 1 1 1 555 1 1 38 LYS HZ1 H -3.776 -0.319 2.376 1.00 . A A . 38 LYS HZ1 1 1 1 556 1 1 38 LYS HZ2 H -4.190 0.331 0.941 1.00 . A A . 38 LYS HZ2 1 1 1 557 1 1 38 LYS N N 0.411 3.260 5.956 1.00 . A A . 38 LYS N 1 1 1 558 1 1 38 LYS NZ N -3.399 0.082 1.524 1.00 . A A . 38 LYS NZ 1 1 1 559 1 1 38 LYS O O -2.187 3.893 5.187 1.00 . A A . 38 LYS O 1 1 1 560 1 1 39 GLN C C -2.541 6.101 1.611 1.00 . A A . 39 GLN C 1 1 1 561 1 1 39 GLN CA C -2.509 5.679 3.082 1.00 . A A . 39 GLN CA 1 1 1 562 1 1 39 GLN CB C -2.588 6.898 4.004 1.00 . A A . 39 GLN CB 1 1 1 563 1 1 39 GLN CD C -5.053 7.417 3.908 1.00 . A A . 39 GLN CD 1 1 1 564 1 1 39 GLN CG C -3.904 6.912 4.783 1.00 . A A . 39 GLN CG 1 1 1 565 1 1 39 GLN H H -0.564 5.032 2.712 1.00 . A A . 39 GLN H 1 1 1 566 1 1 39 GLN HA H -3.348 5.016 3.295 1.00 . A A . 39 GLN HA 1 1 1 567 1 1 39 GLN HB2 H -1.749 6.886 4.700 1.00 . A A . 39 GLN HB2 1 1 1 568 1 1 39 GLN HB3 H -2.499 7.810 3.414 1.00 . A A . 39 GLN HB3 1 1 1 569 1 1 39 GLN HE21 H -5.657 5.498 3.676 1.00 . A A . 39 GLN HE21 1 1 1 570 1 1 39 GLN HE22 H -6.623 6.682 2.861 1.00 . A A . 39 GLN HE22 1 1 1 571 1 1 39 GLN HG2 H -4.130 5.908 5.142 1.00 . A A . 39 GLN HG2 1 1 1 572 1 1 39 GLN HG3 H -3.804 7.550 5.661 1.00 . A A . 39 GLN HG3 1 1 1 573 1 1 39 GLN N N -1.317 4.895 3.355 1.00 . A A . 39 GLN N 1 1 1 574 1 1 39 GLN NE2 N -5.843 6.453 3.443 1.00 . A A . 39 GLN NE2 1 1 1 575 1 1 39 GLN O O -3.279 7.012 1.239 1.00 . A A . 39 GLN O 1 1 1 576 1 1 39 GLN OE1 O -5.213 8.603 3.670 1.00 . A A . 39 GLN OE1 1 1 2 577 1 1 1 MET C C 4.056 2.158 -2.203 1.00 . A A . 1 MET C 1 1 2 578 1 1 1 MET CA C 3.299 1.893 -3.507 1.00 . A A . 1 MET CA 1 1 2 579 1 1 1 MET CB C 4.279 1.927 -4.682 1.00 . A A . 1 MET CB 1 1 2 580 1 1 1 MET CE C 5.483 -1.486 -6.159 1.00 . A A . 1 MET CE 1 1 2 581 1 1 1 MET CG C 4.019 0.766 -5.645 1.00 . A A . 1 MET CG 1 1 2 582 1 1 1 MET H1 H 1.759 2.799 -4.577 1.00 . A A . 1 MET H1 1 1 2 583 1 1 1 MET HA H 2.784 0.935 -3.447 1.00 . A A . 1 MET HA 1 1 2 584 1 1 1 MET HB2 H 4.183 2.874 -5.213 1.00 . A A . 1 MET HB2 1 1 2 585 1 1 1 MET HB3 H 5.302 1.873 -4.308 1.00 . A A . 1 MET HB3 1 1 2 586 1 1 1 MET HE1 H 4.476 -1.851 -6.366 1.00 . A A . 1 MET HE1 1 1 2 587 1 1 1 MET HE2 H 6.192 -1.982 -6.822 1.00 . A A . 1 MET HE2 1 1 2 588 1 1 1 MET HE3 H 5.742 -1.701 -5.123 1.00 . A A . 1 MET HE3 1 1 2 589 1 1 1 MET HG2 H 3.593 -0.078 -5.104 1.00 . A A . 1 MET HG2 1 1 2 590 1 1 1 MET HG3 H 3.290 1.064 -6.398 1.00 . A A . 1 MET HG3 1 1 2 591 1 1 1 MET N N 2.258 2.885 -3.715 1.00 . A A . 1 MET N 1 1 2 592 1 1 1 MET O O 5.010 2.934 -2.182 1.00 . A A . 1 MET O 1 1 2 593 1 1 1 MET SD S 5.543 0.276 -6.435 1.00 . A A . 1 MET SD 1 1 2 594 1 1 2 ASP C C 4.329 3.141 0.492 1.00 . A A . 2 ASP C 1 1 2 595 1 1 2 ASP CA C 4.224 1.652 0.155 1.00 . A A . 2 ASP CA 1 1 2 596 1 1 2 ASP CB C 5.637 1.063 0.165 1.00 . A A . 2 ASP CB 1 1 2 597 1 1 2 ASP CG C 5.724 -0.411 -0.229 1.00 . A A . 2 ASP CG 1 1 2 598 1 1 2 ASP H H 2.825 0.867 -1.175 1.00 . A A . 2 ASP H 1 1 2 599 1 1 2 ASP HA H 3.577 1.113 0.847 1.00 . A A . 2 ASP HA 1 1 2 600 1 1 2 ASP HB2 H 6.261 1.644 -0.514 1.00 . A A . 2 ASP HB2 1 1 2 601 1 1 2 ASP HB3 H 6.057 1.183 1.164 1.00 . A A . 2 ASP HB3 1 1 2 602 1 1 2 ASP HD2 H 5.071 -2.012 0.518 1.00 . A A . 2 ASP HD2 1 1 2 603 1 1 2 ASP N N 3.602 1.498 -1.149 1.00 . A A . 2 ASP N 1 1 2 604 1 1 2 ASP O O 5.247 3.820 0.035 1.00 . A A . 2 ASP O 1 1 2 605 1 1 2 ASP OD1 O 5.843 -0.749 -1.417 1.00 . A A . 2 ASP OD1 1 1 2 606 1 1 2 ASP OD2 O 5.667 -1.244 0.754 1.00 . A A . 2 ASP OD2 1 1 2 607 1 1 3 ILE C C 2.905 5.096 3.153 1.00 . A A . 3 ILE C 1 1 2 608 1 1 3 ILE CA C 3.353 5.000 1.692 1.00 . A A . 3 ILE CA 1 1 2 609 1 1 3 ILE CB C 2.492 5.820 0.730 1.00 . A A . 3 ILE CB 1 1 2 610 1 1 3 ILE CD1 C 4.305 6.747 -0.757 1.00 . A A . 3 ILE CD1 1 1 2 611 1 1 3 ILE CG1 C 3.092 5.820 -0.678 1.00 . A A . 3 ILE CG1 1 1 2 612 1 1 3 ILE CG2 C 2.276 7.238 1.260 1.00 . A A . 3 ILE CG2 1 1 2 613 1 1 3 ILE H H 2.635 3.045 1.657 1.00 . A A . 3 ILE H 1 1 2 614 1 1 3 ILE HA H 4.372 5.379 1.618 1.00 . A A . 3 ILE HA 1 1 2 615 1 1 3 ILE HB H 1.512 5.349 0.663 1.00 . A A . 3 ILE HB 1 1 2 616 1 1 3 ILE HD11 H 4.898 6.495 -1.636 1.00 . A A . 3 ILE HD11 1 1 2 617 1 1 3 ILE HD12 H 3.969 7.781 -0.830 1.00 . A A . 3 ILE HD12 1 1 2 618 1 1 3 ILE HD13 H 4.915 6.625 0.139 1.00 . A A . 3 ILE HD13 1 1 2 619 1 1 3 ILE HG12 H 3.385 4.806 -0.952 1.00 . A A . 3 ILE HG12 1 1 2 620 1 1 3 ILE HG13 H 2.338 6.140 -1.398 1.00 . A A . 3 ILE HG13 1 1 2 621 1 1 3 ILE HG21 H 3.162 7.840 1.061 1.00 . A A . 3 ILE HG21 1 1 2 622 1 1 3 ILE HG22 H 1.414 7.685 0.763 1.00 . A A . 3 ILE HG22 1 1 2 623 1 1 3 ILE HG23 H 2.096 7.201 2.335 1.00 . A A . 3 ILE HG23 1 1 2 624 1 1 3 ILE N N 3.378 3.604 1.289 1.00 . A A . 3 ILE N 1 1 2 625 1 1 3 ILE O O 2.020 4.378 3.613 1.00 . A A . 3 ILE O 1 1 2 626 1 1 4 TYR C C 2.784 7.663 5.494 1.00 . A A . 4 TYR C 1 1 2 627 1 1 4 TYR CA C 3.241 6.228 5.279 1.00 . A A . 4 TYR CA 1 1 2 628 1 1 4 TYR CB C 4.478 5.923 6.121 1.00 . A A . 4 TYR CB 1 1 2 629 1 1 4 TYR CD1 C 4.227 3.608 7.085 1.00 . A A . 4 TYR CD1 1 1 2 630 1 1 4 TYR CD2 C 5.782 3.946 5.255 1.00 . A A . 4 TYR CD2 1 1 2 631 1 1 4 TYR CE1 C 4.560 2.248 7.116 1.00 . A A . 4 TYR CE1 1 1 2 632 1 1 4 TYR CE2 C 6.114 2.587 5.286 1.00 . A A . 4 TYR CE2 1 1 2 633 1 1 4 TYR CG C 4.837 4.456 6.155 1.00 . A A . 4 TYR CG 1 1 2 634 1 1 4 TYR CZ C 5.503 1.738 6.217 1.00 . A A . 4 TYR CZ 1 1 2 635 1 1 4 TYR H H 4.267 6.578 3.453 1.00 . A A . 4 TYR H 1 1 2 636 1 1 4 TYR HA H 2.439 5.552 5.574 1.00 . A A . 4 TYR HA 1 1 2 637 1 1 4 TYR HB2 H 5.322 6.479 5.713 1.00 . A A . 4 TYR HB2 1 1 2 638 1 1 4 TYR HB3 H 4.296 6.260 7.141 1.00 . A A . 4 TYR HB3 1 1 2 639 1 1 4 TYR HD1 H 3.498 4.001 7.779 1.00 . A A . 4 TYR HD1 1 1 2 640 1 1 4 TYR HD2 H 6.253 4.602 4.538 1.00 . A A . 4 TYR HD2 1 1 2 641 1 1 4 TYR HE1 H 4.088 1.593 7.834 1.00 . A A . 4 TYR HE1 1 1 2 642 1 1 4 TYR HE2 H 6.842 2.193 4.593 1.00 . A A . 4 TYR HE2 1 1 2 643 1 1 4 TYR HH H 5.586 -0.051 5.442 1.00 . A A . 4 TYR HH 1 1 2 644 1 1 4 TYR N N 3.547 6.014 3.880 1.00 . A A . 4 TYR N 1 1 2 645 1 1 4 TYR O O 3.604 8.500 5.869 1.00 . A A . 4 TYR O 1 1 2 646 1 1 4 TYR OH O 5.828 0.413 6.247 1.00 . A A . 4 TYR OH 1 1 2 647 1 1 5 VAL C C 0.499 9.429 6.880 1.00 . A A . 5 VAL C 1 1 2 648 1 1 5 VAL CA C 0.966 9.257 5.433 1.00 . A A . 5 VAL CA 1 1 2 649 1 1 5 VAL CB C -0.146 9.510 4.412 1.00 . A A . 5 VAL CB 1 1 2 650 1 1 5 VAL CG1 C -0.709 10.926 4.555 1.00 . A A . 5 VAL CG1 1 1 2 651 1 1 5 VAL CG2 C 0.352 9.259 2.987 1.00 . A A . 5 VAL CG2 1 1 2 652 1 1 5 VAL H H 0.844 7.233 4.955 1.00 . A A . 5 VAL H 1 1 2 653 1 1 5 VAL HA H 1.771 9.965 5.238 1.00 . A A . 5 VAL HA 1 1 2 654 1 1 5 VAL HB H -0.953 8.807 4.614 1.00 . A A . 5 VAL HB 1 1 2 655 1 1 5 VAL HG11 H -1.773 10.918 4.322 1.00 . A A . 5 VAL HG11 1 1 2 656 1 1 5 VAL HG12 H -0.562 11.274 5.577 1.00 . A A . 5 VAL HG12 1 1 2 657 1 1 5 VAL HG13 H -0.191 11.594 3.866 1.00 . A A . 5 VAL HG13 1 1 2 658 1 1 5 VAL HG21 H -0.076 8.330 2.612 1.00 . A A . 5 VAL HG21 1 1 2 659 1 1 5 VAL HG22 H 0.046 10.085 2.346 1.00 . A A . 5 VAL HG22 1 1 2 660 1 1 5 VAL HG23 H 1.439 9.184 2.989 1.00 . A A . 5 VAL HG23 1 1 2 661 1 1 5 VAL N N 1.505 7.919 5.258 1.00 . A A . 5 VAL N 1 1 2 662 1 1 5 VAL O O -0.385 8.708 7.341 1.00 . A A . 5 VAL O 1 1 2 663 1 1 6 CYS C C -0.752 10.772 9.048 1.00 . A A . 6 CYS C 1 1 2 664 1 1 6 CYS CA C 0.771 10.665 8.942 1.00 . A A . 6 CYS CA 1 1 2 665 1 1 6 CYS CB C 1.469 11.925 9.456 1.00 . A A . 6 CYS CB 1 1 2 666 1 1 6 CYS H H 1.831 10.970 7.175 1.00 . A A . 6 CYS H 1 1 2 667 1 1 6 CYS HA H 1.142 9.825 9.529 1.00 . A A . 6 CYS HA 1 1 2 668 1 1 6 CYS HB2 H 2.526 11.870 9.194 1.00 . A A . 6 CYS HB2 1 1 2 669 1 1 6 CYS HB3 H 1.056 12.790 8.937 1.00 . A A . 6 CYS HB3 1 1 2 670 1 1 6 CYS N N 1.113 10.388 7.556 1.00 . A A . 6 CYS N 1 1 2 671 1 1 6 CYS O O -1.416 11.192 8.102 1.00 . A A . 6 CYS O 1 1 2 672 1 1 6 CYS SG S 1.325 12.200 11.260 1.00 . A A . 6 CYS SG 1 1 2 673 1 1 7 THR C C -3.032 11.571 11.416 1.00 . A A . 7 THR C 1 1 2 674 1 1 7 THR CA C -2.692 10.432 10.452 1.00 . A A . 7 THR CA 1 1 2 675 1 1 7 THR CB C -3.132 9.057 10.957 1.00 . A A . 7 THR CB 1 1 2 676 1 1 7 THR CG2 C -2.902 7.953 9.923 1.00 . A A . 7 THR CG2 1 1 2 677 1 1 7 THR H H -0.713 10.044 10.974 1.00 . A A . 7 THR H 1 1 2 678 1 1 7 THR HA H -3.193 10.652 9.509 1.00 . A A . 7 THR HA 1 1 2 679 1 1 7 THR HB H -4.172 9.076 11.281 1.00 . A A . 7 THR HB 1 1 2 680 1 1 7 THR HG1 H -2.325 9.395 12.756 1.00 . A A . 7 THR HG1 1 1 2 681 1 1 7 THR HG21 H -2.894 6.983 10.422 1.00 . A A . 7 THR HG21 1 1 2 682 1 1 7 THR HG22 H -3.703 7.973 9.184 1.00 . A A . 7 THR HG22 1 1 2 683 1 1 7 THR HG23 H -1.945 8.114 9.426 1.00 . A A . 7 THR HG23 1 1 2 684 1 1 7 THR N N -1.261 10.385 10.209 1.00 . A A . 7 THR N 1 1 2 685 1 1 7 THR O O -4.118 11.595 11.994 1.00 . A A . 7 THR O 1 1 2 686 1 1 7 THR OG1 O -2.206 8.756 11.996 1.00 . A A . 7 THR OG1 1 1 2 687 1 1 8 VAL C C -2.358 14.902 11.609 1.00 . A A . 8 VAL C 1 1 2 688 1 1 8 VAL CA C -2.270 13.622 12.444 1.00 . A A . 8 VAL CA 1 1 2 689 1 1 8 VAL CB C -1.149 13.664 13.485 1.00 . A A . 8 VAL CB 1 1 2 690 1 1 8 VAL CG1 C -1.094 15.027 14.178 1.00 . A A . 8 VAL CG1 1 1 2 691 1 1 8 VAL CG2 C -1.308 12.536 14.508 1.00 . A A . 8 VAL CG2 1 1 2 692 1 1 8 VAL H H -1.203 12.456 11.086 1.00 . A A . 8 VAL H 1 1 2 693 1 1 8 VAL HA H -3.213 13.480 12.970 1.00 . A A . 8 VAL HA 1 1 2 694 1 1 8 VAL HB H -0.203 13.514 12.965 1.00 . A A . 8 VAL HB 1 1 2 695 1 1 8 VAL HG11 H -1.972 15.147 14.814 1.00 . A A . 8 VAL HG11 1 1 2 696 1 1 8 VAL HG12 H -0.192 15.089 14.787 1.00 . A A . 8 VAL HG12 1 1 2 697 1 1 8 VAL HG13 H -1.080 15.816 13.426 1.00 . A A . 8 VAL HG13 1 1 2 698 1 1 8 VAL HG21 H -0.895 11.614 14.097 1.00 . A A . 8 VAL HG21 1 1 2 699 1 1 8 VAL HG22 H -0.776 12.797 15.422 1.00 . A A . 8 VAL HG22 1 1 2 700 1 1 8 VAL HG23 H -2.365 12.394 14.730 1.00 . A A . 8 VAL HG23 1 1 2 701 1 1 8 VAL N N -2.084 12.484 11.560 1.00 . A A . 8 VAL N 1 1 2 702 1 1 8 VAL O O -3.299 15.680 11.760 1.00 . A A . 8 VAL O 1 1 2 703 1 1 9 CYS C C -1.641 15.812 8.462 1.00 . A A . 9 CYS C 1 1 2 704 1 1 9 CYS CA C -1.320 16.251 9.892 1.00 . A A . 9 CYS CA 1 1 2 705 1 1 9 CYS CB C 0.031 16.964 9.980 1.00 . A A . 9 CYS CB 1 1 2 706 1 1 9 CYS H H -0.605 14.441 10.635 1.00 . A A . 9 CYS H 1 1 2 707 1 1 9 CYS HA H -2.077 16.941 10.264 1.00 . A A . 9 CYS HA 1 1 2 708 1 1 9 CYS HB2 H 0.104 17.677 9.159 1.00 . A A . 9 CYS HB2 1 1 2 709 1 1 9 CYS HB3 H 0.062 17.541 10.905 1.00 . A A . 9 CYS HB3 1 1 2 710 1 1 9 CYS N N -1.366 15.079 10.750 1.00 . A A . 9 CYS N 1 1 2 711 1 1 9 CYS O O -2.109 16.612 7.654 1.00 . A A . 9 CYS O 1 1 2 712 1 1 9 CYS SG S 1.488 15.858 9.930 1.00 . A A . 9 CYS SG 1 1 2 713 1 1 10 GLY C C -0.372 14.033 6.008 1.00 . A A . 10 GLY C 1 1 2 714 1 1 10 GLY CA C -1.631 13.987 6.875 1.00 . A A . 10 GLY CA 1 1 2 715 1 1 10 GLY H H -0.996 13.898 8.857 1.00 . A A . 10 GLY H 1 1 2 716 1 1 10 GLY HA2 H -1.974 12.958 6.970 1.00 . A A . 10 GLY HA2 1 1 2 717 1 1 10 GLY HA3 H -2.432 14.546 6.390 1.00 . A A . 10 GLY HA3 1 1 2 718 1 1 10 GLY N N -1.376 14.542 8.193 1.00 . A A . 10 GLY N 1 1 2 719 1 1 10 GLY O O -0.412 13.878 4.789 1.00 . A A . 10 GLY O 1 1 2 720 1 1 11 TYR C C 2.231 13.102 5.113 1.00 . A A . 11 TYR C 1 1 2 721 1 1 11 TYR CA C 2.043 14.326 5.997 1.00 . A A . 11 TYR CA 1 1 2 722 1 1 11 TYR CB C 3.160 14.420 7.033 1.00 . A A . 11 TYR CB 1 1 2 723 1 1 11 TYR CD1 C 4.701 15.669 5.478 1.00 . A A . 11 TYR CD1 1 1 2 724 1 1 11 TYR CD2 C 5.610 13.867 6.821 1.00 . A A . 11 TYR CD2 1 1 2 725 1 1 11 TYR CE1 C 5.965 15.889 4.918 1.00 . A A . 11 TYR CE1 1 1 2 726 1 1 11 TYR CE2 C 6.874 14.087 6.262 1.00 . A A . 11 TYR CE2 1 1 2 727 1 1 11 TYR CG C 4.524 14.659 6.430 1.00 . A A . 11 TYR CG 1 1 2 728 1 1 11 TYR CZ C 7.052 15.098 5.309 1.00 . A A . 11 TYR CZ 1 1 2 729 1 1 11 TYR H H 0.743 14.374 7.676 1.00 . A A . 11 TYR H 1 1 2 730 1 1 11 TYR HA H 2.063 15.220 5.373 1.00 . A A . 11 TYR HA 1 1 2 731 1 1 11 TYR HB2 H 2.934 15.240 7.716 1.00 . A A . 11 TYR HB2 1 1 2 732 1 1 11 TYR HB3 H 3.188 13.490 7.601 1.00 . A A . 11 TYR HB3 1 1 2 733 1 1 11 TYR HD1 H 3.863 16.279 5.176 1.00 . A A . 11 TYR HD1 1 1 2 734 1 1 11 TYR HD2 H 5.473 13.087 7.556 1.00 . A A . 11 TYR HD2 1 1 2 735 1 1 11 TYR HE1 H 6.102 16.669 4.183 1.00 . A A . 11 TYR HE1 1 1 2 736 1 1 11 TYR HE2 H 7.712 13.476 6.564 1.00 . A A . 11 TYR HE2 1 1 2 737 1 1 11 TYR HH H 8.972 15.421 5.424 1.00 . A A . 11 TYR HH 1 1 2 738 1 1 11 TYR N N 0.765 14.253 6.674 1.00 . A A . 11 TYR N 1 1 2 739 1 1 11 TYR O O 1.477 12.142 5.260 1.00 . A A . 11 TYR O 1 1 2 740 1 1 11 TYR OH O 8.283 15.312 4.765 1.00 . A A . 11 TYR OH 1 1 2 741 1 1 12 GLU C C 4.956 11.655 3.387 1.00 . A A . 12 GLU C 1 1 2 742 1 1 12 GLU CA C 3.477 12.041 3.332 1.00 . A A . 12 GLU CA 1 1 2 743 1 1 12 GLU CB C 3.050 12.372 1.901 1.00 . A A . 12 GLU CB 1 1 2 744 1 1 12 GLU CD C 1.267 12.071 0.142 1.00 . A A . 12 GLU CD 1 1 2 745 1 1 12 GLU CG C 1.723 11.693 1.553 1.00 . A A . 12 GLU CG 1 1 2 746 1 1 12 GLU H H 3.821 13.942 4.112 1.00 . A A . 12 GLU H 1 1 2 747 1 1 12 GLU HA H 2.866 11.220 3.706 1.00 . A A . 12 GLU HA 1 1 2 748 1 1 12 GLU HB2 H 2.949 13.452 1.788 1.00 . A A . 12 GLU HB2 1 1 2 749 1 1 12 GLU HB3 H 3.822 12.049 1.202 1.00 . A A . 12 GLU HB3 1 1 2 750 1 1 12 GLU HE2 H -0.414 12.870 -0.145 1.00 . A A . 12 GLU HE2 1 1 2 751 1 1 12 GLU HG2 H 1.836 10.611 1.626 1.00 . A A . 12 GLU HG2 1 1 2 752 1 1 12 GLU HG3 H 0.961 11.983 2.276 1.00 . A A . 12 GLU HG3 1 1 2 753 1 1 12 GLU N N 3.213 13.157 4.225 1.00 . A A . 12 GLU N 1 1 2 754 1 1 12 GLU O O 5.852 12.467 3.163 1.00 . A A . 12 GLU O 1 1 2 755 1 1 12 GLU OE1 O 2.098 12.446 -0.699 1.00 . A A . 12 GLU OE1 1 1 2 756 1 1 12 GLU OE2 O -0.001 11.962 -0.068 1.00 . A A . 12 GLU OE2 1 1 2 757 1 1 13 TYR C C 6.859 9.017 2.558 1.00 . A A . 13 TYR C 1 1 2 758 1 1 13 TYR CA C 6.543 9.856 3.789 1.00 . A A . 13 TYR CA 1 1 2 759 1 1 13 TYR CB C 6.676 9.022 5.060 1.00 . A A . 13 TYR CB 1 1 2 760 1 1 13 TYR CD1 C 9.178 9.071 5.365 1.00 . A A . 13 TYR CD1 1 1 2 761 1 1 13 TYR CD2 C 8.075 6.926 5.121 1.00 . A A . 13 TYR CD2 1 1 2 762 1 1 13 TYR CE1 C 10.414 8.422 5.481 1.00 . A A . 13 TYR CE1 1 1 2 763 1 1 13 TYR CE2 C 9.310 6.277 5.237 1.00 . A A . 13 TYR CE2 1 1 2 764 1 1 13 TYR CG C 8.008 8.323 5.185 1.00 . A A . 13 TYR CG 1 1 2 765 1 1 13 TYR CZ C 10.480 7.026 5.417 1.00 . A A . 13 TYR CZ 1 1 2 766 1 1 13 TYR H H 4.423 9.751 3.869 1.00 . A A . 13 TYR H 1 1 2 767 1 1 13 TYR HA H 7.244 10.689 3.838 1.00 . A A . 13 TYR HA 1 1 2 768 1 1 13 TYR HB2 H 6.545 9.677 5.921 1.00 . A A . 13 TYR HB2 1 1 2 769 1 1 13 TYR HB3 H 5.887 8.270 5.068 1.00 . A A . 13 TYR HB3 1 1 2 770 1 1 13 TYR HD1 H 9.127 10.149 5.414 1.00 . A A . 13 TYR HD1 1 1 2 771 1 1 13 TYR HD2 H 7.172 6.348 4.983 1.00 . A A . 13 TYR HD2 1 1 2 772 1 1 13 TYR HE1 H 11.316 9.000 5.619 1.00 . A A . 13 TYR HE1 1 1 2 773 1 1 13 TYR HE2 H 9.361 5.199 5.188 1.00 . A A . 13 TYR HE2 1 1 2 774 1 1 13 TYR HH H 11.613 5.439 5.453 1.00 . A A . 13 TYR HH 1 1 2 775 1 1 13 TYR N N 5.196 10.378 3.694 1.00 . A A . 13 TYR N 1 1 2 776 1 1 13 TYR O O 5.934 8.653 1.834 1.00 . A A . 13 TYR O 1 1 2 777 1 1 13 TYR OH O 11.683 6.394 5.529 1.00 . A A . 13 TYR OH 1 1 2 778 1 1 14 ASP C C 9.562 6.887 1.651 1.00 . A A . 14 ASP C 1 1 2 779 1 1 14 ASP CA C 8.545 7.937 1.200 1.00 . A A . 14 ASP CA 1 1 2 780 1 1 14 ASP CB C 9.208 8.810 0.134 1.00 . A A . 14 ASP CB 1 1 2 781 1 1 14 ASP CG C 9.125 8.264 -1.293 1.00 . A A . 14 ASP CG 1 1 2 782 1 1 14 ASP H H 8.882 9.032 2.941 1.00 . A A . 14 ASP H 1 1 2 783 1 1 14 ASP HA H 7.626 7.492 0.819 1.00 . A A . 14 ASP HA 1 1 2 784 1 1 14 ASP HB2 H 8.746 9.798 0.155 1.00 . A A . 14 ASP HB2 1 1 2 785 1 1 14 ASP HB3 H 10.258 8.943 0.395 1.00 . A A . 14 ASP HB3 1 1 2 786 1 1 14 ASP HD2 H 10.425 7.481 -2.409 1.00 . A A . 14 ASP HD2 1 1 2 787 1 1 14 ASP N N 8.136 8.732 2.346 1.00 . A A . 14 ASP N 1 1 2 788 1 1 14 ASP O O 10.755 7.149 1.785 1.00 . A A . 14 ASP O 1 1 2 789 1 1 14 ASP OD1 O 8.323 8.736 -2.113 1.00 . A A . 14 ASP OD1 1 1 2 790 1 1 14 ASP OD2 O 9.939 7.297 -1.555 1.00 . A A . 14 ASP OD2 1 1 2 791 1 1 15 PRO C C 11.217 4.591 1.683 1.00 . A A . 15 PRO C 1 1 2 792 1 1 15 PRO CA C 9.834 4.533 2.315 1.00 . A A . 15 PRO CA 1 1 2 793 1 1 15 PRO CB C 9.055 3.317 1.819 1.00 . A A . 15 PRO CB 1 1 2 794 1 1 15 PRO CD C 7.657 5.331 1.736 1.00 . A A . 15 PRO CD 1 1 2 795 1 1 15 PRO CG C 7.583 3.838 2.048 1.00 . A A . 15 PRO CG 1 1 2 796 1 1 15 PRO HA H 9.924 4.509 3.401 1.00 . A A . 15 PRO HA 1 1 2 797 1 1 15 PRO HB2 H 9.285 3.074 0.781 1.00 . A A . 15 PRO HB2 1 1 2 798 1 1 15 PRO HB3 H 9.264 2.468 2.470 1.00 . A A . 15 PRO HB3 1 1 2 799 1 1 15 PRO HD2 H 7.299 5.535 0.726 1.00 . A A . 15 PRO HD2 1 1 2 800 1 1 15 PRO HD3 H 7.073 5.891 2.466 1.00 . A A . 15 PRO HD3 1 1 2 801 1 1 15 PRO HG2 H 7.021 3.334 1.261 1.00 . A A . 15 PRO HG2 1 1 2 802 1 1 15 PRO HG3 H 7.140 3.641 3.025 1.00 . A A . 15 PRO HG3 1 1 2 803 1 1 15 PRO N N 9.055 5.674 1.884 1.00 . A A . 15 PRO N 1 1 2 804 1 1 15 PRO O O 11.309 4.806 0.475 1.00 . A A . 15 PRO O 1 1 2 805 1 1 16 ALA C C 14.083 5.893 1.910 1.00 . A A . 16 ALA C 1 1 2 806 1 1 16 ALA CA C 13.611 4.440 1.989 1.00 . A A . 16 ALA CA 1 1 2 807 1 1 16 ALA CB C 13.674 3.732 0.634 1.00 . A A . 16 ALA CB 1 1 2 808 1 1 16 ALA H H 12.165 4.228 3.473 1.00 . A A . 16 ALA H 1 1 2 809 1 1 16 ALA HA H 14.241 3.900 2.697 1.00 . A A . 16 ALA HA 1 1 2 810 1 1 16 ALA HB1 H 12.954 2.914 0.617 1.00 . A A . 16 ALA HB1 1 1 2 811 1 1 16 ALA HB2 H 13.436 4.442 -0.159 1.00 . A A . 16 ALA HB2 1 1 2 812 1 1 16 ALA HB3 H 14.678 3.336 0.477 1.00 . A A . 16 ALA HB3 1 1 2 813 1 1 16 ALA N N 12.249 4.402 2.492 1.00 . A A . 16 ALA N 1 1 2 814 1 1 16 ALA O O 14.187 6.457 0.822 1.00 . A A . 16 ALA O 1 1 2 815 1 1 17 PHE C C 16.340 7.904 3.167 1.00 . A A . 17 PHE C 1 1 2 816 1 1 17 PHE CA C 14.812 7.834 3.155 1.00 . A A . 17 PHE CA 1 1 2 817 1 1 17 PHE CB C 14.276 8.410 4.467 1.00 . A A . 17 PHE CB 1 1 2 818 1 1 17 PHE CD1 C 15.736 10.431 4.713 1.00 . A A . 17 PHE CD1 1 1 2 819 1 1 17 PHE CD2 C 13.403 10.752 4.642 1.00 . A A . 17 PHE CD2 1 1 2 820 1 1 17 PHE CE1 C 15.925 11.832 4.848 1.00 . A A . 17 PHE CE1 1 1 2 821 1 1 17 PHE CE2 C 13.592 12.153 4.777 1.00 . A A . 17 PHE CE2 1 1 2 822 1 1 17 PHE CG C 14.480 9.921 4.613 1.00 . A A . 17 PHE CG 1 1 2 823 1 1 17 PHE CZ C 14.849 12.663 4.877 1.00 . A A . 17 PHE CZ 1 1 2 824 1 1 17 PHE H H 14.266 5.991 3.958 1.00 . A A . 17 PHE H 1 1 2 825 1 1 17 PHE HA H 14.432 8.351 2.273 1.00 . A A . 17 PHE HA 1 1 2 826 1 1 17 PHE HB2 H 13.212 8.189 4.542 1.00 . A A . 17 PHE HB2 1 1 2 827 1 1 17 PHE HB3 H 14.766 7.907 5.301 1.00 . A A . 17 PHE HB3 1 1 2 828 1 1 17 PHE HD1 H 16.598 9.764 4.689 1.00 . A A . 17 PHE HD1 1 1 2 829 1 1 17 PHE HD2 H 12.396 10.342 4.562 1.00 . A A . 17 PHE HD2 1 1 2 830 1 1 17 PHE HE1 H 16.932 12.240 4.928 1.00 . A A . 17 PHE HE1 1 1 2 831 1 1 17 PHE HE2 H 12.730 12.819 4.801 1.00 . A A . 17 PHE HE2 1 1 2 832 1 1 17 PHE HZ H 14.993 13.738 4.981 1.00 . A A . 17 PHE HZ 1 1 2 833 1 1 17 PHE N N 14.354 6.458 3.078 1.00 . A A . 17 PHE N 1 1 2 834 1 1 17 PHE O O 16.948 8.439 2.240 1.00 . A A . 17 PHE O 1 1 2 835 1 1 18 GLU C C 18.764 6.640 5.665 1.00 . A A . 18 GLU C 1 1 2 836 1 1 18 GLU CA C 18.363 7.351 4.371 1.00 . A A . 18 GLU CA 1 1 2 837 1 1 18 GLU CB C 18.924 8.775 4.331 1.00 . A A . 18 GLU CB 1 1 2 838 1 1 18 GLU CD C 20.622 9.973 2.903 1.00 . A A . 18 GLU CD 1 1 2 839 1 1 18 GLU CG C 20.369 8.780 3.826 1.00 . A A . 18 GLU CG 1 1 2 840 1 1 18 GLU H H 16.416 6.925 4.976 1.00 . A A . 18 GLU H 1 1 2 841 1 1 18 GLU HA H 18.738 6.795 3.512 1.00 . A A . 18 GLU HA 1 1 2 842 1 1 18 GLU HB2 H 18.305 9.395 3.682 1.00 . A A . 18 GLU HB2 1 1 2 843 1 1 18 GLU HB3 H 18.882 9.214 5.327 1.00 . A A . 18 GLU HB3 1 1 2 844 1 1 18 GLU HE2 H 19.120 9.621 1.824 1.00 . A A . 18 GLU HE2 1 1 2 845 1 1 18 GLU HG2 H 21.053 8.819 4.673 1.00 . A A . 18 GLU HG2 1 1 2 846 1 1 18 GLU HG3 H 20.574 7.852 3.292 1.00 . A A . 18 GLU HG3 1 1 2 847 1 1 18 GLU N N 16.917 7.358 4.226 1.00 . A A . 18 GLU N 1 1 2 848 1 1 18 GLU O O 19.302 5.535 5.629 1.00 . A A . 18 GLU O 1 1 2 849 1 1 18 GLU OE1 O 21.306 10.929 3.299 1.00 . A A . 18 GLU OE1 1 1 2 850 1 1 18 GLU OE2 O 20.080 9.885 1.736 1.00 . A A . 18 GLU OE2 1 1 2 851 1 1 19 ASP C C 17.576 6.054 8.656 1.00 . A A . 19 ASP C 1 1 2 852 1 1 19 ASP CA C 18.811 6.749 8.081 1.00 . A A . 19 ASP CA 1 1 2 853 1 1 19 ASP CB C 19.233 7.848 9.058 1.00 . A A . 19 ASP CB 1 1 2 854 1 1 19 ASP CG C 20.510 8.599 8.672 1.00 . A A . 19 ASP CG 1 1 2 855 1 1 19 ASP H H 18.048 8.202 6.799 1.00 . A A . 19 ASP H 1 1 2 856 1 1 19 ASP HA H 19.633 6.056 7.900 1.00 . A A . 19 ASP HA 1 1 2 857 1 1 19 ASP HB2 H 18.419 8.567 9.147 1.00 . A A . 19 ASP HB2 1 1 2 858 1 1 19 ASP HB3 H 19.375 7.403 10.042 1.00 . A A . 19 ASP HB3 1 1 2 859 1 1 19 ASP HD2 H 21.061 9.115 6.947 1.00 . A A . 19 ASP HD2 1 1 2 860 1 1 19 ASP N N 18.486 7.304 6.778 1.00 . A A . 19 ASP N 1 1 2 861 1 1 19 ASP O O 17.653 4.909 9.099 1.00 . A A . 19 ASP O 1 1 2 862 1 1 19 ASP OD1 O 21.558 8.451 9.318 1.00 . A A . 19 ASP OD1 1 1 2 863 1 1 19 ASP OD2 O 20.397 9.375 7.649 1.00 . A A . 19 ASP OD2 1 1 2 864 1 1 20 LEU C C 15.496 5.415 10.403 1.00 . A A . 20 LEU C 1 1 2 865 1 1 20 LEU CA C 15.215 6.243 9.147 1.00 . A A . 20 LEU CA 1 1 2 866 1 1 20 LEU CB C 14.472 5.471 8.055 1.00 . A A . 20 LEU CB 1 1 2 867 1 1 20 LEU CD1 C 12.151 4.493 7.932 1.00 . A A . 20 LEU CD1 1 1 2 868 1 1 20 LEU CD2 C 14.159 2.976 8.250 1.00 . A A . 20 LEU CD2 1 1 2 869 1 1 20 LEU CG C 13.549 4.349 8.536 1.00 . A A . 20 LEU CG 1 1 2 870 1 1 20 LEU H H 16.411 7.707 8.272 1.00 . A A . 20 LEU H 1 1 2 871 1 1 20 LEU HA H 14.589 7.090 9.427 1.00 . A A . 20 LEU HA 1 1 2 872 1 1 20 LEU HB2 H 13.879 6.179 7.477 1.00 . A A . 20 LEU HB2 1 1 2 873 1 1 20 LEU HB3 H 15.209 5.042 7.377 1.00 . A A . 20 LEU HB3 1 1 2 874 1 1 20 LEU HD11 H 12.170 4.172 6.890 1.00 . A A . 20 LEU HD11 1 1 2 875 1 1 20 LEU HD12 H 11.448 3.873 8.491 1.00 . A A . 20 LEU HD12 1 1 2 876 1 1 20 LEU HD13 H 11.837 5.536 7.985 1.00 . A A . 20 LEU HD13 1 1 2 877 1 1 20 LEU HD21 H 14.861 3.057 7.419 1.00 . A A . 20 LEU HD21 1 1 2 878 1 1 20 LEU HD22 H 14.685 2.619 9.136 1.00 . A A . 20 LEU HD22 1 1 2 879 1 1 20 LEU HD23 H 13.367 2.274 7.990 1.00 . A A . 20 LEU HD23 1 1 2 880 1 1 20 LEU HG H 13.443 4.434 9.618 1.00 . A A . 20 LEU HG 1 1 2 881 1 1 20 LEU N N 16.465 6.775 8.633 1.00 . A A . 20 LEU N 1 1 2 882 1 1 20 LEU O O 15.620 4.192 10.364 1.00 . A A . 20 LEU O 1 1 2 883 1 1 21 PRO C C 14.561 5.002 13.422 1.00 . A A . 21 PRO C 1 1 2 884 1 1 21 PRO CA C 15.857 5.541 12.834 1.00 . A A . 21 PRO CA 1 1 2 885 1 1 21 PRO CB C 16.400 6.695 13.672 1.00 . A A . 21 PRO CB 1 1 2 886 1 1 21 PRO CD C 15.457 7.556 11.614 1.00 . A A . 21 PRO CD 1 1 2 887 1 1 21 PRO CG C 15.775 7.902 13.067 1.00 . A A . 21 PRO CG 1 1 2 888 1 1 21 PRO HA H 16.594 4.741 12.766 1.00 . A A . 21 PRO HA 1 1 2 889 1 1 21 PRO HB2 H 16.173 6.579 14.732 1.00 . A A . 21 PRO HB2 1 1 2 890 1 1 21 PRO HB3 H 17.476 6.777 13.516 1.00 . A A . 21 PRO HB3 1 1 2 891 1 1 21 PRO HD2 H 14.449 7.877 11.350 1.00 . A A . 21 PRO HD2 1 1 2 892 1 1 21 PRO HD3 H 16.188 8.024 10.954 1.00 . A A . 21 PRO HD3 1 1 2 893 1 1 21 PRO HG2 H 14.844 8.018 13.621 1.00 . A A . 21 PRO HG2 1 1 2 894 1 1 21 PRO HG3 H 16.391 8.797 13.154 1.00 . A A . 21 PRO HG3 1 1 2 895 1 1 21 PRO N N 15.596 6.118 11.532 1.00 . A A . 21 PRO N 1 1 2 896 1 1 21 PRO O O 13.519 5.135 12.782 1.00 . A A . 21 PRO O 1 1 2 897 1 1 22 ASP C C 12.876 4.907 16.199 1.00 . A A . 22 ASP C 1 1 2 898 1 1 22 ASP CA C 13.468 3.861 15.252 1.00 . A A . 22 ASP CA 1 1 2 899 1 1 22 ASP CB C 13.822 2.623 16.079 1.00 . A A . 22 ASP CB 1 1 2 900 1 1 22 ASP CG C 15.187 2.006 15.767 1.00 . A A . 22 ASP CG 1 1 2 901 1 1 22 ASP H H 15.498 4.307 15.118 1.00 . A A . 22 ASP H 1 1 2 902 1 1 22 ASP HA H 12.789 3.601 14.440 1.00 . A A . 22 ASP HA 1 1 2 903 1 1 22 ASP HB2 H 13.793 2.888 17.135 1.00 . A A . 22 ASP HB2 1 1 2 904 1 1 22 ASP HB3 H 13.053 1.866 15.919 1.00 . A A . 22 ASP HB3 1 1 2 905 1 1 22 ASP HD2 H 16.247 2.792 17.111 1.00 . A A . 22 ASP HD2 1 1 2 906 1 1 22 ASP N N 14.646 4.411 14.605 1.00 . A A . 22 ASP N 1 1 2 907 1 1 22 ASP O O 12.367 4.567 17.266 1.00 . A A . 22 ASP O 1 1 2 908 1 1 22 ASP OD1 O 15.277 0.896 15.222 1.00 . A A . 22 ASP OD1 1 1 2 909 1 1 22 ASP OD2 O 16.201 2.724 16.114 1.00 . A A . 22 ASP OD2 1 1 2 910 1 1 23 ASP C C 12.275 8.492 15.681 1.00 . A A . 23 ASP C 1 1 2 911 1 1 23 ASP CA C 12.440 7.257 16.569 1.00 . A A . 23 ASP CA 1 1 2 912 1 1 23 ASP CB C 13.399 7.617 17.706 1.00 . A A . 23 ASP CB 1 1 2 913 1 1 23 ASP CG C 12.812 8.532 18.783 1.00 . A A . 23 ASP CG 1 1 2 914 1 1 23 ASP H H 13.376 6.427 14.903 1.00 . A A . 23 ASP H 1 1 2 915 1 1 23 ASP HA H 11.490 6.898 16.965 1.00 . A A . 23 ASP HA 1 1 2 916 1 1 23 ASP HB2 H 13.739 6.696 18.179 1.00 . A A . 23 ASP HB2 1 1 2 917 1 1 23 ASP HB3 H 14.278 8.100 17.280 1.00 . A A . 23 ASP HB3 1 1 2 918 1 1 23 ASP HD2 H 14.226 9.737 18.479 1.00 . A A . 23 ASP HD2 1 1 2 919 1 1 23 ASP N N 12.961 6.158 15.773 1.00 . A A . 23 ASP N 1 1 2 920 1 1 23 ASP O O 12.624 9.601 16.082 1.00 . A A . 23 ASP O 1 1 2 921 1 1 23 ASP OD1 O 11.651 8.374 19.191 1.00 . A A . 23 ASP OD1 1 1 2 922 1 1 23 ASP OD2 O 13.608 9.450 19.212 1.00 . A A . 23 ASP OD2 1 1 2 923 1 1 24 TRP C C 10.244 10.068 13.939 1.00 . A A . 24 TRP C 1 1 2 924 1 1 24 TRP CA C 11.529 9.338 13.542 1.00 . A A . 24 TRP CA 1 1 2 925 1 1 24 TRP CB C 11.494 8.808 12.106 1.00 . A A . 24 TRP CB 1 1 2 926 1 1 24 TRP CD1 C 12.758 10.722 10.923 1.00 . A A . 24 TRP CD1 1 1 2 927 1 1 24 TRP CD2 C 10.841 10.201 9.941 1.00 . A A . 24 TRP CD2 1 1 2 928 1 1 24 TRP CE2 C 11.411 11.227 9.216 1.00 . A A . 24 TRP CE2 1 1 2 929 1 1 24 TRP CE3 C 9.607 9.639 9.572 1.00 . A A . 24 TRP CE3 1 1 2 930 1 1 24 TRP CG C 11.720 9.882 11.042 1.00 . A A . 24 TRP CG 1 1 2 931 1 1 24 TRP CH2 C 9.585 11.239 7.689 1.00 . A A . 24 TRP CH2 1 1 2 932 1 1 24 TRP CZ2 C 10.816 11.783 8.076 1.00 . A A . 24 TRP CZ2 1 1 2 933 1 1 24 TRP CZ3 C 9.025 10.205 8.431 1.00 . A A . 24 TRP CZ3 1 1 2 934 1 1 24 TRP H H 11.463 7.353 14.171 1.00 . A A . 24 TRP H 1 1 2 935 1 1 24 TRP HA H 12.379 10.015 13.609 1.00 . A A . 24 TRP HA 1 1 2 936 1 1 24 TRP HB2 H 12.256 8.036 11.997 1.00 . A A . 24 TRP HB2 1 1 2 937 1 1 24 TRP HB3 H 10.530 8.331 11.929 1.00 . A A . 24 TRP HB3 1 1 2 938 1 1 24 TRP HD1 H 13.609 10.745 11.603 1.00 . A A . 24 TRP HD1 1 1 2 939 1 1 24 TRP HE1 H 13.313 12.326 9.513 1.00 . A A . 24 TRP HE1 1 1 2 940 1 1 24 TRP HE3 H 9.136 8.828 10.128 1.00 . A A . 24 TRP HE3 1 1 2 941 1 1 24 TRP HH2 H 9.068 11.625 6.810 1.00 . A A . 24 TRP HH2 1 1 2 942 1 1 24 TRP HZ2 H 11.286 12.593 7.520 1.00 . A A . 24 TRP HZ2 1 1 2 943 1 1 24 TRP HZ3 H 8.066 9.806 8.100 1.00 . A A . 24 TRP HZ3 1 1 2 944 1 1 24 TRP N N 11.743 8.258 14.490 1.00 . A A . 24 TRP N 1 1 2 945 1 1 24 TRP NE1 N 12.613 11.554 9.832 1.00 . A A . 24 TRP NE1 1 1 2 946 1 1 24 TRP O O 9.264 9.438 14.333 1.00 . A A . 24 TRP O 1 1 2 947 1 1 25 ALA C C 8.776 13.089 12.970 1.00 . A A . 25 ALA C 1 1 2 948 1 1 25 ALA CA C 9.144 12.209 14.167 1.00 . A A . 25 ALA CA 1 1 2 949 1 1 25 ALA CB C 9.460 13.031 15.418 1.00 . A A . 25 ALA CB 1 1 2 950 1 1 25 ALA H H 11.093 11.892 13.503 1.00 . A A . 25 ALA H 1 1 2 951 1 1 25 ALA HA H 8.311 11.542 14.387 1.00 . A A . 25 ALA HA 1 1 2 952 1 1 25 ALA HB1 H 9.689 14.058 15.131 1.00 . A A . 25 ALA HB1 1 1 2 953 1 1 25 ALA HB2 H 8.599 13.024 16.085 1.00 . A A . 25 ALA HB2 1 1 2 954 1 1 25 ALA HB3 H 10.320 12.598 15.930 1.00 . A A . 25 ALA HB3 1 1 2 955 1 1 25 ALA N N 10.292 11.387 13.824 1.00 . A A . 25 ALA N 1 1 2 956 1 1 25 ALA O O 9.654 13.609 12.285 1.00 . A A . 25 ALA O 1 1 2 957 1 1 26 CYS C C 7.813 15.315 11.584 1.00 . A A . 26 CYS C 1 1 2 958 1 1 26 CYS CA C 6.981 14.033 11.653 1.00 . A A . 26 CYS CA 1 1 2 959 1 1 26 CYS CB C 5.486 14.330 11.795 1.00 . A A . 26 CYS CB 1 1 2 960 1 1 26 CYS H H 6.768 12.799 13.318 1.00 . A A . 26 CYS H 1 1 2 961 1 1 26 CYS HA H 7.108 13.439 10.748 1.00 . A A . 26 CYS HA 1 1 2 962 1 1 26 CYS HB2 H 5.061 13.638 12.522 1.00 . A A . 26 CYS HB2 1 1 2 963 1 1 26 CYS HB3 H 5.367 15.333 12.203 1.00 . A A . 26 CYS HB3 1 1 2 964 1 1 26 CYS N N 7.475 13.226 12.755 1.00 . A A . 26 CYS N 1 1 2 965 1 1 26 CYS O O 8.152 15.928 12.594 1.00 . A A . 26 CYS O 1 1 2 966 1 1 26 CYS SG S 4.528 14.210 10.240 1.00 . A A . 26 CYS SG 1 1 2 967 1 1 27 PRO C C 8.003 18.109 10.010 1.00 . A A . 27 PRO C 1 1 2 968 1 1 27 PRO CA C 8.917 16.893 10.054 1.00 . A A . 27 PRO CA 1 1 2 969 1 1 27 PRO CB C 9.533 16.622 8.683 1.00 . A A . 27 PRO CB 1 1 2 970 1 1 27 PRO CD C 7.756 15.015 9.142 1.00 . A A . 27 PRO CD 1 1 2 971 1 1 27 PRO CG C 8.390 15.816 8.008 1.00 . A A . 27 PRO CG 1 1 2 972 1 1 27 PRO HA H 9.700 17.045 10.797 1.00 . A A . 27 PRO HA 1 1 2 973 1 1 27 PRO HB2 H 9.738 17.539 8.132 1.00 . A A . 27 PRO HB2 1 1 2 974 1 1 27 PRO HB3 H 10.442 16.035 8.808 1.00 . A A . 27 PRO HB3 1 1 2 975 1 1 27 PRO HD2 H 6.673 14.971 9.030 1.00 . A A . 27 PRO HD2 1 1 2 976 1 1 27 PRO HD3 H 8.176 14.009 9.163 1.00 . A A . 27 PRO HD3 1 1 2 977 1 1 27 PRO HG2 H 7.603 16.237 7.382 1.00 . A A . 27 PRO HG2 1 1 2 978 1 1 27 PRO HG3 H 9.079 15.218 7.412 1.00 . A A . 27 PRO HG3 1 1 2 979 1 1 27 PRO N N 8.139 15.711 10.351 1.00 . A A . 27 PRO N 1 1 2 980 1 1 27 PRO O O 8.417 19.147 9.494 1.00 . A A . 27 PRO O 1 1 2 981 1 1 28 VAL C C 5.112 19.088 11.890 1.00 . A A . 28 VAL C 1 1 2 982 1 1 28 VAL CA C 5.848 19.064 10.548 1.00 . A A . 28 VAL CA 1 1 2 983 1 1 28 VAL CB C 4.901 18.947 9.351 1.00 . A A . 28 VAL CB 1 1 2 984 1 1 28 VAL CG1 C 4.373 20.321 8.933 1.00 . A A . 28 VAL CG1 1 1 2 985 1 1 28 VAL CG2 C 5.586 18.244 8.178 1.00 . A A . 28 VAL CG2 1 1 2 986 1 1 28 VAL H H 6.468 17.118 10.957 1.00 . A A . 28 VAL H 1 1 2 987 1 1 28 VAL HA H 6.413 19.989 10.441 1.00 . A A . 28 VAL HA 1 1 2 988 1 1 28 VAL HB H 4.049 18.339 9.655 1.00 . A A . 28 VAL HB 1 1 2 989 1 1 28 VAL HG11 H 3.461 20.197 8.349 1.00 . A A . 28 VAL HG11 1 1 2 990 1 1 28 VAL HG12 H 4.157 20.912 9.824 1.00 . A A . 28 VAL HG12 1 1 2 991 1 1 28 VAL HG13 H 5.124 20.832 8.331 1.00 . A A . 28 VAL HG13 1 1 2 992 1 1 28 VAL HG21 H 6.534 18.737 7.961 1.00 . A A . 28 VAL HG21 1 1 2 993 1 1 28 VAL HG22 H 5.771 17.201 8.437 1.00 . A A . 28 VAL HG22 1 1 2 994 1 1 28 VAL HG23 H 4.943 18.291 7.300 1.00 . A A . 28 VAL HG23 1 1 2 995 1 1 28 VAL N N 6.797 17.965 10.540 1.00 . A A . 28 VAL N 1 1 2 996 1 1 28 VAL O O 5.371 19.951 12.728 1.00 . A A . 28 VAL O 1 1 2 997 1 1 29 CYS C C 4.400 17.735 14.431 1.00 . A A . 29 CYS C 1 1 2 998 1 1 29 CYS CA C 3.438 18.030 13.278 1.00 . A A . 29 CYS CA 1 1 2 999 1 1 29 CYS CB C 2.337 16.973 13.168 1.00 . A A . 29 CYS CB 1 1 2 1000 1 1 29 CYS H H 4.007 17.432 11.365 1.00 . A A . 29 CYS H 1 1 2 1001 1 1 29 CYS HA H 2.949 18.995 13.419 1.00 . A A . 29 CYS HA 1 1 2 1002 1 1 29 CYS HB2 H 1.651 17.094 14.006 1.00 . A A . 29 CYS HB2 1 1 2 1003 1 1 29 CYS HB3 H 1.764 17.159 12.259 1.00 . A A . 29 CYS HB3 1 1 2 1004 1 1 29 CYS N N 4.212 18.131 12.052 1.00 . A A . 29 CYS N 1 1 2 1005 1 1 29 CYS O O 4.082 17.991 15.591 1.00 . A A . 29 CYS O 1 1 2 1006 1 1 29 CYS SG S 2.934 15.244 13.141 1.00 . A A . 29 CYS SG 1 1 2 1007 1 1 30 GLY C C 6.079 15.751 15.988 1.00 . A A . 30 GLY C 1 1 2 1008 1 1 30 GLY CA C 6.567 16.865 15.060 1.00 . A A . 30 GLY CA 1 1 2 1009 1 1 30 GLY H H 5.807 16.993 13.125 1.00 . A A . 30 GLY H 1 1 2 1010 1 1 30 GLY HA2 H 7.482 16.551 14.559 1.00 . A A . 30 GLY HA2 1 1 2 1011 1 1 30 GLY HA3 H 6.812 17.750 15.647 1.00 . A A . 30 GLY HA3 1 1 2 1012 1 1 30 GLY N N 5.556 17.198 14.070 1.00 . A A . 30 GLY N 1 1 2 1013 1 1 30 GLY O O 6.393 15.745 17.177 1.00 . A A . 30 GLY O 1 1 2 1014 1 1 31 ALA C C 5.596 12.458 15.857 1.00 . A A . 31 ALA C 1 1 2 1015 1 1 31 ALA CA C 4.783 13.716 16.168 1.00 . A A . 31 ALA CA 1 1 2 1016 1 1 31 ALA CB C 3.297 13.546 15.848 1.00 . A A . 31 ALA CB 1 1 2 1017 1 1 31 ALA H H 5.066 14.846 14.441 1.00 . A A . 31 ALA H 1 1 2 1018 1 1 31 ALA HA H 4.888 13.954 17.227 1.00 . A A . 31 ALA HA 1 1 2 1019 1 1 31 ALA HB1 H 3.185 12.897 14.978 1.00 . A A . 31 ALA HB1 1 1 2 1020 1 1 31 ALA HB2 H 2.790 13.096 16.703 1.00 . A A . 31 ALA HB2 1 1 2 1021 1 1 31 ALA HB3 H 2.857 14.519 15.635 1.00 . A A . 31 ALA HB3 1 1 2 1022 1 1 31 ALA N N 5.318 14.833 15.409 1.00 . A A . 31 ALA N 1 1 2 1023 1 1 31 ALA O O 6.275 12.391 14.834 1.00 . A A . 31 ALA O 1 1 2 1024 1 1 32 SER C C 5.767 9.545 15.307 1.00 . A A . 32 SER C 1 1 2 1025 1 1 32 SER CA C 6.217 10.239 16.593 1.00 . A A . 32 SER CA 1 1 2 1026 1 1 32 SER CB C 6.002 9.318 17.797 1.00 . A A . 32 SER CB 1 1 2 1027 1 1 32 SER H H 4.945 11.555 17.589 1.00 . A A . 32 SER H 1 1 2 1028 1 1 32 SER HA H 7.269 10.517 16.532 1.00 . A A . 32 SER HA 1 1 2 1029 1 1 32 SER HB2 H 6.371 8.321 17.559 1.00 . A A . 32 SER HB2 1 1 2 1030 1 1 32 SER HB3 H 6.587 9.683 18.640 1.00 . A A . 32 SER HB3 1 1 2 1031 1 1 32 SER HG H 4.490 9.681 19.056 1.00 . A A . 32 SER HG 1 1 2 1032 1 1 32 SER N N 5.499 11.492 16.759 1.00 . A A . 32 SER N 1 1 2 1033 1 1 32 SER O O 4.646 9.752 14.843 1.00 . A A . 32 SER O 1 1 2 1034 1 1 32 SER OG O 4.629 9.238 18.170 1.00 . A A . 32 SER OG 1 1 2 1035 1 1 33 LYS C C 5.642 6.709 13.884 1.00 . A A . 33 LYS C 1 1 2 1036 1 1 33 LYS CA C 6.375 8.008 13.541 1.00 . A A . 33 LYS CA 1 1 2 1037 1 1 33 LYS CB C 7.653 7.797 12.728 1.00 . A A . 33 LYS CB 1 1 2 1038 1 1 33 LYS CD C 8.765 5.539 12.891 1.00 . A A . 33 LYS CD 1 1 2 1039 1 1 33 LYS CE C 8.623 4.461 13.968 1.00 . A A . 33 LYS CE 1 1 2 1040 1 1 33 LYS CG C 8.658 6.939 13.499 1.00 . A A . 33 LYS CG 1 1 2 1041 1 1 33 LYS H H 7.574 8.571 15.148 1.00 . A A . 33 LYS H 1 1 2 1042 1 1 33 LYS HA H 5.710 8.630 12.941 1.00 . A A . 33 LYS HA 1 1 2 1043 1 1 33 LYS HB2 H 7.411 7.315 11.780 1.00 . A A . 33 LYS HB2 1 1 2 1044 1 1 33 LYS HB3 H 8.100 8.761 12.488 1.00 . A A . 33 LYS HB3 1 1 2 1045 1 1 33 LYS HD2 H 7.990 5.406 12.136 1.00 . A A . 33 LYS HD2 1 1 2 1046 1 1 33 LYS HD3 H 9.723 5.429 12.385 1.00 . A A . 33 LYS HD3 1 1 2 1047 1 1 33 LYS HE2 H 9.504 4.464 14.610 1.00 . A A . 33 LYS HE2 1 1 2 1048 1 1 33 LYS HE3 H 7.765 4.684 14.603 1.00 . A A . 33 LYS HE3 1 1 2 1049 1 1 33 LYS HG2 H 9.636 7.419 13.487 1.00 . A A . 33 LYS HG2 1 1 2 1050 1 1 33 LYS HG3 H 8.352 6.864 14.542 1.00 . A A . 33 LYS HG3 1 1 2 1051 1 1 33 LYS HZ1 H 7.481 2.869 13.259 1.00 . A A . 33 LYS HZ1 1 1 2 1052 1 1 33 LYS HZ2 H 8.858 3.089 12.419 1.00 . A A . 33 LYS HZ2 1 1 2 1053 1 1 33 LYS N N 6.664 8.734 14.764 1.00 . A A . 33 LYS N 1 1 2 1054 1 1 33 LYS NZ N 8.457 3.128 13.349 1.00 . A A . 33 LYS NZ 1 1 2 1055 1 1 33 LYS O O 6.020 5.637 13.415 1.00 . A A . 33 LYS O 1 1 2 1056 1 1 34 ASP C C 2.400 5.836 14.559 1.00 . A A . 34 ASP C 1 1 2 1057 1 1 34 ASP CA C 3.820 5.699 15.113 1.00 . A A . 34 ASP CA 1 1 2 1058 1 1 34 ASP CB C 3.726 5.614 16.638 1.00 . A A . 34 ASP CB 1 1 2 1059 1 1 34 ASP CG C 2.998 4.379 17.172 1.00 . A A . 34 ASP CG 1 1 2 1060 1 1 34 ASP H H 4.307 7.725 15.078 1.00 . A A . 34 ASP H 1 1 2 1061 1 1 34 ASP HA H 4.344 4.834 14.709 1.00 . A A . 34 ASP HA 1 1 2 1062 1 1 34 ASP HB2 H 4.735 5.630 17.050 1.00 . A A . 34 ASP HB2 1 1 2 1063 1 1 34 ASP HB3 H 3.217 6.505 17.006 1.00 . A A . 34 ASP HB3 1 1 2 1064 1 1 34 ASP HD2 H 2.752 5.260 18.818 1.00 . A A . 34 ASP HD2 1 1 2 1065 1 1 34 ASP N N 4.608 6.848 14.700 1.00 . A A . 34 ASP N 1 1 2 1066 1 1 34 ASP O O 1.816 4.858 14.092 1.00 . A A . 34 ASP O 1 1 2 1067 1 1 34 ASP OD1 O 3.090 3.285 16.597 1.00 . A A . 34 ASP OD1 1 1 2 1068 1 1 34 ASP OD2 O 2.305 4.576 18.242 1.00 . A A . 34 ASP OD2 1 1 2 1069 1 1 35 ALA C C 0.499 7.088 12.630 1.00 . A A . 35 ALA C 1 1 2 1070 1 1 35 ALA CA C 0.546 7.331 14.140 1.00 . A A . 35 ALA CA 1 1 2 1071 1 1 35 ALA CB C 0.150 8.761 14.513 1.00 . A A . 35 ALA CB 1 1 2 1072 1 1 35 ALA H H 2.367 7.844 15.009 1.00 . A A . 35 ALA H 1 1 2 1073 1 1 35 ALA HA H -0.136 6.638 14.632 1.00 . A A . 35 ALA HA 1 1 2 1074 1 1 35 ALA HB1 H 1.050 9.359 14.659 1.00 . A A . 35 ALA HB1 1 1 2 1075 1 1 35 ALA HB2 H -0.448 9.193 13.711 1.00 . A A . 35 ALA HB2 1 1 2 1076 1 1 35 ALA HB3 H -0.431 8.748 15.434 1.00 . A A . 35 ALA HB3 1 1 2 1077 1 1 35 ALA N N 1.886 7.054 14.629 1.00 . A A . 35 ALA N 1 1 2 1078 1 1 35 ALA O O -0.580 7.026 12.041 1.00 . A A . 35 ALA O 1 1 2 1079 1 1 36 PHE C C 1.240 5.342 10.244 1.00 . A A . 36 PHE C 1 1 2 1080 1 1 36 PHE CA C 1.787 6.721 10.616 1.00 . A A . 36 PHE CA 1 1 2 1081 1 1 36 PHE CB C 3.275 6.778 10.264 1.00 . A A . 36 PHE CB 1 1 2 1082 1 1 36 PHE CD1 C 3.479 9.161 11.006 1.00 . A A . 36 PHE CD1 1 1 2 1083 1 1 36 PHE CD2 C 4.658 8.497 9.077 1.00 . A A . 36 PHE CD2 1 1 2 1084 1 1 36 PHE CE1 C 3.989 10.479 10.864 1.00 . A A . 36 PHE CE1 1 1 2 1085 1 1 36 PHE CE2 C 5.167 9.814 8.935 1.00 . A A . 36 PHE CE2 1 1 2 1086 1 1 36 PHE CG C 3.824 8.198 10.110 1.00 . A A . 36 PHE CG 1 1 2 1087 1 1 36 PHE CZ C 4.823 10.777 9.831 1.00 . A A . 36 PHE CZ 1 1 2 1088 1 1 36 PHE H H 2.553 7.007 12.533 1.00 . A A . 36 PHE H 1 1 2 1089 1 1 36 PHE HA H 1.198 7.491 10.117 1.00 . A A . 36 PHE HA 1 1 2 1090 1 1 36 PHE HB2 H 3.841 6.262 11.038 1.00 . A A . 36 PHE HB2 1 1 2 1091 1 1 36 PHE HB3 H 3.439 6.234 9.333 1.00 . A A . 36 PHE HB3 1 1 2 1092 1 1 36 PHE HD1 H 2.811 8.922 11.833 1.00 . A A . 36 PHE HD1 1 1 2 1093 1 1 36 PHE HD2 H 4.933 7.724 8.359 1.00 . A A . 36 PHE HD2 1 1 2 1094 1 1 36 PHE HE1 H 3.712 11.250 11.582 1.00 . A A . 36 PHE HE1 1 1 2 1095 1 1 36 PHE HE2 H 5.835 10.054 8.107 1.00 . A A . 36 PHE HE2 1 1 2 1096 1 1 36 PHE HZ H 5.214 11.789 9.721 1.00 . A A . 36 PHE HZ 1 1 2 1097 1 1 36 PHE N N 1.680 6.956 12.046 1.00 . A A . 36 PHE N 1 1 2 1098 1 1 36 PHE O O 1.556 4.348 10.897 1.00 . A A . 36 PHE O 1 1 2 1099 1 1 37 GLU C C -0.552 4.201 7.256 1.00 . A A . 37 GLU C 1 1 2 1100 1 1 37 GLU CA C -0.169 4.084 8.733 1.00 . A A . 37 GLU CA 1 1 2 1101 1 1 37 GLU CB C -1.380 3.703 9.586 1.00 . A A . 37 GLU CB 1 1 2 1102 1 1 37 GLU CD C -0.060 1.782 10.550 1.00 . A A . 37 GLU CD 1 1 2 1103 1 1 37 GLU CG C -1.379 2.206 9.901 1.00 . A A . 37 GLU CG 1 1 2 1104 1 1 37 GLU H H 0.174 6.138 8.674 1.00 . A A . 37 GLU H 1 1 2 1105 1 1 37 GLU HA H 0.607 3.328 8.855 1.00 . A A . 37 GLU HA 1 1 2 1106 1 1 37 GLU HB2 H -1.370 4.273 10.515 1.00 . A A . 37 GLU HB2 1 1 2 1107 1 1 37 GLU HB3 H -2.297 3.967 9.059 1.00 . A A . 37 GLU HB3 1 1 2 1108 1 1 37 GLU HE2 H 0.063 0.374 9.306 1.00 . A A . 37 GLU HE2 1 1 2 1109 1 1 37 GLU HG2 H -2.209 1.970 10.567 1.00 . A A . 37 GLU HG2 1 1 2 1110 1 1 37 GLU HG3 H -1.536 1.637 8.984 1.00 . A A . 37 GLU HG3 1 1 2 1111 1 1 37 GLU N N 0.426 5.325 9.199 1.00 . A A . 37 GLU N 1 1 2 1112 1 1 37 GLU O O -0.957 5.269 6.799 1.00 . A A . 37 GLU O 1 1 2 1113 1 1 37 GLU OE1 O 0.249 2.220 11.668 1.00 . A A . 37 GLU OE1 1 1 2 1114 1 1 37 GLU OE2 O 0.654 0.967 9.851 1.00 . A A . 37 GLU OE2 1 1 2 1115 1 1 38 LYS C C -2.009 3.866 4.890 1.00 . A A . 38 LYS C 1 1 2 1116 1 1 38 LYS CA C -0.737 3.052 5.136 1.00 . A A . 38 LYS CA 1 1 2 1117 1 1 38 LYS CB C -0.827 1.607 4.643 1.00 . A A . 38 LYS CB 1 1 2 1118 1 1 38 LYS CD C -2.678 1.223 2.974 1.00 . A A . 38 LYS CD 1 1 2 1119 1 1 38 LYS CE C -2.981 0.860 1.518 1.00 . A A . 38 LYS CE 1 1 2 1120 1 1 38 LYS CG C -1.196 1.555 3.160 1.00 . A A . 38 LYS CG 1 1 2 1121 1 1 38 LYS H H -0.080 2.224 6.931 1.00 . A A . 38 LYS H 1 1 2 1122 1 1 38 LYS HA H 0.085 3.524 4.599 1.00 . A A . 38 LYS HA 1 1 2 1123 1 1 38 LYS HB2 H 0.126 1.104 4.803 1.00 . A A . 38 LYS HB2 1 1 2 1124 1 1 38 LYS HB3 H -1.573 1.066 5.226 1.00 . A A . 38 LYS HB3 1 1 2 1125 1 1 38 LYS HD2 H -2.953 0.391 3.624 1.00 . A A . 38 LYS HD2 1 1 2 1126 1 1 38 LYS HD3 H -3.286 2.076 3.273 1.00 . A A . 38 LYS HD3 1 1 2 1127 1 1 38 LYS HE2 H -3.492 1.689 1.030 1.00 . A A . 38 LYS HE2 1 1 2 1128 1 1 38 LYS HE3 H -2.049 0.697 0.977 1.00 . A A . 38 LYS HE3 1 1 2 1129 1 1 38 LYS HG2 H -0.974 2.515 2.692 1.00 . A A . 38 LYS HG2 1 1 2 1130 1 1 38 LYS HG3 H -0.586 0.806 2.655 1.00 . A A . 38 LYS HG3 1 1 2 1131 1 1 38 LYS HZ1 H -3.299 -1.191 1.700 1.00 . A A . 38 LYS HZ1 1 1 2 1132 1 1 38 LYS HZ2 H -4.613 -0.307 2.081 1.00 . A A . 38 LYS HZ2 1 1 2 1133 1 1 38 LYS N N -0.410 3.088 6.551 1.00 . A A . 38 LYS N 1 1 2 1134 1 1 38 LYS NZ N -3.820 -0.357 1.451 1.00 . A A . 38 LYS NZ 1 1 2 1135 1 1 38 LYS O O -2.953 3.801 5.675 1.00 . A A . 38 LYS O 1 1 2 1136 1 1 39 GLN C C -2.953 6.007 2.027 1.00 . A A . 39 GLN C 1 1 2 1137 1 1 39 GLN CA C -3.132 5.441 3.437 1.00 . A A . 39 GLN CA 1 1 2 1138 1 1 39 GLN CB C -3.339 6.564 4.456 1.00 . A A . 39 GLN CB 1 1 2 1139 1 1 39 GLN CD C -5.531 7.438 3.567 1.00 . A A . 39 GLN CD 1 1 2 1140 1 1 39 GLN CG C -4.826 6.769 4.750 1.00 . A A . 39 GLN CG 1 1 2 1141 1 1 39 GLN H H -1.219 4.662 3.163 1.00 . A A . 39 GLN H 1 1 2 1142 1 1 39 GLN HA H -3.992 4.773 3.461 1.00 . A A . 39 GLN HA 1 1 2 1143 1 1 39 GLN HB2 H -2.813 6.322 5.380 1.00 . A A . 39 GLN HB2 1 1 2 1144 1 1 39 GLN HB3 H -2.908 7.489 4.076 1.00 . A A . 39 GLN HB3 1 1 2 1145 1 1 39 GLN HE21 H -5.080 9.238 4.376 1.00 . A A . 39 GLN HE21 1 1 2 1146 1 1 39 GLN HE22 H -5.958 9.295 2.883 1.00 . A A . 39 GLN HE22 1 1 2 1147 1 1 39 GLN HG2 H -5.295 5.809 4.961 1.00 . A A . 39 GLN HG2 1 1 2 1148 1 1 39 GLN HG3 H -4.943 7.385 5.641 1.00 . A A . 39 GLN HG3 1 1 2 1149 1 1 39 GLN N N -1.991 4.615 3.797 1.00 . A A . 39 GLN N 1 1 2 1150 1 1 39 GLN NE2 N -5.522 8.767 3.612 1.00 . A A . 39 GLN NE2 1 1 2 1151 1 1 39 GLN O O -2.781 5.255 1.069 1.00 . A A . 39 GLN O 1 1 2 1152 1 1 39 GLN OE1 O -6.047 6.789 2.671 1.00 . A A . 39 GLN OE1 1 1 3 1153 1 1 1 MET C C 3.378 2.101 -1.813 1.00 . A A . 1 MET C 1 1 3 1154 1 1 1 MET CA C 2.389 1.601 -2.868 1.00 . A A . 1 MET CA 1 1 3 1155 1 1 1 MET CB C 2.444 2.517 -4.093 1.00 . A A . 1 MET CB 1 1 3 1156 1 1 1 MET CE C 2.934 1.229 -7.644 1.00 . A A . 1 MET CE 1 1 3 1157 1 1 1 MET CG C 1.719 1.884 -5.283 1.00 . A A . 1 MET CG 1 1 3 1158 1 1 1 MET H1 H 0.785 0.734 -1.863 1.00 . A A . 1 MET H1 1 1 3 1159 1 1 1 MET HA H 2.621 0.569 -3.133 1.00 . A A . 1 MET HA 1 1 3 1160 1 1 1 MET HB2 H 1.989 3.478 -3.854 1.00 . A A . 1 MET HB2 1 1 3 1161 1 1 1 MET HB3 H 3.483 2.713 -4.359 1.00 . A A . 1 MET HB3 1 1 3 1162 1 1 1 MET HE1 H 2.128 0.671 -8.121 1.00 . A A . 1 MET HE1 1 1 3 1163 1 1 1 MET HE2 H 3.643 1.560 -8.401 1.00 . A A . 1 MET HE2 1 1 3 1164 1 1 1 MET HE3 H 3.442 0.589 -6.924 1.00 . A A . 1 MET HE3 1 1 3 1165 1 1 1 MET HG2 H 1.920 0.813 -5.315 1.00 . A A . 1 MET HG2 1 1 3 1166 1 1 1 MET HG3 H 0.642 2.002 -5.167 1.00 . A A . 1 MET HG3 1 1 3 1167 1 1 1 MET N N 1.035 1.575 -2.343 1.00 . A A . 1 MET N 1 1 3 1168 1 1 1 MET O O 4.083 3.085 -2.034 1.00 . A A . 1 MET O 1 1 3 1169 1 1 1 MET SD S 2.257 2.650 -6.803 1.00 . A A . 1 MET SD 1 1 3 1170 1 1 2 ASP C C 4.249 3.280 0.605 1.00 . A A . 2 ASP C 1 1 3 1171 1 1 2 ASP CA C 4.287 1.763 0.403 1.00 . A A . 2 ASP CA 1 1 3 1172 1 1 2 ASP CB C 5.730 1.364 0.092 1.00 . A A . 2 ASP CB 1 1 3 1173 1 1 2 ASP CG C 6.001 -0.142 0.107 1.00 . A A . 2 ASP CG 1 1 3 1174 1 1 2 ASP H H 2.820 0.604 -0.516 1.00 . A A . 2 ASP H 1 1 3 1175 1 1 2 ASP HA H 3.913 1.218 1.269 1.00 . A A . 2 ASP HA 1 1 3 1176 1 1 2 ASP HB2 H 5.996 1.755 -0.890 1.00 . A A . 2 ASP HB2 1 1 3 1177 1 1 2 ASP HB3 H 6.389 1.843 0.815 1.00 . A A . 2 ASP HB3 1 1 3 1178 1 1 2 ASP HD2 H 6.412 -1.333 1.508 1.00 . A A . 2 ASP HD2 1 1 3 1179 1 1 2 ASP N N 3.397 1.403 -0.688 1.00 . A A . 2 ASP N 1 1 3 1180 1 1 2 ASP O O 5.012 4.012 -0.024 1.00 . A A . 2 ASP O 1 1 3 1181 1 1 2 ASP OD1 O 5.474 -0.895 -0.725 1.00 . A A . 2 ASP OD1 1 1 3 1182 1 1 2 ASP OD2 O 6.802 -0.542 1.036 1.00 . A A . 2 ASP OD2 1 1 3 1183 1 1 3 ILE C C 2.853 5.298 3.256 1.00 . A A . 3 ILE C 1 1 3 1184 1 1 3 ILE CA C 3.209 5.121 1.778 1.00 . A A . 3 ILE CA 1 1 3 1185 1 1 3 ILE CB C 2.202 5.765 0.822 1.00 . A A . 3 ILE CB 1 1 3 1186 1 1 3 ILE CD1 C 1.690 6.335 -1.580 1.00 . A A . 3 ILE CD1 1 1 3 1187 1 1 3 ILE CG1 C 2.706 5.712 -0.622 1.00 . A A . 3 ILE CG1 1 1 3 1188 1 1 3 ILE CG2 C 1.865 7.191 1.260 1.00 . A A . 3 ILE CG2 1 1 3 1189 1 1 3 ILE H H 2.739 3.104 1.992 1.00 . A A . 3 ILE H 1 1 3 1190 1 1 3 ILE HA H 4.174 5.594 1.595 1.00 . A A . 3 ILE HA 1 1 3 1191 1 1 3 ILE HB H 1.278 5.189 0.861 1.00 . A A . 3 ILE HB 1 1 3 1192 1 1 3 ILE HD11 H 2.204 7.007 -2.269 1.00 . A A . 3 ILE HD11 1 1 3 1193 1 1 3 ILE HD12 H 1.192 5.547 -2.145 1.00 . A A . 3 ILE HD12 1 1 3 1194 1 1 3 ILE HD13 H 0.950 6.896 -1.011 1.00 . A A . 3 ILE HD13 1 1 3 1195 1 1 3 ILE HG12 H 3.656 6.241 -0.699 1.00 . A A . 3 ILE HG12 1 1 3 1196 1 1 3 ILE HG13 H 2.895 4.677 -0.908 1.00 . A A . 3 ILE HG13 1 1 3 1197 1 1 3 ILE HG21 H 0.786 7.292 1.373 1.00 . A A . 3 ILE HG21 1 1 3 1198 1 1 3 ILE HG22 H 2.352 7.404 2.212 1.00 . A A . 3 ILE HG22 1 1 3 1199 1 1 3 ILE HG23 H 2.218 7.896 0.507 1.00 . A A . 3 ILE HG23 1 1 3 1200 1 1 3 ILE N N 3.355 3.705 1.485 1.00 . A A . 3 ILE N 1 1 3 1201 1 1 3 ILE O O 1.990 4.616 3.805 1.00 . A A . 3 ILE O 1 1 3 1202 1 1 4 TYR C C 2.726 7.920 5.451 1.00 . A A . 4 TYR C 1 1 3 1203 1 1 4 TYR CA C 3.331 6.531 5.297 1.00 . A A . 4 TYR CA 1 1 3 1204 1 1 4 TYR CB C 4.657 6.434 6.046 1.00 . A A . 4 TYR CB 1 1 3 1205 1 1 4 TYR CD1 C 4.889 4.162 7.114 1.00 . A A . 4 TYR CD1 1 1 3 1206 1 1 4 TYR CD2 C 6.103 4.617 5.064 1.00 . A A . 4 TYR CD2 1 1 3 1207 1 1 4 TYR CE1 C 5.420 2.867 7.141 1.00 . A A . 4 TYR CE1 1 1 3 1208 1 1 4 TYR CE2 C 6.634 3.321 5.092 1.00 . A A . 4 TYR CE2 1 1 3 1209 1 1 4 TYR CG C 5.231 5.036 6.075 1.00 . A A . 4 TYR CG 1 1 3 1210 1 1 4 TYR CZ C 6.293 2.447 6.131 1.00 . A A . 4 TYR CZ 1 1 3 1211 1 1 4 TYR H H 4.245 6.775 3.395 1.00 . A A . 4 TYR H 1 1 3 1212 1 1 4 TYR HA H 2.637 5.797 5.707 1.00 . A A . 4 TYR HA 1 1 3 1213 1 1 4 TYR HB2 H 5.378 7.095 5.566 1.00 . A A . 4 TYR HB2 1 1 3 1214 1 1 4 TYR HB3 H 4.504 6.768 7.071 1.00 . A A . 4 TYR HB3 1 1 3 1215 1 1 4 TYR HD1 H 4.216 4.486 7.894 1.00 . A A . 4 TYR HD1 1 1 3 1216 1 1 4 TYR HD2 H 6.367 5.291 4.263 1.00 . A A . 4 TYR HD2 1 1 3 1217 1 1 4 TYR HE1 H 5.157 2.192 7.942 1.00 . A A . 4 TYR HE1 1 1 3 1218 1 1 4 TYR HE2 H 7.307 2.997 4.313 1.00 . A A . 4 TYR HE2 1 1 3 1219 1 1 4 TYR HH H 7.769 1.172 6.126 1.00 . A A . 4 TYR HH 1 1 3 1220 1 1 4 TYR N N 3.547 6.242 3.894 1.00 . A A . 4 TYR N 1 1 3 1221 1 1 4 TYR O O 3.478 8.890 5.537 1.00 . A A . 4 TYR O 1 1 3 1222 1 1 4 TYR OH O 6.810 1.185 6.156 1.00 . A A . 4 TYR OH 1 1 3 1223 1 1 5 VAL C C 0.383 9.495 7.100 1.00 . A A . 5 VAL C 1 1 3 1224 1 1 5 VAL CA C 0.726 9.267 5.626 1.00 . A A . 5 VAL CA 1 1 3 1225 1 1 5 VAL CB C -0.501 9.315 4.713 1.00 . A A . 5 VAL CB 1 1 3 1226 1 1 5 VAL CG1 C -1.162 10.694 4.755 1.00 . A A . 5 VAL CG1 1 1 3 1227 1 1 5 VAL CG2 C -0.132 8.927 3.280 1.00 . A A . 5 VAL CG2 1 1 3 1228 1 1 5 VAL H H 0.799 7.197 5.412 1.00 . A A . 5 VAL H 1 1 3 1229 1 1 5 VAL HA H 1.418 10.045 5.303 1.00 . A A . 5 VAL HA 1 1 3 1230 1 1 5 VAL HB H -1.222 8.586 5.082 1.00 . A A . 5 VAL HB 1 1 3 1231 1 1 5 VAL HG11 H -0.925 11.183 5.700 1.00 . A A . 5 VAL HG11 1 1 3 1232 1 1 5 VAL HG12 H -0.791 11.301 3.929 1.00 . A A . 5 VAL HG12 1 1 3 1233 1 1 5 VAL HG13 H -2.243 10.581 4.666 1.00 . A A . 5 VAL HG13 1 1 3 1234 1 1 5 VAL HG21 H 0.539 8.068 3.297 1.00 . A A . 5 VAL HG21 1 1 3 1235 1 1 5 VAL HG22 H -1.038 8.670 2.729 1.00 . A A . 5 VAL HG22 1 1 3 1236 1 1 5 VAL HG23 H 0.363 9.766 2.792 1.00 . A A . 5 VAL HG23 1 1 3 1237 1 1 5 VAL N N 1.403 7.991 5.482 1.00 . A A . 5 VAL N 1 1 3 1238 1 1 5 VAL O O -0.420 8.761 7.675 1.00 . A A . 5 VAL O 1 1 3 1239 1 1 6 CYS C C -0.731 10.939 9.295 1.00 . A A . 6 CYS C 1 1 3 1240 1 1 6 CYS CA C 0.779 10.848 9.065 1.00 . A A . 6 CYS CA 1 1 3 1241 1 1 6 CYS CB C 1.496 12.139 9.463 1.00 . A A . 6 CYS CB 1 1 3 1242 1 1 6 CYS H H 1.659 11.108 7.195 1.00 . A A . 6 CYS H 1 1 3 1243 1 1 6 CYS HA H 1.212 10.041 9.655 1.00 . A A . 6 CYS HA 1 1 3 1244 1 1 6 CYS HB2 H 2.530 12.085 9.122 1.00 . A A . 6 CYS HB2 1 1 3 1245 1 1 6 CYS HB3 H 1.031 12.974 8.938 1.00 . A A . 6 CYS HB3 1 1 3 1246 1 1 6 CYS N N 1.008 10.515 7.669 1.00 . A A . 6 CYS N 1 1 3 1247 1 1 6 CYS O O -1.486 11.250 8.376 1.00 . A A . 6 CYS O 1 1 3 1248 1 1 6 CYS SG S 1.488 12.499 11.257 1.00 . A A . 6 CYS SG 1 1 3 1249 1 1 7 THR C C -2.806 11.896 11.815 1.00 . A A . 7 THR C 1 1 3 1250 1 1 7 THR CA C -2.533 10.708 10.893 1.00 . A A . 7 THR CA 1 1 3 1251 1 1 7 THR CB C -2.906 9.359 11.512 1.00 . A A . 7 THR CB 1 1 3 1252 1 1 7 THR CG2 C -2.616 8.185 10.576 1.00 . A A . 7 THR CG2 1 1 3 1253 1 1 7 THR H H -0.507 10.408 11.272 1.00 . A A . 7 THR H 1 1 3 1254 1 1 7 THR HA H -3.116 10.866 9.986 1.00 . A A . 7 THR HA 1 1 3 1255 1 1 7 THR HB H -3.947 9.354 11.833 1.00 . A A . 7 THR HB 1 1 3 1256 1 1 7 THR HG1 H -2.087 9.925 13.248 1.00 . A A . 7 THR HG1 1 1 3 1257 1 1 7 THR HG21 H -2.561 7.263 11.156 1.00 . A A . 7 THR HG21 1 1 3 1258 1 1 7 THR HG22 H -3.414 8.102 9.839 1.00 . A A . 7 THR HG22 1 1 3 1259 1 1 7 THR HG23 H -1.666 8.351 10.068 1.00 . A A . 7 THR HG23 1 1 3 1260 1 1 7 THR N N -1.126 10.661 10.529 1.00 . A A . 7 THR N 1 1 3 1261 1 1 7 THR O O -3.829 11.936 12.497 1.00 . A A . 7 THR O 1 1 3 1262 1 1 7 THR OG1 O -1.971 9.195 12.575 1.00 . A A . 7 THR OG1 1 1 3 1263 1 1 8 VAL C C -2.136 15.257 11.735 1.00 . A A . 8 VAL C 1 1 3 1264 1 1 8 VAL CA C -2.001 14.026 12.633 1.00 . A A . 8 VAL CA 1 1 3 1265 1 1 8 VAL CB C -0.820 14.118 13.601 1.00 . A A . 8 VAL CB 1 1 3 1266 1 1 8 VAL CG1 C -0.699 15.528 14.186 1.00 . A A . 8 VAL CG1 1 1 3 1267 1 1 8 VAL CG2 C -0.937 13.073 14.712 1.00 . A A . 8 VAL CG2 1 1 3 1268 1 1 8 VAL H H -1.045 12.799 11.248 1.00 . A A . 8 VAL H 1 1 3 1269 1 1 8 VAL HA H -2.912 13.920 13.223 1.00 . A A . 8 VAL HA 1 1 3 1270 1 1 8 VAL HB H 0.090 13.909 13.039 1.00 . A A . 8 VAL HB 1 1 3 1271 1 1 8 VAL HG11 H -0.204 16.178 13.465 1.00 . A A . 8 VAL HG11 1 1 3 1272 1 1 8 VAL HG12 H -1.693 15.917 14.404 1.00 . A A . 8 VAL HG12 1 1 3 1273 1 1 8 VAL HG13 H -0.114 15.491 15.105 1.00 . A A . 8 VAL HG13 1 1 3 1274 1 1 8 VAL HG21 H -0.566 12.115 14.348 1.00 . A A . 8 VAL HG21 1 1 3 1275 1 1 8 VAL HG22 H -0.348 13.389 15.572 1.00 . A A . 8 VAL HG22 1 1 3 1276 1 1 8 VAL HG23 H -1.982 12.969 15.005 1.00 . A A . 8 VAL HG23 1 1 3 1277 1 1 8 VAL N N -1.874 12.838 11.806 1.00 . A A . 8 VAL N 1 1 3 1278 1 1 8 VAL O O -3.070 16.041 11.887 1.00 . A A . 8 VAL O 1 1 3 1279 1 1 9 CYS C C -1.561 15.987 8.505 1.00 . A A . 9 CYS C 1 1 3 1280 1 1 9 CYS CA C -1.189 16.508 9.894 1.00 . A A . 9 CYS CA 1 1 3 1281 1 1 9 CYS CB C 0.155 17.238 9.889 1.00 . A A . 9 CYS CB 1 1 3 1282 1 1 9 CYS H H -0.431 14.744 10.701 1.00 . A A . 9 CYS H 1 1 3 1283 1 1 9 CYS HA H -1.940 17.212 10.257 1.00 . A A . 9 CYS HA 1 1 3 1284 1 1 9 CYS HB2 H 0.192 17.898 9.023 1.00 . A A . 9 CYS HB2 1 1 3 1285 1 1 9 CYS HB3 H 0.213 17.871 10.775 1.00 . A A . 9 CYS HB3 1 1 3 1286 1 1 9 CYS N N -1.189 15.387 10.818 1.00 . A A . 9 CYS N 1 1 3 1287 1 1 9 CYS O O -1.998 16.753 7.647 1.00 . A A . 9 CYS O 1 1 3 1288 1 1 9 CYS SG S 1.622 16.144 9.855 1.00 . A A . 9 CYS SG 1 1 3 1289 1 1 10 GLY C C -0.461 14.040 6.138 1.00 . A A . 10 GLY C 1 1 3 1290 1 1 10 GLY CA C -1.685 14.055 7.056 1.00 . A A . 10 GLY CA 1 1 3 1291 1 1 10 GLY H H -1.020 14.071 9.030 1.00 . A A . 10 GLY H 1 1 3 1292 1 1 10 GLY HA2 H -2.029 13.034 7.228 1.00 . A A . 10 GLY HA2 1 1 3 1293 1 1 10 GLY HA3 H -2.502 14.588 6.570 1.00 . A A . 10 GLY HA3 1 1 3 1294 1 1 10 GLY N N -1.374 14.688 8.327 1.00 . A A . 10 GLY N 1 1 3 1295 1 1 10 GLY O O -0.542 13.749 4.947 1.00 . A A . 10 GLY O 1 1 3 1296 1 1 11 TYR C C 2.000 13.227 5.022 1.00 . A A . 11 TYR C 1 1 3 1297 1 1 11 TYR CA C 1.941 14.396 5.996 1.00 . A A . 11 TYR CA 1 1 3 1298 1 1 11 TYR CB C 3.107 14.339 6.979 1.00 . A A . 11 TYR CB 1 1 3 1299 1 1 11 TYR CD1 C 4.608 15.565 5.369 1.00 . A A . 11 TYR CD1 1 1 3 1300 1 1 11 TYR CD2 C 5.545 13.764 6.695 1.00 . A A . 11 TYR CD2 1 1 3 1301 1 1 11 TYR CE1 C 5.856 15.771 4.768 1.00 . A A . 11 TYR CE1 1 1 3 1302 1 1 11 TYR CE2 C 6.792 13.970 6.095 1.00 . A A . 11 TYR CE2 1 1 3 1303 1 1 11 TYR CG C 4.452 14.562 6.332 1.00 . A A . 11 TYR CG 1 1 3 1304 1 1 11 TYR CZ C 6.948 14.973 5.131 1.00 . A A . 11 TYR CZ 1 1 3 1305 1 1 11 TYR H H 0.704 14.593 7.712 1.00 . A A . 11 TYR H 1 1 3 1306 1 1 11 TYR HA H 1.997 15.327 5.434 1.00 . A A . 11 TYR HA 1 1 3 1307 1 1 11 TYR HB2 H 2.957 15.104 7.742 1.00 . A A . 11 TYR HB2 1 1 3 1308 1 1 11 TYR HB3 H 3.110 13.361 7.461 1.00 . A A . 11 TYR HB3 1 1 3 1309 1 1 11 TYR HD1 H 3.766 16.181 5.088 1.00 . A A . 11 TYR HD1 1 1 3 1310 1 1 11 TYR HD2 H 5.425 12.990 7.439 1.00 . A A . 11 TYR HD2 1 1 3 1311 1 1 11 TYR HE1 H 5.977 16.545 4.024 1.00 . A A . 11 TYR HE1 1 1 3 1312 1 1 11 TYR HE2 H 7.634 13.356 6.375 1.00 . A A . 11 TYR HE2 1 1 3 1313 1 1 11 TYR HH H 8.478 16.077 4.633 1.00 . A A . 11 TYR HH 1 1 3 1314 1 1 11 TYR N N 0.691 14.362 6.729 1.00 . A A . 11 TYR N 1 1 3 1315 1 1 11 TYR O O 1.305 12.236 5.240 1.00 . A A . 11 TYR O 1 1 3 1316 1 1 11 TYR OH O 8.164 15.174 4.545 1.00 . A A . 11 TYR OH 1 1 3 1317 1 1 12 GLU C C 4.417 11.943 2.796 1.00 . A A . 12 GLU C 1 1 3 1318 1 1 12 GLU CA C 2.943 12.304 2.996 1.00 . A A . 12 GLU CA 1 1 3 1319 1 1 12 GLU CB C 2.294 12.709 1.671 1.00 . A A . 12 GLU CB 1 1 3 1320 1 1 12 GLU CD C 0.720 11.156 0.457 1.00 . A A . 12 GLU CD 1 1 3 1321 1 1 12 GLU CG C 0.859 12.185 1.582 1.00 . A A . 12 GLU CG 1 1 3 1322 1 1 12 GLU H H 3.375 14.170 3.815 1.00 . A A . 12 GLU H 1 1 3 1323 1 1 12 GLU HA H 2.407 11.451 3.411 1.00 . A A . 12 GLU HA 1 1 3 1324 1 1 12 GLU HB2 H 2.294 13.795 1.579 1.00 . A A . 12 GLU HB2 1 1 3 1325 1 1 12 GLU HB3 H 2.879 12.319 0.840 1.00 . A A . 12 GLU HB3 1 1 3 1326 1 1 12 GLU HE2 H -1.059 10.561 0.298 1.00 . A A . 12 GLU HE2 1 1 3 1327 1 1 12 GLU HG2 H 0.574 11.733 2.531 1.00 . A A . 12 GLU HG2 1 1 3 1328 1 1 12 GLU HG3 H 0.175 13.016 1.406 1.00 . A A . 12 GLU HG3 1 1 3 1329 1 1 12 GLU N N 2.813 13.360 3.985 1.00 . A A . 12 GLU N 1 1 3 1330 1 1 12 GLU O O 5.242 12.763 2.398 1.00 . A A . 12 GLU O 1 1 3 1331 1 1 12 GLU OE1 O 1.443 11.234 -0.546 1.00 . A A . 12 GLU OE1 1 1 3 1332 1 1 12 GLU OE2 O -0.177 10.252 0.655 1.00 . A A . 12 GLU OE2 1 1 3 1333 1 1 13 TYR C C 6.189 9.293 1.717 1.00 . A A . 13 TYR C 1 1 3 1334 1 1 13 TYR CA C 6.086 10.181 2.950 1.00 . A A . 13 TYR CA 1 1 3 1335 1 1 13 TYR CB C 6.469 9.406 4.207 1.00 . A A . 13 TYR CB 1 1 3 1336 1 1 13 TYR CD1 C 8.884 10.040 4.558 1.00 . A A . 13 TYR CD1 1 1 3 1337 1 1 13 TYR CD2 C 8.347 7.731 4.048 1.00 . A A . 13 TYR CD2 1 1 3 1338 1 1 13 TYR CE1 C 10.244 9.710 4.618 1.00 . A A . 13 TYR CE1 1 1 3 1339 1 1 13 TYR CE2 C 9.706 7.402 4.108 1.00 . A A . 13 TYR CE2 1 1 3 1340 1 1 13 TYR CG C 7.936 9.051 4.273 1.00 . A A . 13 TYR CG 1 1 3 1341 1 1 13 TYR CZ C 10.654 8.392 4.394 1.00 . A A . 13 TYR CZ 1 1 3 1342 1 1 13 TYR H H 4.017 10.044 3.408 1.00 . A A . 13 TYR H 1 1 3 1343 1 1 13 TYR HA H 6.765 11.025 2.833 1.00 . A A . 13 TYR HA 1 1 3 1344 1 1 13 TYR HB2 H 6.219 10.011 5.079 1.00 . A A . 13 TYR HB2 1 1 3 1345 1 1 13 TYR HB3 H 5.887 8.485 4.242 1.00 . A A . 13 TYR HB3 1 1 3 1346 1 1 13 TYR HD1 H 8.568 11.058 4.732 1.00 . A A . 13 TYR HD1 1 1 3 1347 1 1 13 TYR HD2 H 7.616 6.967 3.828 1.00 . A A . 13 TYR HD2 1 1 3 1348 1 1 13 TYR HE1 H 10.975 10.474 4.838 1.00 . A A . 13 TYR HE1 1 1 3 1349 1 1 13 TYR HE2 H 10.023 6.384 3.935 1.00 . A A . 13 TYR HE2 1 1 3 1350 1 1 13 TYR HH H 12.433 8.483 5.191 1.00 . A A . 13 TYR HH 1 1 3 1351 1 1 13 TYR N N 4.733 10.680 3.085 1.00 . A A . 13 TYR N 1 1 3 1352 1 1 13 TYR O O 5.167 8.773 1.272 1.00 . A A . 13 TYR O 1 1 3 1353 1 1 13 TYR OH O 11.979 8.070 4.452 1.00 . A A . 13 TYR OH 1 1 3 1354 1 1 14 ASP C C 8.830 7.419 0.239 1.00 . A A . 14 ASP C 1 1 3 1355 1 1 14 ASP CA C 7.605 8.309 0.021 1.00 . A A . 14 ASP CA 1 1 3 1356 1 1 14 ASP CB C 7.861 9.169 -1.219 1.00 . A A . 14 ASP CB 1 1 3 1357 1 1 14 ASP CG C 7.505 8.506 -2.550 1.00 . A A . 14 ASP CG 1 1 3 1358 1 1 14 ASP H H 8.224 9.563 1.566 1.00 . A A . 14 ASP H 1 1 3 1359 1 1 14 ASP HA H 6.686 7.735 -0.091 1.00 . A A . 14 ASP HA 1 1 3 1360 1 1 14 ASP HB2 H 7.289 10.092 -1.126 1.00 . A A . 14 ASP HB2 1 1 3 1361 1 1 14 ASP HB3 H 8.915 9.448 -1.238 1.00 . A A . 14 ASP HB3 1 1 3 1362 1 1 14 ASP HD2 H 8.659 9.250 -3.840 1.00 . A A . 14 ASP HD2 1 1 3 1363 1 1 14 ASP N N 7.398 9.137 1.198 1.00 . A A . 14 ASP N 1 1 3 1364 1 1 14 ASP O O 9.958 7.765 -0.102 1.00 . A A . 14 ASP O 1 1 3 1365 1 1 14 ASP OD1 O 7.075 7.343 -2.589 1.00 . A A . 14 ASP OD1 1 1 3 1366 1 1 14 ASP OD2 O 7.690 9.242 -3.593 1.00 . A A . 14 ASP OD2 1 1 3 1367 1 1 15 PRO C C 10.654 5.263 0.041 1.00 . A A . 15 PRO C 1 1 3 1368 1 1 15 PRO CA C 9.584 5.250 1.124 1.00 . A A . 15 PRO CA 1 1 3 1369 1 1 15 PRO CB C 8.830 3.922 1.132 1.00 . A A . 15 PRO CB 1 1 3 1370 1 1 15 PRO CD C 7.262 5.806 1.238 1.00 . A A . 15 PRO CD 1 1 3 1371 1 1 15 PRO CG C 7.472 4.393 1.781 1.00 . A A . 15 PRO CG 1 1 3 1372 1 1 15 PRO HA H 10.040 5.434 2.097 1.00 . A A . 15 PRO HA 1 1 3 1373 1 1 15 PRO HB2 H 8.731 3.496 0.133 1.00 . A A . 15 PRO HB2 1 1 3 1374 1 1 15 PRO HB3 H 9.338 3.226 1.800 1.00 . A A . 15 PRO HB3 1 1 3 1375 1 1 15 PRO HD2 H 6.560 5.802 0.404 1.00 . A A . 15 PRO HD2 1 1 3 1376 1 1 15 PRO HD3 H 6.902 6.457 2.034 1.00 . A A . 15 PRO HD3 1 1 3 1377 1 1 15 PRO HG2 H 6.707 3.735 1.368 1.00 . A A . 15 PRO HG2 1 1 3 1378 1 1 15 PRO HG3 H 7.463 4.363 2.870 1.00 . A A . 15 PRO HG3 1 1 3 1379 1 1 15 PRO N N 8.577 6.245 0.824 1.00 . A A . 15 PRO N 1 1 3 1380 1 1 15 PRO O O 10.383 4.803 -1.067 1.00 . A A . 15 PRO O 1 1 3 1381 1 1 16 ALA C C 14.076 6.639 0.015 1.00 . A A . 16 ALA C 1 1 3 1382 1 1 16 ALA CA C 12.915 5.844 -0.588 1.00 . A A . 16 ALA CA 1 1 3 1383 1 1 16 ALA CB C 12.408 6.453 -1.896 1.00 . A A . 16 ALA CB 1 1 3 1384 1 1 16 ALA H H 12.039 6.153 1.277 1.00 . A A . 16 ALA H 1 1 3 1385 1 1 16 ALA HA H 13.246 4.823 -0.782 1.00 . A A . 16 ALA HA 1 1 3 1386 1 1 16 ALA HB1 H 12.548 5.740 -2.707 1.00 . A A . 16 ALA HB1 1 1 3 1387 1 1 16 ALA HB2 H 11.348 6.692 -1.799 1.00 . A A . 16 ALA HB2 1 1 3 1388 1 1 16 ALA HB3 H 12.966 7.364 -2.112 1.00 . A A . 16 ALA HB3 1 1 3 1389 1 1 16 ALA N N 11.827 5.782 0.372 1.00 . A A . 16 ALA N 1 1 3 1390 1 1 16 ALA O O 14.383 7.738 -0.442 1.00 . A A . 16 ALA O 1 1 3 1391 1 1 17 PHE C C 16.726 5.650 2.348 1.00 . A A . 17 PHE C 1 1 3 1392 1 1 17 PHE CA C 15.810 6.689 1.700 1.00 . A A . 17 PHE CA 1 1 3 1393 1 1 17 PHE CB C 15.225 7.588 2.792 1.00 . A A . 17 PHE CB 1 1 3 1394 1 1 17 PHE CD1 C 15.200 9.957 1.981 1.00 . A A . 17 PHE CD1 1 1 3 1395 1 1 17 PHE CD2 C 13.155 8.790 2.058 1.00 . A A . 17 PHE CD2 1 1 3 1396 1 1 17 PHE CE1 C 14.527 11.105 1.485 1.00 . A A . 17 PHE CE1 1 1 3 1397 1 1 17 PHE CE2 C 12.481 9.938 1.562 1.00 . A A . 17 PHE CE2 1 1 3 1398 1 1 17 PHE CG C 14.499 8.824 2.257 1.00 . A A . 17 PHE CG 1 1 3 1399 1 1 17 PHE CZ C 13.181 11.071 1.285 1.00 . A A . 17 PHE CZ 1 1 3 1400 1 1 17 PHE H H 14.434 5.155 1.396 1.00 . A A . 17 PHE H 1 1 3 1401 1 1 17 PHE HA H 16.368 7.240 0.943 1.00 . A A . 17 PHE HA 1 1 3 1402 1 1 17 PHE HB2 H 14.530 7.004 3.395 1.00 . A A . 17 PHE HB2 1 1 3 1403 1 1 17 PHE HB3 H 16.029 7.910 3.453 1.00 . A A . 17 PHE HB3 1 1 3 1404 1 1 17 PHE HD1 H 16.277 9.985 2.141 1.00 . A A . 17 PHE HD1 1 1 3 1405 1 1 17 PHE HD2 H 12.594 7.883 2.278 1.00 . A A . 17 PHE HD2 1 1 3 1406 1 1 17 PHE HE1 H 15.087 12.012 1.263 1.00 . A A . 17 PHE HE1 1 1 3 1407 1 1 17 PHE HE2 H 11.403 9.911 1.402 1.00 . A A . 17 PHE HE2 1 1 3 1408 1 1 17 PHE HZ H 12.664 11.952 0.905 1.00 . A A . 17 PHE HZ 1 1 3 1409 1 1 17 PHE N N 14.690 6.050 1.030 1.00 . A A . 17 PHE N 1 1 3 1410 1 1 17 PHE O O 16.560 4.450 2.135 1.00 . A A . 17 PHE O 1 1 3 1411 1 1 18 GLU C C 18.976 5.853 5.181 1.00 . A A . 18 GLU C 1 1 3 1412 1 1 18 GLU CA C 18.619 5.278 3.809 1.00 . A A . 18 GLU CA 1 1 3 1413 1 1 18 GLU CB C 19.874 5.060 2.962 1.00 . A A . 18 GLU CB 1 1 3 1414 1 1 18 GLU CD C 22.068 3.822 3.089 1.00 . A A . 18 GLU CD 1 1 3 1415 1 1 18 GLU CG C 20.558 3.740 3.324 1.00 . A A . 18 GLU CG 1 1 3 1416 1 1 18 GLU H H 17.805 7.125 3.296 1.00 . A A . 18 GLU H 1 1 3 1417 1 1 18 GLU HA H 18.100 4.327 3.930 1.00 . A A . 18 GLU HA 1 1 3 1418 1 1 18 GLU HB2 H 19.608 5.058 1.905 1.00 . A A . 18 GLU HB2 1 1 3 1419 1 1 18 GLU HB3 H 20.568 5.887 3.115 1.00 . A A . 18 GLU HB3 1 1 3 1420 1 1 18 GLU HE2 H 23.101 2.360 2.506 1.00 . A A . 18 GLU HE2 1 1 3 1421 1 1 18 GLU HG2 H 20.361 3.500 4.368 1.00 . A A . 18 GLU HG2 1 1 3 1422 1 1 18 GLU HG3 H 20.136 2.933 2.726 1.00 . A A . 18 GLU HG3 1 1 3 1423 1 1 18 GLU N N 17.675 6.148 3.127 1.00 . A A . 18 GLU N 1 1 3 1424 1 1 18 GLU O O 20.134 6.178 5.439 1.00 . A A . 18 GLU O 1 1 3 1425 1 1 18 GLU OE1 O 22.765 4.566 3.793 1.00 . A A . 18 GLU OE1 1 1 3 1426 1 1 18 GLU OE2 O 22.511 3.077 2.134 1.00 . A A . 18 GLU OE2 1 1 3 1427 1 1 19 ASP C C 16.799 6.581 8.071 1.00 . A A . 19 ASP C 1 1 3 1428 1 1 19 ASP CA C 18.152 6.491 7.364 1.00 . A A . 19 ASP CA 1 1 3 1429 1 1 19 ASP CB C 18.756 7.898 7.318 1.00 . A A . 19 ASP CB 1 1 3 1430 1 1 19 ASP CG C 19.994 8.098 8.193 1.00 . A A . 19 ASP CG 1 1 3 1431 1 1 19 ASP H H 17.021 5.695 5.806 1.00 . A A . 19 ASP H 1 1 3 1432 1 1 19 ASP HA H 18.834 5.795 7.852 1.00 . A A . 19 ASP HA 1 1 3 1433 1 1 19 ASP HB2 H 19.016 8.131 6.286 1.00 . A A . 19 ASP HB2 1 1 3 1434 1 1 19 ASP HB3 H 17.993 8.613 7.625 1.00 . A A . 19 ASP HB3 1 1 3 1435 1 1 19 ASP HD2 H 20.786 9.703 8.780 1.00 . A A . 19 ASP HD2 1 1 3 1436 1 1 19 ASP N N 17.959 5.962 6.025 1.00 . A A . 19 ASP N 1 1 3 1437 1 1 19 ASP O O 16.078 7.566 7.919 1.00 . A A . 19 ASP O 1 1 3 1438 1 1 19 ASP OD1 O 20.935 7.290 8.163 1.00 . A A . 19 ASP OD1 1 1 3 1439 1 1 19 ASP OD2 O 19.969 9.149 8.941 1.00 . A A . 19 ASP OD2 1 1 3 1440 1 1 20 LEU C C 15.471 4.809 10.914 1.00 . A A . 20 LEU C 1 1 3 1441 1 1 20 LEU CA C 15.240 5.486 9.562 1.00 . A A . 20 LEU CA 1 1 3 1442 1 1 20 LEU CB C 14.154 4.818 8.717 1.00 . A A . 20 LEU CB 1 1 3 1443 1 1 20 LEU CD1 C 11.762 4.803 7.922 1.00 . A A . 20 LEU CD1 1 1 3 1444 1 1 20 LEU CD2 C 12.283 4.617 10.396 1.00 . A A . 20 LEU CD2 1 1 3 1445 1 1 20 LEU CG C 12.712 5.205 9.051 1.00 . A A . 20 LEU CG 1 1 3 1446 1 1 20 LEU H H 17.086 4.742 8.949 1.00 . A A . 20 LEU H 1 1 3 1447 1 1 20 LEU HA H 14.923 6.514 9.740 1.00 . A A . 20 LEU HA 1 1 3 1448 1 1 20 LEU HB2 H 14.339 5.054 7.670 1.00 . A A . 20 LEU HB2 1 1 3 1449 1 1 20 LEU HB3 H 14.253 3.737 8.823 1.00 . A A . 20 LEU HB3 1 1 3 1450 1 1 20 LEU HD11 H 11.258 5.690 7.537 1.00 . A A . 20 LEU HD11 1 1 3 1451 1 1 20 LEU HD12 H 12.329 4.332 7.119 1.00 . A A . 20 LEU HD12 1 1 3 1452 1 1 20 LEU HD13 H 11.020 4.100 8.303 1.00 . A A . 20 LEU HD13 1 1 3 1453 1 1 20 LEU HD21 H 12.717 5.205 11.205 1.00 . A A . 20 LEU HD21 1 1 3 1454 1 1 20 LEU HD22 H 11.196 4.640 10.474 1.00 . A A . 20 LEU HD22 1 1 3 1455 1 1 20 LEU HD23 H 12.631 3.586 10.471 1.00 . A A . 20 LEU HD23 1 1 3 1456 1 1 20 LEU HG H 12.662 6.290 9.143 1.00 . A A . 20 LEU HG 1 1 3 1457 1 1 20 LEU N N 16.494 5.538 8.830 1.00 . A A . 20 LEU N 1 1 3 1458 1 1 20 LEU O O 15.234 3.617 11.097 1.00 . A A . 20 LEU O 1 1 3 1459 1 1 21 PRO C C 14.938 4.827 13.937 1.00 . A A . 21 PRO C 1 1 3 1460 1 1 21 PRO CA C 16.235 5.180 13.224 1.00 . A A . 21 PRO CA 1 1 3 1461 1 1 21 PRO CB C 16.911 6.382 13.880 1.00 . A A . 21 PRO CB 1 1 3 1462 1 1 21 PRO CD C 16.235 7.015 11.693 1.00 . A A . 21 PRO CD 1 1 3 1463 1 1 21 PRO CG C 17.324 7.327 12.718 1.00 . A A . 21 PRO CG 1 1 3 1464 1 1 21 PRO HA H 16.906 4.320 13.227 1.00 . A A . 21 PRO HA 1 1 3 1465 1 1 21 PRO HB2 H 16.251 6.896 14.580 1.00 . A A . 21 PRO HB2 1 1 3 1466 1 1 21 PRO HB3 H 17.823 6.053 14.379 1.00 . A A . 21 PRO HB3 1 1 3 1467 1 1 21 PRO HD2 H 15.353 7.632 11.865 1.00 . A A . 21 PRO HD2 1 1 3 1468 1 1 21 PRO HD3 H 16.621 7.174 10.686 1.00 . A A . 21 PRO HD3 1 1 3 1469 1 1 21 PRO HG2 H 17.317 8.395 12.936 1.00 . A A . 21 PRO HG2 1 1 3 1470 1 1 21 PRO HG3 H 18.311 7.007 12.385 1.00 . A A . 21 PRO HG3 1 1 3 1471 1 1 21 PRO N N 15.946 5.609 11.873 1.00 . A A . 21 PRO N 1 1 3 1472 1 1 21 PRO O O 13.885 4.858 13.302 1.00 . A A . 21 PRO O 1 1 3 1473 1 1 22 ASP C C 13.386 5.364 16.786 1.00 . A A . 22 ASP C 1 1 3 1474 1 1 22 ASP CA C 13.855 4.145 15.989 1.00 . A A . 22 ASP CA 1 1 3 1475 1 1 22 ASP CB C 14.165 3.022 16.981 1.00 . A A . 22 ASP CB 1 1 3 1476 1 1 22 ASP CG C 15.540 3.107 17.645 1.00 . A A . 22 ASP CG 1 1 3 1477 1 1 22 ASP H H 15.894 4.478 15.725 1.00 . A A . 22 ASP H 1 1 3 1478 1 1 22 ASP HA H 13.120 3.819 15.253 1.00 . A A . 22 ASP HA 1 1 3 1479 1 1 22 ASP HB2 H 13.401 3.026 17.760 1.00 . A A . 22 ASP HB2 1 1 3 1480 1 1 22 ASP HB3 H 14.086 2.068 16.462 1.00 . A A . 22 ASP HB3 1 1 3 1481 1 1 22 ASP HD2 H 16.111 1.679 16.558 1.00 . A A . 22 ASP HD2 1 1 3 1482 1 1 22 ASP N N 15.034 4.501 15.217 1.00 . A A . 22 ASP N 1 1 3 1483 1 1 22 ASP O O 13.257 5.300 18.007 1.00 . A A . 22 ASP O 1 1 3 1484 1 1 22 ASP OD1 O 15.703 3.740 18.699 1.00 . A A . 22 ASP OD1 1 1 3 1485 1 1 22 ASP OD2 O 16.483 2.480 17.027 1.00 . A A . 22 ASP OD2 1 1 3 1486 1 1 23 ASP C C 12.536 8.761 15.615 1.00 . A A . 23 ASP C 1 1 3 1487 1 1 23 ASP CA C 12.690 7.679 16.685 1.00 . A A . 23 ASP CA 1 1 3 1488 1 1 23 ASP CB C 13.702 8.176 17.720 1.00 . A A . 23 ASP CB 1 1 3 1489 1 1 23 ASP CG C 13.110 9.023 18.848 1.00 . A A . 23 ASP CG 1 1 3 1490 1 1 23 ASP H H 13.249 6.491 15.068 1.00 . A A . 23 ASP H 1 1 3 1491 1 1 23 ASP HA H 11.743 7.426 17.163 1.00 . A A . 23 ASP HA 1 1 3 1492 1 1 23 ASP HB2 H 14.204 7.315 18.157 1.00 . A A . 23 ASP HB2 1 1 3 1493 1 1 23 ASP HB3 H 14.464 8.763 17.206 1.00 . A A . 23 ASP HB3 1 1 3 1494 1 1 23 ASP HD2 H 13.692 7.742 20.099 1.00 . A A . 23 ASP HD2 1 1 3 1495 1 1 23 ASP N N 13.143 6.447 16.061 1.00 . A A . 23 ASP N 1 1 3 1496 1 1 23 ASP O O 13.227 9.778 15.651 1.00 . A A . 23 ASP O 1 1 3 1497 1 1 23 ASP OD1 O 12.289 9.921 18.609 1.00 . A A . 23 ASP OD1 1 1 3 1498 1 1 23 ASP OD2 O 13.531 8.727 20.030 1.00 . A A . 23 ASP OD2 1 1 3 1499 1 1 24 TRP C C 10.154 10.288 13.992 1.00 . A A . 24 TRP C 1 1 3 1500 1 1 24 TRP CA C 11.371 9.445 13.609 1.00 . A A . 24 TRP CA 1 1 3 1501 1 1 24 TRP CB C 11.198 8.716 12.275 1.00 . A A . 24 TRP CB 1 1 3 1502 1 1 24 TRP CD1 C 12.407 10.404 10.742 1.00 . A A . 24 TRP CD1 1 1 3 1503 1 1 24 TRP CD2 C 10.428 9.780 9.967 1.00 . A A . 24 TRP CD2 1 1 3 1504 1 1 24 TRP CE2 C 10.963 10.674 9.062 1.00 . A A . 24 TRP CE2 1 1 3 1505 1 1 24 TRP CE3 C 9.167 9.195 9.760 1.00 . A A . 24 TRP CE3 1 1 3 1506 1 1 24 TRP CG C 11.369 9.613 11.048 1.00 . A A . 24 TRP CG 1 1 3 1507 1 1 24 TRP CH2 C 9.047 10.493 7.661 1.00 . A A . 24 TRP CH2 1 1 3 1508 1 1 24 TRP CZ2 C 10.305 11.063 7.888 1.00 . A A . 24 TRP CZ2 1 1 3 1509 1 1 24 TRP CZ3 C 8.522 9.594 8.583 1.00 . A A . 24 TRP CZ3 1 1 3 1510 1 1 24 TRP H H 11.067 7.676 14.666 1.00 . A A . 24 TRP H 1 1 3 1511 1 1 24 TRP HA H 12.250 10.083 13.509 1.00 . A A . 24 TRP HA 1 1 3 1512 1 1 24 TRP HB2 H 11.920 7.902 12.221 1.00 . A A . 24 TRP HB2 1 1 3 1513 1 1 24 TRP HB3 H 10.206 8.264 12.247 1.00 . A A . 24 TRP HB3 1 1 3 1514 1 1 24 TRP HD1 H 13.299 10.510 11.360 1.00 . A A . 24 TRP HD1 1 1 3 1515 1 1 24 TRP HE1 H 12.892 11.766 9.075 1.00 . A A . 24 TRP HE1 1 1 3 1516 1 1 24 TRP HE3 H 8.723 8.486 10.459 1.00 . A A . 24 TRP HE3 1 1 3 1517 1 1 24 TRP HH2 H 8.482 10.753 6.767 1.00 . A A . 24 TRP HH2 1 1 3 1518 1 1 24 TRP HZ2 H 10.749 11.772 7.189 1.00 . A A . 24 TRP HZ2 1 1 3 1519 1 1 24 TRP HZ3 H 7.541 9.169 8.373 1.00 . A A . 24 TRP HZ3 1 1 3 1520 1 1 24 TRP N N 11.624 8.505 14.687 1.00 . A A . 24 TRP N 1 1 3 1521 1 1 24 TRP NE1 N 12.205 11.065 9.548 1.00 . A A . 24 TRP NE1 1 1 3 1522 1 1 24 TRP O O 9.181 9.768 14.538 1.00 . A A . 24 TRP O 1 1 3 1523 1 1 25 ALA C C 8.775 13.258 12.730 1.00 . A A . 25 ALA C 1 1 3 1524 1 1 25 ALA CA C 9.164 12.495 13.999 1.00 . A A . 25 ALA CA 1 1 3 1525 1 1 25 ALA CB C 9.593 13.428 15.133 1.00 . A A . 25 ALA CB 1 1 3 1526 1 1 25 ALA H H 11.041 11.990 13.248 1.00 . A A . 25 ALA H 1 1 3 1527 1 1 25 ALA HA H 8.311 11.904 14.333 1.00 . A A . 25 ALA HA 1 1 3 1528 1 1 25 ALA HB1 H 9.393 14.461 14.849 1.00 . A A . 25 ALA HB1 1 1 3 1529 1 1 25 ALA HB2 H 9.032 13.185 16.035 1.00 . A A . 25 ALA HB2 1 1 3 1530 1 1 25 ALA HB3 H 10.659 13.304 15.322 1.00 . A A . 25 ALA HB3 1 1 3 1531 1 1 25 ALA N N 10.246 11.576 13.692 1.00 . A A . 25 ALA N 1 1 3 1532 1 1 25 ALA O O 9.640 13.670 11.960 1.00 . A A . 25 ALA O 1 1 3 1533 1 1 26 CYS C C 7.656 15.488 11.310 1.00 . A A . 26 CYS C 1 1 3 1534 1 1 26 CYS CA C 6.957 14.130 11.394 1.00 . A A . 26 CYS CA 1 1 3 1535 1 1 26 CYS CB C 5.435 14.274 11.448 1.00 . A A . 26 CYS CB 1 1 3 1536 1 1 26 CYS H H 6.775 13.085 13.187 1.00 . A A . 26 CYS H 1 1 3 1537 1 1 26 CYS HA H 7.195 13.518 10.524 1.00 . A A . 26 CYS HA 1 1 3 1538 1 1 26 CYS HB2 H 5.024 13.430 12.004 1.00 . A A . 26 CYS HB2 1 1 3 1539 1 1 26 CYS HB3 H 5.189 15.176 12.009 1.00 . A A . 26 CYS HB3 1 1 3 1540 1 1 26 CYS N N 7.472 13.423 12.555 1.00 . A A . 26 CYS N 1 1 3 1541 1 1 26 CYS O O 7.779 16.220 12.289 1.00 . A A . 26 CYS O 1 1 3 1542 1 1 26 CYS SG S 4.613 14.355 9.815 1.00 . A A . 26 CYS SG 1 1 3 1543 1 1 27 PRO C C 7.815 18.201 9.801 1.00 . A A . 27 PRO C 1 1 3 1544 1 1 27 PRO CA C 8.806 17.046 9.792 1.00 . A A . 27 PRO CA 1 1 3 1545 1 1 27 PRO CB C 9.386 16.833 8.394 1.00 . A A . 27 PRO CB 1 1 3 1546 1 1 27 PRO CD C 7.989 14.974 8.926 1.00 . A A . 27 PRO CD 1 1 3 1547 1 1 27 PRO CG C 8.306 15.893 7.749 1.00 . A A . 27 PRO CG 1 1 3 1548 1 1 27 PRO HA H 9.605 17.238 10.509 1.00 . A A . 27 PRO HA 1 1 3 1549 1 1 27 PRO HB2 H 9.498 17.769 7.846 1.00 . A A . 27 PRO HB2 1 1 3 1550 1 1 27 PRO HB3 H 10.342 16.318 8.479 1.00 . A A . 27 PRO HB3 1 1 3 1551 1 1 27 PRO HD2 H 6.984 14.560 8.837 1.00 . A A . 27 PRO HD2 1 1 3 1552 1 1 27 PRO HD3 H 8.726 14.173 8.978 1.00 . A A . 27 PRO HD3 1 1 3 1553 1 1 27 PRO HG2 H 7.378 16.310 7.358 1.00 . A A . 27 PRO HG2 1 1 3 1554 1 1 27 PRO HG3 H 8.861 15.383 6.963 1.00 . A A . 27 PRO HG3 1 1 3 1555 1 1 27 PRO N N 8.116 15.812 10.099 1.00 . A A . 27 PRO N 1 1 3 1556 1 1 27 PRO O O 8.229 19.341 9.595 1.00 . A A . 27 PRO O 1 1 3 1557 1 1 28 VAL C C 5.041 19.118 11.501 1.00 . A A . 28 VAL C 1 1 3 1558 1 1 28 VAL CA C 5.521 18.922 10.062 1.00 . A A . 28 VAL CA 1 1 3 1559 1 1 28 VAL CB C 4.389 18.558 9.098 1.00 . A A . 28 VAL CB 1 1 3 1560 1 1 28 VAL CG1 C 3.295 19.629 9.109 1.00 . A A . 28 VAL CG1 1 1 3 1561 1 1 28 VAL CG2 C 4.924 18.336 7.683 1.00 . A A . 28 VAL CG2 1 1 3 1562 1 1 28 VAL H H 6.219 16.963 10.199 1.00 . A A . 28 VAL H 1 1 3 1563 1 1 28 VAL HA H 5.976 19.850 9.714 1.00 . A A . 28 VAL HA 1 1 3 1564 1 1 28 VAL HB H 3.946 17.623 9.440 1.00 . A A . 28 VAL HB 1 1 3 1565 1 1 28 VAL HG11 H 3.351 20.195 10.038 1.00 . A A . 28 VAL HG11 1 1 3 1566 1 1 28 VAL HG12 H 3.437 20.302 8.264 1.00 . A A . 28 VAL HG12 1 1 3 1567 1 1 28 VAL HG13 H 2.319 19.150 9.034 1.00 . A A . 28 VAL HG13 1 1 3 1568 1 1 28 VAL HG21 H 4.501 19.084 7.013 1.00 . A A . 28 VAL HG21 1 1 3 1569 1 1 28 VAL HG22 H 6.010 18.425 7.687 1.00 . A A . 28 VAL HG22 1 1 3 1570 1 1 28 VAL HG23 H 4.642 17.340 7.340 1.00 . A A . 28 VAL HG23 1 1 3 1571 1 1 28 VAL N N 6.547 17.893 10.033 1.00 . A A . 28 VAL N 1 1 3 1572 1 1 28 VAL O O 5.604 19.922 12.243 1.00 . A A . 28 VAL O 1 1 3 1573 1 1 29 CYS C C 4.588 18.327 14.200 1.00 . A A . 29 CYS C 1 1 3 1574 1 1 29 CYS CA C 3.445 18.449 13.192 1.00 . A A . 29 CYS CA 1 1 3 1575 1 1 29 CYS CB C 2.367 17.388 13.417 1.00 . A A . 29 CYS CB 1 1 3 1576 1 1 29 CYS H H 3.555 17.717 11.245 1.00 . A A . 29 CYS H 1 1 3 1577 1 1 29 CYS HA H 2.962 19.424 13.269 1.00 . A A . 29 CYS HA 1 1 3 1578 1 1 29 CYS HB2 H 2.027 17.450 14.451 1.00 . A A . 29 CYS HB2 1 1 3 1579 1 1 29 CYS HB3 H 1.510 17.619 12.785 1.00 . A A . 29 CYS HB3 1 1 3 1580 1 1 29 CYS N N 4.007 18.368 11.853 1.00 . A A . 29 CYS N 1 1 3 1581 1 1 29 CYS O O 4.700 19.138 15.118 1.00 . A A . 29 CYS O 1 1 3 1582 1 1 29 CYS SG S 2.899 15.670 13.077 1.00 . A A . 29 CYS SG 1 1 3 1583 1 1 30 GLY C C 6.289 15.847 15.770 1.00 . A A . 30 GLY C 1 1 3 1584 1 1 30 GLY CA C 6.537 17.065 14.878 1.00 . A A . 30 GLY CA 1 1 3 1585 1 1 30 GLY H H 5.308 16.649 13.248 1.00 . A A . 30 GLY H 1 1 3 1586 1 1 30 GLY HA2 H 7.438 16.909 14.285 1.00 . A A . 30 GLY HA2 1 1 3 1587 1 1 30 GLY HA3 H 6.713 17.945 15.499 1.00 . A A . 30 GLY HA3 1 1 3 1588 1 1 30 GLY N N 5.406 17.305 13.997 1.00 . A A . 30 GLY N 1 1 3 1589 1 1 30 GLY O O 7.206 15.357 16.427 1.00 . A A . 30 GLY O 1 1 3 1590 1 1 31 ALA C C 5.532 13.045 16.174 1.00 . A A . 31 ALA C 1 1 3 1591 1 1 31 ALA CA C 4.663 14.242 16.565 1.00 . A A . 31 ALA CA 1 1 3 1592 1 1 31 ALA CB C 3.170 13.964 16.381 1.00 . A A . 31 ALA CB 1 1 3 1593 1 1 31 ALA H H 4.304 15.799 15.227 1.00 . A A . 31 ALA H 1 1 3 1594 1 1 31 ALA HA H 4.848 14.489 17.610 1.00 . A A . 31 ALA HA 1 1 3 1595 1 1 31 ALA HB1 H 2.698 14.817 15.895 1.00 . A A . 31 ALA HB1 1 1 3 1596 1 1 31 ALA HB2 H 3.039 13.076 15.762 1.00 . A A . 31 ALA HB2 1 1 3 1597 1 1 31 ALA HB3 H 2.709 13.800 17.354 1.00 . A A . 31 ALA HB3 1 1 3 1598 1 1 31 ALA N N 5.044 15.394 15.765 1.00 . A A . 31 ALA N 1 1 3 1599 1 1 31 ALA O O 6.189 13.065 15.134 1.00 . A A . 31 ALA O 1 1 3 1600 1 1 32 SER C C 5.712 10.071 15.587 1.00 . A A . 32 SER C 1 1 3 1601 1 1 32 SER CA C 6.285 10.829 16.785 1.00 . A A . 32 SER CA 1 1 3 1602 1 1 32 SER CB C 6.308 9.930 18.023 1.00 . A A . 32 SER CB 1 1 3 1603 1 1 32 SER H H 4.970 12.026 17.872 1.00 . A A . 32 SER H 1 1 3 1604 1 1 32 SER HA H 7.295 11.178 16.570 1.00 . A A . 32 SER HA 1 1 3 1605 1 1 32 SER HB2 H 6.677 8.942 17.745 1.00 . A A . 32 SER HB2 1 1 3 1606 1 1 32 SER HB3 H 7.006 10.337 18.754 1.00 . A A . 32 SER HB3 1 1 3 1607 1 1 32 SER HG H 4.311 9.870 17.913 1.00 . A A . 32 SER HG 1 1 3 1608 1 1 32 SER N N 5.508 12.033 17.027 1.00 . A A . 32 SER N 1 1 3 1609 1 1 32 SER O O 4.635 10.401 15.094 1.00 . A A . 32 SER O 1 1 3 1610 1 1 32 SER OG O 5.019 9.805 18.616 1.00 . A A . 32 SER OG 1 1 3 1611 1 1 33 LYS C C 5.212 7.072 14.526 1.00 . A A . 33 LYS C 1 1 3 1612 1 1 33 LYS CA C 6.039 8.256 14.021 1.00 . A A . 33 LYS CA 1 1 3 1613 1 1 33 LYS CB C 7.248 7.847 13.177 1.00 . A A . 33 LYS CB 1 1 3 1614 1 1 33 LYS CD C 8.293 5.567 13.446 1.00 . A A . 33 LYS CD 1 1 3 1615 1 1 33 LYS CE C 9.096 5.518 12.144 1.00 . A A . 33 LYS CE 1 1 3 1616 1 1 33 LYS CG C 8.222 6.994 13.992 1.00 . A A . 33 LYS CG 1 1 3 1617 1 1 33 LYS H H 7.334 8.802 15.557 1.00 . A A . 33 LYS H 1 1 3 1618 1 1 33 LYS HA H 5.403 8.880 13.391 1.00 . A A . 33 LYS HA 1 1 3 1619 1 1 33 LYS HB2 H 6.914 7.287 12.303 1.00 . A A . 33 LYS HB2 1 1 3 1620 1 1 33 LYS HB3 H 7.757 8.737 12.809 1.00 . A A . 33 LYS HB3 1 1 3 1621 1 1 33 LYS HD2 H 8.752 4.912 14.186 1.00 . A A . 33 LYS HD2 1 1 3 1622 1 1 33 LYS HD3 H 7.285 5.191 13.269 1.00 . A A . 33 LYS HD3 1 1 3 1623 1 1 33 LYS HE2 H 9.855 6.300 12.149 1.00 . A A . 33 LYS HE2 1 1 3 1624 1 1 33 LYS HE3 H 9.621 4.566 12.070 1.00 . A A . 33 LYS HE3 1 1 3 1625 1 1 33 LYS HG2 H 9.215 7.446 13.968 1.00 . A A . 33 LYS HG2 1 1 3 1626 1 1 33 LYS HG3 H 7.907 6.973 15.036 1.00 . A A . 33 LYS HG3 1 1 3 1627 1 1 33 LYS HZ1 H 8.396 5.013 10.248 1.00 . A A . 33 LYS HZ1 1 1 3 1628 1 1 33 LYS HZ2 H 7.227 5.584 11.226 1.00 . A A . 33 LYS HZ2 1 1 3 1629 1 1 33 LYS N N 6.459 9.066 15.152 1.00 . A A . 33 LYS N 1 1 3 1630 1 1 33 LYS NZ N 8.204 5.691 10.977 1.00 . A A . 33 LYS NZ 1 1 3 1631 1 1 33 LYS O O 5.355 5.955 14.031 1.00 . A A . 33 LYS O 1 1 3 1632 1 1 34 ASP C C 2.141 6.373 15.407 1.00 . A A . 34 ASP C 1 1 3 1633 1 1 34 ASP CA C 3.514 6.330 16.080 1.00 . A A . 34 ASP CA 1 1 3 1634 1 1 34 ASP CB C 3.313 6.559 17.580 1.00 . A A . 34 ASP CB 1 1 3 1635 1 1 34 ASP CG C 2.742 7.928 17.954 1.00 . A A . 34 ASP CG 1 1 3 1636 1 1 34 ASP H H 4.254 8.269 15.899 1.00 . A A . 34 ASP H 1 1 3 1637 1 1 34 ASP HA H 4.037 5.391 15.899 1.00 . A A . 34 ASP HA 1 1 3 1638 1 1 34 ASP HB2 H 2.647 5.787 17.963 1.00 . A A . 34 ASP HB2 1 1 3 1639 1 1 34 ASP HB3 H 4.272 6.432 18.082 1.00 . A A . 34 ASP HB3 1 1 3 1640 1 1 34 ASP HD2 H 1.505 8.751 19.111 1.00 . A A . 34 ASP HD2 1 1 3 1641 1 1 34 ASP N N 4.364 7.358 15.502 1.00 . A A . 34 ASP N 1 1 3 1642 1 1 34 ASP O O 1.635 5.348 14.954 1.00 . A A . 34 ASP O 1 1 3 1643 1 1 34 ASP OD1 O 2.874 8.903 17.198 1.00 . A A . 34 ASP OD1 1 1 3 1644 1 1 34 ASP OD2 O 2.133 7.972 19.089 1.00 . A A . 34 ASP OD2 1 1 3 1645 1 1 35 ALA C C 0.343 7.373 13.275 1.00 . A A . 35 ALA C 1 1 3 1646 1 1 35 ALA CA C 0.272 7.763 14.753 1.00 . A A . 35 ALA CA 1 1 3 1647 1 1 35 ALA CB C -0.179 9.211 14.953 1.00 . A A . 35 ALA CB 1 1 3 1648 1 1 35 ALA H H 1.995 8.401 15.733 1.00 . A A . 35 ALA H 1 1 3 1649 1 1 35 ALA HA H -0.431 7.103 15.261 1.00 . A A . 35 ALA HA 1 1 3 1650 1 1 35 ALA HB1 H 0.529 9.725 15.604 1.00 . A A . 35 ALA HB1 1 1 3 1651 1 1 35 ALA HB2 H -0.220 9.716 13.989 1.00 . A A . 35 ALA HB2 1 1 3 1652 1 1 35 ALA HB3 H -1.168 9.223 15.412 1.00 . A A . 35 ALA HB3 1 1 3 1653 1 1 35 ALA N N 1.576 7.572 15.363 1.00 . A A . 35 ALA N 1 1 3 1654 1 1 35 ALA O O -0.688 7.190 12.628 1.00 . A A . 35 ALA O 1 1 3 1655 1 1 36 PHE C C 1.279 5.481 11.112 1.00 . A A . 36 PHE C 1 1 3 1656 1 1 36 PHE CA C 1.787 6.895 11.394 1.00 . A A . 36 PHE CA 1 1 3 1657 1 1 36 PHE CB C 3.296 6.940 11.152 1.00 . A A . 36 PHE CB 1 1 3 1658 1 1 36 PHE CD1 C 3.762 9.342 11.688 1.00 . A A . 36 PHE CD1 1 1 3 1659 1 1 36 PHE CD2 C 4.361 8.546 9.552 1.00 . A A . 36 PHE CD2 1 1 3 1660 1 1 36 PHE CE1 C 4.255 10.630 11.346 1.00 . A A . 36 PHE CE1 1 1 3 1661 1 1 36 PHE CE2 C 4.852 9.834 9.211 1.00 . A A . 36 PHE CE2 1 1 3 1662 1 1 36 PHE CG C 3.826 8.327 10.784 1.00 . A A . 36 PHE CG 1 1 3 1663 1 1 36 PHE CZ C 4.789 10.848 10.115 1.00 . A A . 36 PHE CZ 1 1 3 1664 1 1 36 PHE H H 2.400 7.410 13.318 1.00 . A A . 36 PHE H 1 1 3 1665 1 1 36 PHE HA H 1.232 7.607 10.782 1.00 . A A . 36 PHE HA 1 1 3 1666 1 1 36 PHE HB2 H 3.809 6.594 12.050 1.00 . A A . 36 PHE HB2 1 1 3 1667 1 1 36 PHE HB3 H 3.547 6.243 10.353 1.00 . A A . 36 PHE HB3 1 1 3 1668 1 1 36 PHE HD1 H 3.334 9.167 12.674 1.00 . A A . 36 PHE HD1 1 1 3 1669 1 1 36 PHE HD2 H 4.411 7.734 8.829 1.00 . A A . 36 PHE HD2 1 1 3 1670 1 1 36 PHE HE1 H 4.203 11.443 12.070 1.00 . A A . 36 PHE HE1 1 1 3 1671 1 1 36 PHE HE2 H 5.281 10.010 8.224 1.00 . A A . 36 PHE HE2 1 1 3 1672 1 1 36 PHE HZ H 5.166 11.836 9.852 1.00 . A A . 36 PHE HZ 1 1 3 1673 1 1 36 PHE N N 1.568 7.259 12.784 1.00 . A A . 36 PHE N 1 1 3 1674 1 1 36 PHE O O 1.525 4.561 11.892 1.00 . A A . 36 PHE O 1 1 3 1675 1 1 37 GLU C C 0.523 3.685 8.199 1.00 . A A . 37 GLU C 1 1 3 1676 1 1 37 GLU CA C 0.034 4.061 9.599 1.00 . A A . 37 GLU CA 1 1 3 1677 1 1 37 GLU CB C -1.495 4.069 9.663 1.00 . A A . 37 GLU CB 1 1 3 1678 1 1 37 GLU CD C -3.307 2.854 10.926 1.00 . A A . 37 GLU CD 1 1 3 1679 1 1 37 GLU CG C -2.033 2.703 10.092 1.00 . A A . 37 GLU CG 1 1 3 1680 1 1 37 GLU H H 0.382 6.102 9.365 1.00 . A A . 37 GLU H 1 1 3 1681 1 1 37 GLU HA H 0.418 3.348 10.329 1.00 . A A . 37 GLU HA 1 1 3 1682 1 1 37 GLU HB2 H -1.829 4.833 10.365 1.00 . A A . 37 GLU HB2 1 1 3 1683 1 1 37 GLU HB3 H -1.902 4.334 8.687 1.00 . A A . 37 GLU HB3 1 1 3 1684 1 1 37 GLU HE2 H -3.665 1.186 11.725 1.00 . A A . 37 GLU HE2 1 1 3 1685 1 1 37 GLU HG2 H -2.240 2.097 9.210 1.00 . A A . 37 GLU HG2 1 1 3 1686 1 1 37 GLU HG3 H -1.275 2.175 10.671 1.00 . A A . 37 GLU HG3 1 1 3 1687 1 1 37 GLU N N 0.579 5.349 9.994 1.00 . A A . 37 GLU N 1 1 3 1688 1 1 37 GLU O O 0.848 4.559 7.396 1.00 . A A . 37 GLU O 1 1 3 1689 1 1 37 GLU OE1 O -4.190 3.649 10.572 1.00 . A A . 37 GLU OE1 1 1 3 1690 1 1 37 GLU OE2 O -3.362 2.105 11.976 1.00 . A A . 37 GLU OE2 1 1 3 1691 1 1 38 LYS C C -0.213 1.656 5.760 1.00 . A A . 38 LYS C 1 1 3 1692 1 1 38 LYS CA C 1.003 1.882 6.660 1.00 . A A . 38 LYS CA 1 1 3 1693 1 1 38 LYS CB C 1.874 0.638 6.841 1.00 . A A . 38 LYS CB 1 1 3 1694 1 1 38 LYS CD C 4.041 -0.291 5.944 1.00 . A A . 38 LYS CD 1 1 3 1695 1 1 38 LYS CE C 4.063 -1.761 5.522 1.00 . A A . 38 LYS CE 1 1 3 1696 1 1 38 LYS CG C 2.706 0.363 5.586 1.00 . A A . 38 LYS CG 1 1 3 1697 1 1 38 LYS H H 0.293 1.681 8.608 1.00 . A A . 38 LYS H 1 1 3 1698 1 1 38 LYS HA H 1.630 2.651 6.208 1.00 . A A . 38 LYS HA 1 1 3 1699 1 1 38 LYS HB2 H 2.535 0.773 7.696 1.00 . A A . 38 LYS HB2 1 1 3 1700 1 1 38 LYS HB3 H 1.244 -0.224 7.059 1.00 . A A . 38 LYS HB3 1 1 3 1701 1 1 38 LYS HD2 H 4.855 0.243 5.455 1.00 . A A . 38 LYS HD2 1 1 3 1702 1 1 38 LYS HD3 H 4.211 -0.215 7.018 1.00 . A A . 38 LYS HD3 1 1 3 1703 1 1 38 LYS HE2 H 3.252 -2.299 6.015 1.00 . A A . 38 LYS HE2 1 1 3 1704 1 1 38 LYS HE3 H 3.891 -1.840 4.448 1.00 . A A . 38 LYS HE3 1 1 3 1705 1 1 38 LYS HG2 H 2.148 -0.286 4.911 1.00 . A A . 38 LYS HG2 1 1 3 1706 1 1 38 LYS HG3 H 2.885 1.297 5.052 1.00 . A A . 38 LYS HG3 1 1 3 1707 1 1 38 LYS HZ1 H 5.758 -1.982 6.712 1.00 . A A . 38 LYS HZ1 1 1 3 1708 1 1 38 LYS HZ2 H 5.273 -3.379 6.032 1.00 . A A . 38 LYS HZ2 1 1 3 1709 1 1 38 LYS N N 0.559 2.385 7.949 1.00 . A A . 38 LYS N 1 1 3 1710 1 1 38 LYS NZ N 5.360 -2.382 5.871 1.00 . A A . 38 LYS NZ 1 1 3 1711 1 1 38 LYS O O -0.956 0.692 5.945 1.00 . A A . 38 LYS O 1 1 3 1712 1 1 39 GLN C C -1.105 3.074 2.524 1.00 . A A . 39 GLN C 1 1 3 1713 1 1 39 GLN CA C -1.492 2.470 3.875 1.00 . A A . 39 GLN CA 1 1 3 1714 1 1 39 GLN CB C -2.737 3.153 4.445 1.00 . A A . 39 GLN CB 1 1 3 1715 1 1 39 GLN CD C -4.485 3.185 2.626 1.00 . A A . 39 GLN CD 1 1 3 1716 1 1 39 GLN CG C -4.014 2.499 3.910 1.00 . A A . 39 GLN CG 1 1 3 1717 1 1 39 GLN H H 0.230 3.340 4.661 1.00 . A A . 39 GLN H 1 1 3 1718 1 1 39 GLN HA H -1.690 1.404 3.761 1.00 . A A . 39 GLN HA 1 1 3 1719 1 1 39 GLN HB2 H -2.722 3.095 5.533 1.00 . A A . 39 GLN HB2 1 1 3 1720 1 1 39 GLN HB3 H -2.729 4.210 4.181 1.00 . A A . 39 GLN HB3 1 1 3 1721 1 1 39 GLN HE21 H -6.371 3.164 3.363 1.00 . A A . 39 GLN HE21 1 1 3 1722 1 1 39 GLN HE22 H -6.197 3.874 1.793 1.00 . A A . 39 GLN HE22 1 1 3 1723 1 1 39 GLN HG2 H -3.831 1.442 3.716 1.00 . A A . 39 GLN HG2 1 1 3 1724 1 1 39 GLN HG3 H -4.798 2.553 4.665 1.00 . A A . 39 GLN HG3 1 1 3 1725 1 1 39 GLN N N -0.379 2.559 4.804 1.00 . A A . 39 GLN N 1 1 3 1726 1 1 39 GLN NE2 N -5.792 3.428 2.592 1.00 . A A . 39 GLN NE2 1 1 3 1727 1 1 39 GLN O O -0.575 4.183 2.464 1.00 . A A . 39 GLN O 1 1 3 1728 1 1 39 GLN OE1 O -3.713 3.475 1.728 1.00 . A A . 39 GLN OE1 1 1 4 1729 1 1 1 MET C C 4.992 0.235 -1.666 1.00 . A A . 1 MET C 1 1 4 1730 1 1 1 MET CA C 5.649 0.133 -3.044 1.00 . A A . 1 MET CA 1 1 4 1731 1 1 1 MET CB C 5.654 -1.327 -3.501 1.00 . A A . 1 MET CB 1 1 4 1732 1 1 1 MET CE C 5.955 -2.951 -7.237 1.00 . A A . 1 MET CE 1 1 4 1733 1 1 1 MET CG C 5.474 -1.428 -5.017 1.00 . A A . 1 MET CG 1 1 4 1734 1 1 1 MET H1 H 7.564 0.412 -3.814 1.00 . A A . 1 MET H1 1 1 4 1735 1 1 1 MET HA H 5.120 0.769 -3.754 1.00 . A A . 1 MET HA 1 1 4 1736 1 1 1 MET HB2 H 6.592 -1.800 -3.210 1.00 . A A . 1 MET HB2 1 1 4 1737 1 1 1 MET HB3 H 4.853 -1.872 -3.000 1.00 . A A . 1 MET HB3 1 1 4 1738 1 1 1 MET HE1 H 5.060 -2.790 -7.838 1.00 . A A . 1 MET HE1 1 1 4 1739 1 1 1 MET HE2 H 6.623 -2.096 -7.342 1.00 . A A . 1 MET HE2 1 1 4 1740 1 1 1 MET HE3 H 6.462 -3.853 -7.578 1.00 . A A . 1 MET HE3 1 1 4 1741 1 1 1 MET HG2 H 4.532 -0.965 -5.312 1.00 . A A . 1 MET HG2 1 1 4 1742 1 1 1 MET HG3 H 6.269 -0.881 -5.523 1.00 . A A . 1 MET HG3 1 1 4 1743 1 1 1 MET N N 7.011 0.636 -3.011 1.00 . A A . 1 MET N 1 1 4 1744 1 1 1 MET O O 4.498 -0.759 -1.135 1.00 . A A . 1 MET O 1 1 4 1745 1 1 1 MET SD S 5.495 -3.140 -5.522 1.00 . A A . 1 MET SD 1 1 4 1746 1 1 2 ASP C C 4.286 3.197 0.401 1.00 . A A . 2 ASP C 1 1 4 1747 1 1 2 ASP CA C 4.423 1.689 0.181 1.00 . A A . 2 ASP CA 1 1 4 1748 1 1 2 ASP CB C 5.307 1.127 1.296 1.00 . A A . 2 ASP CB 1 1 4 1749 1 1 2 ASP CG C 4.577 0.266 2.328 1.00 . A A . 2 ASP CG 1 1 4 1750 1 1 2 ASP H H 5.414 2.247 -1.563 1.00 . A A . 2 ASP H 1 1 4 1751 1 1 2 ASP HA H 3.459 1.181 0.161 1.00 . A A . 2 ASP HA 1 1 4 1752 1 1 2 ASP HB2 H 6.101 0.532 0.844 1.00 . A A . 2 ASP HB2 1 1 4 1753 1 1 2 ASP HB3 H 5.786 1.958 1.813 1.00 . A A . 2 ASP HB3 1 1 4 1754 1 1 2 ASP HD2 H 6.070 -0.851 2.594 1.00 . A A . 2 ASP HD2 1 1 4 1755 1 1 2 ASP N N 5.009 1.444 -1.125 1.00 . A A . 2 ASP N 1 1 4 1756 1 1 2 ASP O O 5.005 3.984 -0.212 1.00 . A A . 2 ASP O 1 1 4 1757 1 1 2 ASP OD1 O 3.339 0.236 2.374 1.00 . A A . 2 ASP OD1 1 1 4 1758 1 1 2 ASP OD2 O 5.345 -0.406 3.119 1.00 . A A . 2 ASP OD2 1 1 4 1759 1 1 3 ILE C C 2.746 5.089 3.061 1.00 . A A . 3 ILE C 1 1 4 1760 1 1 3 ILE CA C 3.118 4.953 1.584 1.00 . A A . 3 ILE CA 1 1 4 1761 1 1 3 ILE CB C 2.077 5.540 0.630 1.00 . A A . 3 ILE CB 1 1 4 1762 1 1 3 ILE CD1 C 3.749 6.332 -1.083 1.00 . A A . 3 ILE CD1 1 1 4 1763 1 1 3 ILE CG1 C 2.541 5.431 -0.824 1.00 . A A . 3 ILE CG1 1 1 4 1764 1 1 3 ILE CG2 C 1.731 6.980 1.015 1.00 . A A . 3 ILE CG2 1 1 4 1765 1 1 3 ILE H H 2.778 2.907 1.770 1.00 . A A . 3 ILE H 1 1 4 1766 1 1 3 ILE HA H 4.051 5.489 1.412 1.00 . A A . 3 ILE HA 1 1 4 1767 1 1 3 ILE HB H 1.162 4.955 0.721 1.00 . A A . 3 ILE HB 1 1 4 1768 1 1 3 ILE HD11 H 3.466 7.134 -1.764 1.00 . A A . 3 ILE HD11 1 1 4 1769 1 1 3 ILE HD12 H 4.093 6.760 -0.141 1.00 . A A . 3 ILE HD12 1 1 4 1770 1 1 3 ILE HD13 H 4.552 5.745 -1.529 1.00 . A A . 3 ILE HD13 1 1 4 1771 1 1 3 ILE HG12 H 2.799 4.396 -1.050 1.00 . A A . 3 ILE HG12 1 1 4 1772 1 1 3 ILE HG13 H 1.726 5.709 -1.492 1.00 . A A . 3 ILE HG13 1 1 4 1773 1 1 3 ILE HG21 H 1.978 7.145 2.063 1.00 . A A . 3 ILE HG21 1 1 4 1774 1 1 3 ILE HG22 H 2.304 7.670 0.394 1.00 . A A . 3 ILE HG22 1 1 4 1775 1 1 3 ILE HG23 H 0.666 7.153 0.860 1.00 . A A . 3 ILE HG23 1 1 4 1776 1 1 3 ILE N N 3.358 3.553 1.276 1.00 . A A . 3 ILE N 1 1 4 1777 1 1 3 ILE O O 2.012 4.282 3.627 1.00 . A A . 3 ILE O 1 1 4 1778 1 1 4 TYR C C 2.615 7.870 5.263 1.00 . A A . 4 TYR C 1 1 4 1779 1 1 4 TYR CA C 3.022 6.415 5.083 1.00 . A A . 4 TYR CA 1 1 4 1780 1 1 4 TYR CB C 4.273 6.097 5.897 1.00 . A A . 4 TYR CB 1 1 4 1781 1 1 4 TYR CD1 C 3.968 3.737 6.727 1.00 . A A . 4 TYR CD1 1 1 4 1782 1 1 4 TYR CD2 C 5.657 4.171 5.043 1.00 . A A . 4 TYR CD2 1 1 4 1783 1 1 4 TYR CE1 C 4.309 2.379 6.719 1.00 . A A . 4 TYR CE1 1 1 4 1784 1 1 4 TYR CE2 C 5.998 2.813 5.035 1.00 . A A . 4 TYR CE2 1 1 4 1785 1 1 4 TYR CG C 4.641 4.633 5.889 1.00 . A A . 4 TYR CG 1 1 4 1786 1 1 4 TYR CZ C 5.324 1.918 5.873 1.00 . A A . 4 TYR CZ 1 1 4 1787 1 1 4 TYR H H 3.874 6.780 3.172 1.00 . A A . 4 TYR H 1 1 4 1788 1 1 4 TYR HA H 2.206 5.775 5.424 1.00 . A A . 4 TYR HA 1 1 4 1789 1 1 4 TYR HB2 H 5.107 6.668 5.489 1.00 . A A . 4 TYR HB2 1 1 4 1790 1 1 4 TYR HB3 H 4.107 6.408 6.928 1.00 . A A . 4 TYR HB3 1 1 4 1791 1 1 4 TYR HD1 H 3.183 4.093 7.380 1.00 . A A . 4 TYR HD1 1 1 4 1792 1 1 4 TYR HD2 H 6.177 4.862 4.396 1.00 . A A . 4 TYR HD2 1 1 4 1793 1 1 4 TYR HE1 H 3.789 1.688 7.366 1.00 . A A . 4 TYR HE1 1 1 4 1794 1 1 4 TYR HE2 H 6.781 2.457 4.382 1.00 . A A . 4 TYR HE2 1 1 4 1795 1 1 4 TYR HH H 5.277 0.116 5.124 1.00 . A A . 4 TYR HH 1 1 4 1796 1 1 4 TYR N N 3.276 6.145 3.683 1.00 . A A . 4 TYR N 1 1 4 1797 1 1 4 TYR O O 3.479 8.743 5.181 1.00 . A A . 4 TYR O 1 1 4 1798 1 1 4 TYR OH O 5.656 0.594 5.865 1.00 . A A . 4 TYR OH 1 1 4 1799 1 1 5 VAL C C 0.472 9.663 7.159 1.00 . A A . 5 VAL C 1 1 4 1800 1 1 5 VAL CA C 0.841 9.458 5.689 1.00 . A A . 5 VAL CA 1 1 4 1801 1 1 5 VAL CB C -0.326 9.727 4.737 1.00 . A A . 5 VAL CB 1 1 4 1802 1 1 5 VAL CG1 C -0.967 11.087 5.026 1.00 . A A . 5 VAL CG1 1 1 4 1803 1 1 5 VAL CG2 C 0.123 9.632 3.278 1.00 . A A . 5 VAL CG2 1 1 4 1804 1 1 5 VAL H H 0.637 7.389 5.566 1.00 . A A . 5 VAL H 1 1 4 1805 1 1 5 VAL HA H 1.651 10.141 5.432 1.00 . A A . 5 VAL HA 1 1 4 1806 1 1 5 VAL HB H -1.080 8.960 4.906 1.00 . A A . 5 VAL HB 1 1 4 1807 1 1 5 VAL HG11 H -2.051 10.990 4.999 1.00 . A A . 5 VAL HG11 1 1 4 1808 1 1 5 VAL HG12 H -0.656 11.433 6.012 1.00 . A A . 5 VAL HG12 1 1 4 1809 1 1 5 VAL HG13 H -0.647 11.806 4.271 1.00 . A A . 5 VAL HG13 1 1 4 1810 1 1 5 VAL HG21 H -0.181 8.670 2.866 1.00 . A A . 5 VAL HG21 1 1 4 1811 1 1 5 VAL HG22 H -0.337 10.436 2.703 1.00 . A A . 5 VAL HG22 1 1 4 1812 1 1 5 VAL HG23 H 1.208 9.722 3.225 1.00 . A A . 5 VAL HG23 1 1 4 1813 1 1 5 VAL N N 1.333 8.104 5.502 1.00 . A A . 5 VAL N 1 1 4 1814 1 1 5 VAL O O -0.272 8.870 7.732 1.00 . A A . 5 VAL O 1 1 4 1815 1 1 6 CYS C C -0.763 11.201 9.303 1.00 . A A . 6 CYS C 1 1 4 1816 1 1 6 CYS CA C 0.748 11.051 9.121 1.00 . A A . 6 CYS CA 1 1 4 1817 1 1 6 CYS CB C 1.504 12.303 9.567 1.00 . A A . 6 CYS CB 1 1 4 1818 1 1 6 CYS H H 1.617 11.372 7.255 1.00 . A A . 6 CYS H 1 1 4 1819 1 1 6 CYS HA H 1.128 10.216 9.711 1.00 . A A . 6 CYS HA 1 1 4 1820 1 1 6 CYS HB2 H 2.488 12.304 9.098 1.00 . A A . 6 CYS HB2 1 1 4 1821 1 1 6 CYS HB3 H 0.975 13.182 9.197 1.00 . A A . 6 CYS HB3 1 1 4 1822 1 1 6 CYS N N 1.011 10.731 7.728 1.00 . A A . 6 CYS N 1 1 4 1823 1 1 6 CYS O O -1.445 11.745 8.435 1.00 . A A . 6 CYS O 1 1 4 1824 1 1 6 CYS SG S 1.718 12.469 11.377 1.00 . A A . 6 CYS SG 1 1 4 1825 1 1 7 THR C C -2.930 11.889 11.764 1.00 . A A . 7 THR C 1 1 4 1826 1 1 7 THR CA C -2.662 10.784 10.741 1.00 . A A . 7 THR CA 1 1 4 1827 1 1 7 THR CB C -3.117 9.400 11.210 1.00 . A A . 7 THR CB 1 1 4 1828 1 1 7 THR CG2 C -2.642 8.281 10.279 1.00 . A A . 7 THR CG2 1 1 4 1829 1 1 7 THR H H -0.682 10.270 11.136 1.00 . A A . 7 THR H 1 1 4 1830 1 1 7 THR HA H -3.196 11.054 9.830 1.00 . A A . 7 THR HA 1 1 4 1831 1 1 7 THR HB H -4.199 9.368 11.335 1.00 . A A . 7 THR HB 1 1 4 1832 1 1 7 THR HG1 H -2.634 9.875 13.092 1.00 . A A . 7 THR HG1 1 1 4 1833 1 1 7 THR HG21 H -2.736 7.322 10.788 1.00 . A A . 7 THR HG21 1 1 4 1834 1 1 7 THR HG22 H -3.251 8.277 9.376 1.00 . A A . 7 THR HG22 1 1 4 1835 1 1 7 THR HG23 H -1.598 8.449 10.013 1.00 . A A . 7 THR HG23 1 1 4 1836 1 1 7 THR N N -1.244 10.710 10.436 1.00 . A A . 7 THR N 1 1 4 1837 1 1 7 THR O O -3.964 11.887 12.430 1.00 . A A . 7 THR O 1 1 4 1838 1 1 7 THR OG1 O -2.387 9.183 12.414 1.00 . A A . 7 THR OG1 1 1 4 1839 1 1 8 VAL C C -2.199 15.228 12.003 1.00 . A A . 8 VAL C 1 1 4 1840 1 1 8 VAL CA C -2.101 13.918 12.787 1.00 . A A . 8 VAL CA 1 1 4 1841 1 1 8 VAL CB C -0.935 13.901 13.777 1.00 . A A . 8 VAL CB 1 1 4 1842 1 1 8 VAL CG1 C -0.831 15.231 14.526 1.00 . A A . 8 VAL CG1 1 1 4 1843 1 1 8 VAL CG2 C -1.063 12.730 14.754 1.00 . A A . 8 VAL CG2 1 1 4 1844 1 1 8 VAL H H -1.142 12.804 11.312 1.00 . A A . 8 VAL H 1 1 4 1845 1 1 8 VAL HA H -3.024 13.777 13.351 1.00 . A A . 8 VAL HA 1 1 4 1846 1 1 8 VAL HB H -0.015 13.763 13.208 1.00 . A A . 8 VAL HB 1 1 4 1847 1 1 8 VAL HG11 H -0.423 15.991 13.861 1.00 . A A . 8 VAL HG11 1 1 4 1848 1 1 8 VAL HG12 H -1.822 15.537 14.863 1.00 . A A . 8 VAL HG12 1 1 4 1849 1 1 8 VAL HG13 H -0.175 15.113 15.389 1.00 . A A . 8 VAL HG13 1 1 4 1850 1 1 8 VAL HG21 H -0.446 11.900 14.409 1.00 . A A . 8 VAL HG21 1 1 4 1851 1 1 8 VAL HG22 H -0.729 13.044 15.744 1.00 . A A . 8 VAL HG22 1 1 4 1852 1 1 8 VAL HG23 H -2.104 12.412 14.807 1.00 . A A . 8 VAL HG23 1 1 4 1853 1 1 8 VAL N N -1.980 12.809 11.858 1.00 . A A . 8 VAL N 1 1 4 1854 1 1 8 VAL O O -3.110 16.023 12.227 1.00 . A A . 8 VAL O 1 1 4 1855 1 1 9 CYS C C -1.616 16.228 8.852 1.00 . A A . 9 CYS C 1 1 4 1856 1 1 9 CYS CA C -1.217 16.611 10.278 1.00 . A A . 9 CYS CA 1 1 4 1857 1 1 9 CYS CB C 0.153 17.292 10.325 1.00 . A A . 9 CYS CB 1 1 4 1858 1 1 9 CYS H H -0.512 14.760 10.922 1.00 . A A . 9 CYS H 1 1 4 1859 1 1 9 CYS HA H -1.939 17.304 10.710 1.00 . A A . 9 CYS HA 1 1 4 1860 1 1 9 CYS HB2 H 0.194 18.046 9.540 1.00 . A A . 9 CYS HB2 1 1 4 1861 1 1 9 CYS HB3 H 0.251 17.814 11.276 1.00 . A A . 9 CYS HB3 1 1 4 1862 1 1 9 CYS N N -1.249 15.411 11.098 1.00 . A A . 9 CYS N 1 1 4 1863 1 1 9 CYS O O -2.053 17.078 8.078 1.00 . A A . 9 CYS O 1 1 4 1864 1 1 9 CYS SG S 1.578 16.161 10.128 1.00 . A A . 9 CYS SG 1 1 4 1865 1 1 10 GLY C C -0.554 14.394 6.328 1.00 . A A . 10 GLY C 1 1 4 1866 1 1 10 GLY CA C -1.790 14.445 7.228 1.00 . A A . 10 GLY CA 1 1 4 1867 1 1 10 GLY H H -1.096 14.265 9.184 1.00 . A A . 10 GLY H 1 1 4 1868 1 1 10 GLY HA2 H -2.223 13.448 7.316 1.00 . A A . 10 GLY HA2 1 1 4 1869 1 1 10 GLY HA3 H -2.549 15.082 6.775 1.00 . A A . 10 GLY HA3 1 1 4 1870 1 1 10 GLY N N -1.452 14.950 8.548 1.00 . A A . 10 GLY N 1 1 4 1871 1 1 10 GLY O O -0.625 14.092 5.139 1.00 . A A . 10 GLY O 1 1 4 1872 1 1 11 TYR C C 1.926 13.492 5.293 1.00 . A A . 11 TYR C 1 1 4 1873 1 1 11 TYR CA C 1.857 14.699 6.216 1.00 . A A . 11 TYR CA 1 1 4 1874 1 1 11 TYR CB C 3.008 14.681 7.217 1.00 . A A . 11 TYR CB 1 1 4 1875 1 1 11 TYR CD1 C 4.518 15.925 5.629 1.00 . A A . 11 TYR CD1 1 1 4 1876 1 1 11 TYR CD2 C 5.454 14.127 6.960 1.00 . A A . 11 TYR CD2 1 1 4 1877 1 1 11 TYR CE1 C 5.771 16.144 5.043 1.00 . A A . 11 TYR CE1 1 1 4 1878 1 1 11 TYR CE2 C 6.706 14.345 6.375 1.00 . A A . 11 TYR CE2 1 1 4 1879 1 1 11 TYR CG C 4.359 14.917 6.587 1.00 . A A . 11 TYR CG 1 1 4 1880 1 1 11 TYR CZ C 6.866 15.353 5.416 1.00 . A A . 11 TYR CZ 1 1 4 1881 1 1 11 TYR H H 0.600 14.942 7.912 1.00 . A A . 11 TYR H 1 1 4 1882 1 1 11 TYR HA H 1.924 15.607 5.617 1.00 . A A . 11 TYR HA 1 1 4 1883 1 1 11 TYR HB2 H 2.833 15.455 7.964 1.00 . A A . 11 TYR HB2 1 1 4 1884 1 1 11 TYR HB3 H 3.021 13.711 7.715 1.00 . A A . 11 TYR HB3 1 1 4 1885 1 1 11 TYR HD1 H 3.674 16.535 5.341 1.00 . A A . 11 TYR HD1 1 1 4 1886 1 1 11 TYR HD2 H 5.331 13.349 7.699 1.00 . A A . 11 TYR HD2 1 1 4 1887 1 1 11 TYR HE1 H 5.894 16.921 4.304 1.00 . A A . 11 TYR HE1 1 1 4 1888 1 1 11 TYR HE2 H 7.550 13.736 6.662 1.00 . A A . 11 TYR HE2 1 1 4 1889 1 1 11 TYR HH H 8.076 16.264 4.187 1.00 . A A . 11 TYR HH 1 1 4 1890 1 1 11 TYR N N 0.596 14.699 6.931 1.00 . A A . 11 TYR N 1 1 4 1891 1 1 11 TYR O O 1.169 12.544 5.496 1.00 . A A . 11 TYR O 1 1 4 1892 1 1 11 TYR OH O 8.086 15.566 4.846 1.00 . A A . 11 TYR OH 1 1 4 1893 1 1 12 GLU C C 4.420 11.991 3.312 1.00 . A A . 12 GLU C 1 1 4 1894 1 1 12 GLU CA C 2.960 12.446 3.373 1.00 . A A . 12 GLU CA 1 1 4 1895 1 1 12 GLU CB C 2.450 12.837 1.984 1.00 . A A . 12 GLU CB 1 1 4 1896 1 1 12 GLU CD C 0.287 13.265 0.761 1.00 . A A . 12 GLU CD 1 1 4 1897 1 1 12 GLU CG C 1.004 12.381 1.784 1.00 . A A . 12 GLU CG 1 1 4 1898 1 1 12 GLU H H 3.425 14.322 4.152 1.00 . A A . 12 GLU H 1 1 4 1899 1 1 12 GLU HA H 2.339 11.643 3.769 1.00 . A A . 12 GLU HA 1 1 4 1900 1 1 12 GLU HB2 H 2.515 13.918 1.861 1.00 . A A . 12 GLU HB2 1 1 4 1901 1 1 12 GLU HB3 H 3.086 12.390 1.220 1.00 . A A . 12 GLU HB3 1 1 4 1902 1 1 12 GLU HE2 H 0.378 13.906 -1.007 1.00 . A A . 12 GLU HE2 1 1 4 1903 1 1 12 GLU HG2 H 0.989 11.345 1.447 1.00 . A A . 12 GLU HG2 1 1 4 1904 1 1 12 GLU HG3 H 0.472 12.415 2.735 1.00 . A A . 12 GLU HG3 1 1 4 1905 1 1 12 GLU N N 2.814 13.546 4.311 1.00 . A A . 12 GLU N 1 1 4 1906 1 1 12 GLU O O 5.352 12.791 3.265 1.00 . A A . 12 GLU O 1 1 4 1907 1 1 12 GLU OE1 O -0.615 14.033 1.130 1.00 . A A . 12 GLU OE1 1 1 4 1908 1 1 12 GLU OE2 O 0.697 13.136 -0.455 1.00 . A A . 12 GLU OE2 1 1 4 1909 1 1 13 TYR C C 6.081 9.279 1.977 1.00 . A A . 13 TYR C 1 1 4 1910 1 1 13 TYR CA C 5.922 10.077 3.263 1.00 . A A . 13 TYR CA 1 1 4 1911 1 1 13 TYR CB C 6.126 9.183 4.483 1.00 . A A . 13 TYR CB 1 1 4 1912 1 1 13 TYR CD1 C 8.563 9.642 4.931 1.00 . A A . 13 TYR CD1 1 1 4 1913 1 1 13 TYR CD2 C 7.859 7.354 4.541 1.00 . A A . 13 TYR CD2 1 1 4 1914 1 1 13 TYR CE1 C 9.885 9.207 5.091 1.00 . A A . 13 TYR CE1 1 1 4 1915 1 1 13 TYR CE2 C 9.180 6.920 4.700 1.00 . A A . 13 TYR CE2 1 1 4 1916 1 1 13 TYR CG C 7.550 8.715 4.656 1.00 . A A . 13 TYR CG 1 1 4 1917 1 1 13 TYR CZ C 10.193 7.847 4.974 1.00 . A A . 13 TYR CZ 1 1 4 1918 1 1 13 TYR H H 3.800 10.053 3.355 1.00 . A A . 13 TYR H 1 1 4 1919 1 1 13 TYR HA H 6.666 10.873 3.279 1.00 . A A . 13 TYR HA 1 1 4 1920 1 1 13 TYR HB2 H 5.831 9.739 5.374 1.00 . A A . 13 TYR HB2 1 1 4 1921 1 1 13 TYR HB3 H 5.482 8.310 4.387 1.00 . A A . 13 TYR HB3 1 1 4 1922 1 1 13 TYR HD1 H 8.326 10.691 5.020 1.00 . A A . 13 TYR HD1 1 1 4 1923 1 1 13 TYR HD2 H 7.078 6.640 4.328 1.00 . A A . 13 TYR HD2 1 1 4 1924 1 1 13 TYR HE1 H 10.667 9.922 5.302 1.00 . A A . 13 TYR HE1 1 1 4 1925 1 1 13 TYR HE2 H 9.418 5.870 4.611 1.00 . A A . 13 TYR HE2 1 1 4 1926 1 1 13 TYR HH H 11.771 7.430 6.045 1.00 . A A . 13 TYR HH 1 1 4 1927 1 1 13 TYR N N 4.600 10.668 3.315 1.00 . A A . 13 TYR N 1 1 4 1928 1 1 13 TYR O O 5.076 8.823 1.433 1.00 . A A . 13 TYR O 1 1 4 1929 1 1 13 TYR OH O 11.480 7.424 5.130 1.00 . A A . 13 TYR OH 1 1 4 1930 1 1 14 ASP C C 8.781 7.464 0.520 1.00 . A A . 14 ASP C 1 1 4 1931 1 1 14 ASP CA C 7.578 8.382 0.302 1.00 . A A . 14 ASP CA 1 1 4 1932 1 1 14 ASP CB C 7.904 9.324 -0.859 1.00 . A A . 14 ASP CB 1 1 4 1933 1 1 14 ASP CG C 7.604 8.763 -2.250 1.00 . A A . 14 ASP CG 1 1 4 1934 1 1 14 ASP H H 8.127 9.502 1.970 1.00 . A A . 14 ASP H 1 1 4 1935 1 1 14 ASP HA H 6.660 7.828 0.103 1.00 . A A . 14 ASP HA 1 1 4 1936 1 1 14 ASP HB2 H 7.341 10.249 -0.727 1.00 . A A . 14 ASP HB2 1 1 4 1937 1 1 14 ASP HB3 H 8.961 9.584 -0.809 1.00 . A A . 14 ASP HB3 1 1 4 1938 1 1 14 ASP HD2 H 6.384 10.117 -2.723 1.00 . A A . 14 ASP HD2 1 1 4 1939 1 1 14 ASP N N 7.315 9.127 1.522 1.00 . A A . 14 ASP N 1 1 4 1940 1 1 14 ASP O O 9.927 7.816 0.253 1.00 . A A . 14 ASP O 1 1 4 1941 1 1 14 ASP OD1 O 7.779 7.563 -2.507 1.00 . A A . 14 ASP OD1 1 1 4 1942 1 1 14 ASP OD2 O 7.167 9.626 -3.104 1.00 . A A . 14 ASP OD2 1 1 4 1943 1 1 15 PRO C C 10.566 5.272 0.243 1.00 . A A . 15 PRO C 1 1 4 1944 1 1 15 PRO CA C 9.471 5.233 1.299 1.00 . A A . 15 PRO CA 1 1 4 1945 1 1 15 PRO CB C 8.693 3.921 1.235 1.00 . A A . 15 PRO CB 1 1 4 1946 1 1 15 PRO CD C 7.152 5.812 1.341 1.00 . A A . 15 PRO CD 1 1 4 1947 1 1 15 PRO CG C 7.321 4.365 1.800 1.00 . A A . 15 PRO CG 1 1 4 1948 1 1 15 PRO HA H 9.905 5.369 2.288 1.00 . A A . 15 PRO HA 1 1 4 1949 1 1 15 PRO HB2 H 8.622 3.531 0.218 1.00 . A A . 15 PRO HB2 1 1 4 1950 1 1 15 PRO HB3 H 9.165 3.193 1.894 1.00 . A A . 15 PRO HB3 1 1 4 1951 1 1 15 PRO HD2 H 6.489 5.871 0.478 1.00 . A A . 15 PRO HD2 1 1 4 1952 1 1 15 PRO HD3 H 6.764 6.416 2.161 1.00 . A A . 15 PRO HD3 1 1 4 1953 1 1 15 PRO HG2 H 6.501 3.766 1.406 1.00 . A A . 15 PRO HG2 1 1 4 1954 1 1 15 PRO HG3 H 7.377 4.278 2.885 1.00 . A A . 15 PRO HG3 1 1 4 1955 1 1 15 PRO N N 8.489 6.260 1.017 1.00 . A A . 15 PRO N 1 1 4 1956 1 1 15 PRO O O 10.249 5.226 -0.945 1.00 . A A . 15 PRO O 1 1 4 1957 1 1 16 ALA C C 14.175 5.909 0.492 1.00 . A A . 16 ALA C 1 1 4 1958 1 1 16 ALA CA C 12.933 5.399 -0.241 1.00 . A A . 16 ALA CA 1 1 4 1959 1 1 16 ALA CB C 12.567 6.271 -1.444 1.00 . A A . 16 ALA CB 1 1 4 1960 1 1 16 ALA H H 12.063 5.392 1.651 1.00 . A A . 16 ALA H 1 1 4 1961 1 1 16 ALA HA H 13.117 4.383 -0.588 1.00 . A A . 16 ALA HA 1 1 4 1962 1 1 16 ALA HB1 H 11.785 6.974 -1.159 1.00 . A A . 16 ALA HB1 1 1 4 1963 1 1 16 ALA HB2 H 13.447 6.821 -1.775 1.00 . A A . 16 ALA HB2 1 1 4 1964 1 1 16 ALA HB3 H 12.208 5.638 -2.256 1.00 . A A . 16 ALA HB3 1 1 4 1965 1 1 16 ALA N N 11.813 5.355 0.684 1.00 . A A . 16 ALA N 1 1 4 1966 1 1 16 ALA O O 15.298 5.552 0.141 1.00 . A A . 16 ALA O 1 1 4 1967 1 1 17 PHE C C 15.917 6.197 2.843 1.00 . A A . 17 PHE C 1 1 4 1968 1 1 17 PHE CA C 15.015 7.299 2.285 1.00 . A A . 17 PHE CA 1 1 4 1969 1 1 17 PHE CB C 14.377 8.058 3.449 1.00 . A A . 17 PHE CB 1 1 4 1970 1 1 17 PHE CD1 C 13.420 9.579 1.705 1.00 . A A . 17 PHE CD1 1 1 4 1971 1 1 17 PHE CD2 C 12.786 9.926 3.948 1.00 . A A . 17 PHE CD2 1 1 4 1972 1 1 17 PHE CE1 C 12.600 10.667 1.305 1.00 . A A . 17 PHE CE1 1 1 4 1973 1 1 17 PHE CE2 C 11.967 11.015 3.547 1.00 . A A . 17 PHE CE2 1 1 4 1974 1 1 17 PHE CG C 13.494 9.231 3.017 1.00 . A A . 17 PHE CG 1 1 4 1975 1 1 17 PHE CZ C 11.891 11.362 2.235 1.00 . A A . 17 PHE CZ 1 1 4 1976 1 1 17 PHE H H 13.014 7.022 1.778 1.00 . A A . 17 PHE H 1 1 4 1977 1 1 17 PHE HA H 15.597 7.939 1.621 1.00 . A A . 17 PHE HA 1 1 4 1978 1 1 17 PHE HB2 H 13.778 7.363 4.038 1.00 . A A . 17 PHE HB2 1 1 4 1979 1 1 17 PHE HB3 H 15.166 8.431 4.102 1.00 . A A . 17 PHE HB3 1 1 4 1980 1 1 17 PHE HD1 H 13.987 9.022 0.960 1.00 . A A . 17 PHE HD1 1 1 4 1981 1 1 17 PHE HD2 H 12.846 9.648 4.999 1.00 . A A . 17 PHE HD2 1 1 4 1982 1 1 17 PHE HE1 H 12.539 10.946 0.254 1.00 . A A . 17 PHE HE1 1 1 4 1983 1 1 17 PHE HE2 H 11.398 11.572 4.292 1.00 . A A . 17 PHE HE2 1 1 4 1984 1 1 17 PHE HZ H 11.262 12.198 1.927 1.00 . A A . 17 PHE HZ 1 1 4 1985 1 1 17 PHE N N 13.931 6.736 1.499 1.00 . A A . 17 PHE N 1 1 4 1986 1 1 17 PHE O O 15.742 5.022 2.520 1.00 . A A . 17 PHE O 1 1 4 1987 1 1 18 GLU C C 17.814 5.857 5.799 1.00 . A A . 18 GLU C 1 1 4 1988 1 1 18 GLU CA C 17.792 5.675 4.279 1.00 . A A . 18 GLU CA 1 1 4 1989 1 1 18 GLU CB C 19.194 5.831 3.688 1.00 . A A . 18 GLU CB 1 1 4 1990 1 1 18 GLU CD C 19.814 3.554 2.800 1.00 . A A . 18 GLU CD 1 1 4 1991 1 1 18 GLU CG C 20.031 4.573 3.921 1.00 . A A . 18 GLU CG 1 1 4 1992 1 1 18 GLU H H 16.998 7.569 3.931 1.00 . A A . 18 GLU H 1 1 4 1993 1 1 18 GLU HA H 17.409 4.685 4.031 1.00 . A A . 18 GLU HA 1 1 4 1994 1 1 18 GLU HB2 H 19.121 6.032 2.618 1.00 . A A . 18 GLU HB2 1 1 4 1995 1 1 18 GLU HB3 H 19.690 6.691 4.140 1.00 . A A . 18 GLU HB3 1 1 4 1996 1 1 18 GLU HE2 H 21.484 4.042 2.082 1.00 . A A . 18 GLU HE2 1 1 4 1997 1 1 18 GLU HG2 H 21.088 4.838 3.975 1.00 . A A . 18 GLU HG2 1 1 4 1998 1 1 18 GLU HG3 H 19.766 4.127 4.879 1.00 . A A . 18 GLU HG3 1 1 4 1999 1 1 18 GLU N N 16.863 6.613 3.673 1.00 . A A . 18 GLU N 1 1 4 2000 1 1 18 GLU O O 17.556 4.914 6.544 1.00 . A A . 18 GLU O 1 1 4 2001 1 1 18 GLU OE1 O 18.683 3.084 2.601 1.00 . A A . 18 GLU OE1 1 1 4 2002 1 1 18 GLU OE2 O 20.869 3.255 2.122 1.00 . A A . 18 GLU OE2 1 1 4 2003 1 1 19 ASP C C 16.847 7.047 8.281 1.00 . A A . 19 ASP C 1 1 4 2004 1 1 19 ASP CA C 18.185 7.395 7.627 1.00 . A A . 19 ASP CA 1 1 4 2005 1 1 19 ASP CB C 18.444 8.887 7.847 1.00 . A A . 19 ASP CB 1 1 4 2006 1 1 19 ASP CG C 19.879 9.245 8.236 1.00 . A A . 19 ASP CG 1 1 4 2007 1 1 19 ASP H H 18.335 7.839 5.598 1.00 . A A . 19 ASP H 1 1 4 2008 1 1 19 ASP HA H 19.009 6.799 8.021 1.00 . A A . 19 ASP HA 1 1 4 2009 1 1 19 ASP HB2 H 18.187 9.423 6.933 1.00 . A A . 19 ASP HB2 1 1 4 2010 1 1 19 ASP HB3 H 17.771 9.247 8.626 1.00 . A A . 19 ASP HB3 1 1 4 2011 1 1 19 ASP HD2 H 20.961 10.106 9.515 1.00 . A A . 19 ASP HD2 1 1 4 2012 1 1 19 ASP N N 18.126 7.077 6.211 1.00 . A A . 19 ASP N 1 1 4 2013 1 1 19 ASP O O 15.915 7.850 8.261 1.00 . A A . 19 ASP O 1 1 4 2014 1 1 19 ASP OD1 O 20.838 8.903 7.527 1.00 . A A . 19 ASP OD1 1 1 4 2015 1 1 19 ASP OD2 O 19.996 9.912 9.334 1.00 . A A . 19 ASP OD2 1 1 4 2016 1 1 20 LEU C C 15.939 4.845 10.890 1.00 . A A . 20 LEU C 1 1 4 2017 1 1 20 LEU CA C 15.584 5.384 9.503 1.00 . A A . 20 LEU CA 1 1 4 2018 1 1 20 LEU CB C 14.848 4.374 8.620 1.00 . A A . 20 LEU CB 1 1 4 2019 1 1 20 LEU CD1 C 12.749 4.184 10.004 1.00 . A A . 20 LEU CD1 1 1 4 2020 1 1 20 LEU CD2 C 12.864 5.833 8.080 1.00 . A A . 20 LEU CD2 1 1 4 2021 1 1 20 LEU CG C 13.322 4.475 8.615 1.00 . A A . 20 LEU CG 1 1 4 2022 1 1 20 LEU H H 17.557 5.202 8.857 1.00 . A A . 20 LEU H 1 1 4 2023 1 1 20 LEU HA H 14.927 6.245 9.625 1.00 . A A . 20 LEU HA 1 1 4 2024 1 1 20 LEU HB2 H 15.203 4.490 7.596 1.00 . A A . 20 LEU HB2 1 1 4 2025 1 1 20 LEU HB3 H 15.125 3.371 8.942 1.00 . A A . 20 LEU HB3 1 1 4 2026 1 1 20 LEU HD11 H 13.092 3.206 10.340 1.00 . A A . 20 LEU HD11 1 1 4 2027 1 1 20 LEU HD12 H 13.086 4.948 10.703 1.00 . A A . 20 LEU HD12 1 1 4 2028 1 1 20 LEU HD13 H 11.660 4.189 9.956 1.00 . A A . 20 LEU HD13 1 1 4 2029 1 1 20 LEU HD21 H 12.625 6.492 8.916 1.00 . A A . 20 LEU HD21 1 1 4 2030 1 1 20 LEU HD22 H 13.662 6.278 7.485 1.00 . A A . 20 LEU HD22 1 1 4 2031 1 1 20 LEU HD23 H 11.978 5.700 7.459 1.00 . A A . 20 LEU HD23 1 1 4 2032 1 1 20 LEU HG H 12.931 3.714 7.940 1.00 . A A . 20 LEU HG 1 1 4 2033 1 1 20 LEU N N 16.794 5.849 8.845 1.00 . A A . 20 LEU N 1 1 4 2034 1 1 20 LEU O O 16.093 3.644 11.103 1.00 . A A . 20 LEU O 1 1 4 2035 1 1 21 PRO C C 15.142 5.051 13.965 1.00 . A A . 21 PRO C 1 1 4 2036 1 1 21 PRO CA C 16.395 5.487 13.220 1.00 . A A . 21 PRO CA 1 1 4 2037 1 1 21 PRO CB C 16.931 6.805 13.777 1.00 . A A . 21 PRO CB 1 1 4 2038 1 1 21 PRO CD C 15.893 7.193 11.625 1.00 . A A . 21 PRO CD 1 1 4 2039 1 1 21 PRO CG C 16.216 7.839 12.971 1.00 . A A . 21 PRO CG 1 1 4 2040 1 1 21 PRO HA H 17.157 4.709 13.290 1.00 . A A . 21 PRO HA 1 1 4 2041 1 1 21 PRO HB2 H 16.773 6.896 14.852 1.00 . A A . 21 PRO HB2 1 1 4 2042 1 1 21 PRO HB3 H 17.990 6.893 13.533 1.00 . A A . 21 PRO HB3 1 1 4 2043 1 1 21 PRO HD2 H 14.875 7.429 11.314 1.00 . A A . 21 PRO HD2 1 1 4 2044 1 1 21 PRO HD3 H 16.607 7.529 10.872 1.00 . A A . 21 PRO HD3 1 1 4 2045 1 1 21 PRO HG2 H 15.285 8.060 13.495 1.00 . A A . 21 PRO HG2 1 1 4 2046 1 1 21 PRO HG3 H 16.822 8.738 12.863 1.00 . A A . 21 PRO HG3 1 1 4 2047 1 1 21 PRO N N 16.067 5.773 11.841 1.00 . A A . 21 PRO N 1 1 4 2048 1 1 21 PRO O O 14.056 5.123 13.392 1.00 . A A . 21 PRO O 1 1 4 2049 1 1 22 ASP C C 13.675 5.334 16.856 1.00 . A A . 22 ASP C 1 1 4 2050 1 1 22 ASP CA C 14.176 4.170 16.000 1.00 . A A . 22 ASP CA 1 1 4 2051 1 1 22 ASP CB C 14.575 3.029 16.939 1.00 . A A . 22 ASP CB 1 1 4 2052 1 1 22 ASP CG C 15.945 3.186 17.601 1.00 . A A . 22 ASP CG 1 1 4 2053 1 1 22 ASP H H 16.195 4.556 15.663 1.00 . A A . 22 ASP H 1 1 4 2054 1 1 22 ASP HA H 13.432 3.833 15.278 1.00 . A A . 22 ASP HA 1 1 4 2055 1 1 22 ASP HB2 H 13.818 2.939 17.719 1.00 . A A . 22 ASP HB2 1 1 4 2056 1 1 22 ASP HB3 H 14.564 2.095 16.376 1.00 . A A . 22 ASP HB3 1 1 4 2057 1 1 22 ASP HD2 H 16.803 3.748 19.180 1.00 . A A . 22 ASP HD2 1 1 4 2058 1 1 22 ASP N N 15.308 4.612 15.204 1.00 . A A . 22 ASP N 1 1 4 2059 1 1 22 ASP O O 13.547 5.204 18.073 1.00 . A A . 22 ASP O 1 1 4 2060 1 1 22 ASP OD1 O 16.989 3.098 16.937 1.00 . A A . 22 ASP OD1 1 1 4 2061 1 1 22 ASP OD2 O 15.914 3.410 18.870 1.00 . A A . 22 ASP OD2 1 1 4 2062 1 1 23 ASP C C 12.685 8.745 15.851 1.00 . A A . 23 ASP C 1 1 4 2063 1 1 23 ASP CA C 12.919 7.631 16.873 1.00 . A A . 23 ASP CA 1 1 4 2064 1 1 23 ASP CB C 13.942 8.133 17.894 1.00 . A A . 23 ASP CB 1 1 4 2065 1 1 23 ASP CG C 15.393 8.130 17.411 1.00 . A A . 23 ASP CG 1 1 4 2066 1 1 23 ASP H H 13.509 6.542 15.198 1.00 . A A . 23 ASP H 1 1 4 2067 1 1 23 ASP HA H 11.999 7.320 17.368 1.00 . A A . 23 ASP HA 1 1 4 2068 1 1 23 ASP HB2 H 13.674 9.150 18.185 1.00 . A A . 23 ASP HB2 1 1 4 2069 1 1 23 ASP HB3 H 13.870 7.518 18.791 1.00 . A A . 23 ASP HB3 1 1 4 2070 1 1 23 ASP HD2 H 16.279 7.053 18.678 1.00 . A A . 23 ASP HD2 1 1 4 2071 1 1 23 ASP N N 13.404 6.445 16.188 1.00 . A A . 23 ASP N 1 1 4 2072 1 1 23 ASP O O 13.244 9.834 15.975 1.00 . A A . 23 ASP O 1 1 4 2073 1 1 23 ASP OD1 O 15.666 8.249 16.208 1.00 . A A . 23 ASP OD1 1 1 4 2074 1 1 23 ASP OD2 O 16.277 7.995 18.342 1.00 . A A . 23 ASP OD2 1 1 4 2075 1 1 24 TRP C C 10.215 10.066 14.180 1.00 . A A . 24 TRP C 1 1 4 2076 1 1 24 TRP CA C 11.543 9.396 13.821 1.00 . A A . 24 TRP CA 1 1 4 2077 1 1 24 TRP CB C 11.523 8.726 12.445 1.00 . A A . 24 TRP CB 1 1 4 2078 1 1 24 TRP CD1 C 12.776 10.539 11.102 1.00 . A A . 24 TRP CD1 1 1 4 2079 1 1 24 TRP CD2 C 10.899 9.872 10.131 1.00 . A A . 24 TRP CD2 1 1 4 2080 1 1 24 TRP CE2 C 11.466 10.832 9.318 1.00 . A A . 24 TRP CE2 1 1 4 2081 1 1 24 TRP CE3 C 9.688 9.244 9.791 1.00 . A A . 24 TRP CE3 1 1 4 2082 1 1 24 TRP CG C 11.754 9.691 11.280 1.00 . A A . 24 TRP CG 1 1 4 2083 1 1 24 TRP CH2 C 9.684 10.640 7.752 1.00 . A A . 24 TRP CH2 1 1 4 2084 1 1 24 TRP CZ2 C 10.892 11.251 8.112 1.00 . A A . 24 TRP CZ2 1 1 4 2085 1 1 24 TRP CZ3 C 9.127 9.675 8.582 1.00 . A A . 24 TRP CZ3 1 1 4 2086 1 1 24 TRP H H 11.407 7.547 14.770 1.00 . A A . 24 TRP H 1 1 4 2087 1 1 24 TRP HA H 12.340 10.139 13.800 1.00 . A A . 24 TRP HA 1 1 4 2088 1 1 24 TRP HB2 H 12.288 7.951 12.419 1.00 . A A . 24 TRP HB2 1 1 4 2089 1 1 24 TRP HB3 H 10.562 8.232 12.308 1.00 . A A . 24 TRP HB3 1 1 4 2090 1 1 24 TRP HD1 H 13.607 10.653 11.797 1.00 . A A . 24 TRP HD1 1 1 4 2091 1 1 24 TRP HE1 H 13.335 12.003 9.547 1.00 . A A . 24 TRP HE1 1 1 4 2092 1 1 24 TRP HE3 H 9.221 8.483 10.416 1.00 . A A . 24 TRP HE3 1 1 4 2093 1 1 24 TRP HH2 H 9.184 10.920 6.825 1.00 . A A . 24 TRP HH2 1 1 4 2094 1 1 24 TRP HZ2 H 11.359 12.012 7.487 1.00 . A A . 24 TRP HZ2 1 1 4 2095 1 1 24 TRP HZ3 H 8.186 9.220 8.270 1.00 . A A . 24 TRP HZ3 1 1 4 2096 1 1 24 TRP N N 11.858 8.435 14.864 1.00 . A A . 24 TRP N 1 1 4 2097 1 1 24 TRP NE1 N 12.644 11.251 9.927 1.00 . A A . 24 TRP NE1 1 1 4 2098 1 1 24 TRP O O 9.269 9.395 14.590 1.00 . A A . 24 TRP O 1 1 4 2099 1 1 25 ALA C C 8.633 13.021 13.109 1.00 . A A . 25 ALA C 1 1 4 2100 1 1 25 ALA CA C 8.990 12.146 14.313 1.00 . A A . 25 ALA CA 1 1 4 2101 1 1 25 ALA CB C 9.215 12.968 15.584 1.00 . A A . 25 ALA CB 1 1 4 2102 1 1 25 ALA H H 10.959 11.918 13.677 1.00 . A A . 25 ALA H 1 1 4 2103 1 1 25 ALA HA H 8.178 11.440 14.490 1.00 . A A . 25 ALA HA 1 1 4 2104 1 1 25 ALA HB1 H 9.022 14.019 15.375 1.00 . A A . 25 ALA HB1 1 1 4 2105 1 1 25 ALA HB2 H 8.538 12.621 16.365 1.00 . A A . 25 ALA HB2 1 1 4 2106 1 1 25 ALA HB3 H 10.246 12.846 15.916 1.00 . A A . 25 ALA HB3 1 1 4 2107 1 1 25 ALA N N 10.186 11.379 14.012 1.00 . A A . 25 ALA N 1 1 4 2108 1 1 25 ALA O O 9.515 13.590 12.468 1.00 . A A . 25 ALA O 1 1 4 2109 1 1 26 CYS C C 7.513 15.275 11.795 1.00 . A A . 26 CYS C 1 1 4 2110 1 1 26 CYS CA C 6.855 13.896 11.722 1.00 . A A . 26 CYS CA 1 1 4 2111 1 1 26 CYS CB C 5.328 13.991 11.715 1.00 . A A . 26 CYS CB 1 1 4 2112 1 1 26 CYS H H 6.627 12.633 13.364 1.00 . A A . 26 CYS H 1 1 4 2113 1 1 26 CYS HA H 7.151 13.372 10.813 1.00 . A A . 26 CYS HA 1 1 4 2114 1 1 26 CYS HB2 H 4.916 13.040 12.049 1.00 . A A . 26 CYS HB2 1 1 4 2115 1 1 26 CYS HB3 H 5.022 14.743 12.445 1.00 . A A . 26 CYS HB3 1 1 4 2116 1 1 26 CYS N N 7.338 13.100 12.838 1.00 . A A . 26 CYS N 1 1 4 2117 1 1 26 CYS O O 7.195 16.106 12.642 1.00 . A A . 26 CYS O 1 1 4 2118 1 1 26 CYS SG S 4.592 14.414 10.094 1.00 . A A . 26 CYS SG 1 1 4 2119 1 1 27 PRO C C 8.243 17.918 10.798 1.00 . A A . 27 PRO C 1 1 4 2120 1 1 27 PRO CA C 9.200 16.734 10.755 1.00 . A A . 27 PRO CA 1 1 4 2121 1 1 27 PRO CB C 9.896 16.642 9.400 1.00 . A A . 27 PRO CB 1 1 4 2122 1 1 27 PRO CD C 8.850 14.546 9.861 1.00 . A A . 27 PRO CD 1 1 4 2123 1 1 27 PRO CG C 10.123 15.127 9.250 1.00 . A A . 27 PRO CG 1 1 4 2124 1 1 27 PRO HA H 9.935 16.824 11.555 1.00 . A A . 27 PRO HA 1 1 4 2125 1 1 27 PRO HB2 H 9.279 17.031 8.590 1.00 . A A . 27 PRO HB2 1 1 4 2126 1 1 27 PRO HB3 H 10.848 17.173 9.448 1.00 . A A . 27 PRO HB3 1 1 4 2127 1 1 27 PRO HD2 H 8.077 14.421 9.102 1.00 . A A . 27 PRO HD2 1 1 4 2128 1 1 27 PRO HD3 H 9.071 13.592 10.339 1.00 . A A . 27 PRO HD3 1 1 4 2129 1 1 27 PRO HG2 H 10.260 14.719 8.248 1.00 . A A . 27 PRO HG2 1 1 4 2130 1 1 27 PRO HG3 H 11.001 14.938 9.868 1.00 . A A . 27 PRO HG3 1 1 4 2131 1 1 27 PRO N N 8.452 15.501 10.872 1.00 . A A . 27 PRO N 1 1 4 2132 1 1 27 PRO O O 8.689 19.032 11.064 1.00 . A A . 27 PRO O 1 1 4 2133 1 1 28 VAL C C 5.481 18.933 11.986 1.00 . A A . 28 VAL C 1 1 4 2134 1 1 28 VAL CA C 5.975 18.720 10.553 1.00 . A A . 28 VAL CA 1 1 4 2135 1 1 28 VAL CB C 4.846 18.391 9.574 1.00 . A A . 28 VAL CB 1 1 4 2136 1 1 28 VAL CG1 C 3.726 19.430 9.659 1.00 . A A . 28 VAL CG1 1 1 4 2137 1 1 28 VAL CG2 C 5.377 18.273 8.144 1.00 . A A . 28 VAL CG2 1 1 4 2138 1 1 28 VAL H H 6.614 16.751 10.324 1.00 . A A . 28 VAL H 1 1 4 2139 1 1 28 VAL HA H 6.462 19.634 10.211 1.00 . A A . 28 VAL HA 1 1 4 2140 1 1 28 VAL HB H 4.429 17.425 9.857 1.00 . A A . 28 VAL HB 1 1 4 2141 1 1 28 VAL HG11 H 3.282 19.567 8.673 1.00 . A A . 28 VAL HG11 1 1 4 2142 1 1 28 VAL HG12 H 2.963 19.086 10.357 1.00 . A A . 28 VAL HG12 1 1 4 2143 1 1 28 VAL HG13 H 4.136 20.378 10.008 1.00 . A A . 28 VAL HG13 1 1 4 2144 1 1 28 VAL HG21 H 4.562 18.436 7.439 1.00 . A A . 28 VAL HG21 1 1 4 2145 1 1 28 VAL HG22 H 6.153 19.021 7.982 1.00 . A A . 28 VAL HG22 1 1 4 2146 1 1 28 VAL HG23 H 5.795 17.277 7.993 1.00 . A A . 28 VAL HG23 1 1 4 2147 1 1 28 VAL N N 6.969 17.661 10.539 1.00 . A A . 28 VAL N 1 1 4 2148 1 1 28 VAL O O 6.052 19.727 12.731 1.00 . A A . 28 VAL O 1 1 4 2149 1 1 29 CYS C C 4.925 17.929 14.677 1.00 . A A . 29 CYS C 1 1 4 2150 1 1 29 CYS CA C 3.849 18.307 13.657 1.00 . A A . 29 CYS CA 1 1 4 2151 1 1 29 CYS CB C 2.598 17.438 13.797 1.00 . A A . 29 CYS CB 1 1 4 2152 1 1 29 CYS H H 3.967 17.565 11.714 1.00 . A A . 29 CYS H 1 1 4 2153 1 1 29 CYS HA H 3.540 19.345 13.788 1.00 . A A . 29 CYS HA 1 1 4 2154 1 1 29 CYS HB2 H 2.245 17.497 14.827 1.00 . A A . 29 CYS HB2 1 1 4 2155 1 1 29 CYS HB3 H 1.812 17.852 13.166 1.00 . A A . 29 CYS HB3 1 1 4 2156 1 1 29 CYS N N 4.425 18.208 12.327 1.00 . A A . 29 CYS N 1 1 4 2157 1 1 29 CYS O O 5.115 18.626 15.672 1.00 . A A . 29 CYS O 1 1 4 2158 1 1 29 CYS SG S 2.835 15.677 13.359 1.00 . A A . 29 CYS SG 1 1 4 2159 1 1 30 GLY C C 6.269 15.009 15.910 1.00 . A A . 30 GLY C 1 1 4 2160 1 1 30 GLY CA C 6.653 16.346 15.274 1.00 . A A . 30 GLY CA 1 1 4 2161 1 1 30 GLY H H 5.441 16.264 13.581 1.00 . A A . 30 GLY H 1 1 4 2162 1 1 30 GLY HA2 H 7.579 16.231 14.710 1.00 . A A . 30 GLY HA2 1 1 4 2163 1 1 30 GLY HA3 H 6.844 17.083 16.053 1.00 . A A . 30 GLY HA3 1 1 4 2164 1 1 30 GLY N N 5.601 16.826 14.393 1.00 . A A . 30 GLY N 1 1 4 2165 1 1 30 GLY O O 7.124 14.300 16.439 1.00 . A A . 30 GLY O 1 1 4 2166 1 1 31 ALA C C 5.368 12.305 15.961 1.00 . A A . 31 ALA C 1 1 4 2167 1 1 31 ALA CA C 4.472 13.465 16.400 1.00 . A A . 31 ALA CA 1 1 4 2168 1 1 31 ALA CB C 3.016 13.271 15.975 1.00 . A A . 31 ALA CB 1 1 4 2169 1 1 31 ALA H H 4.292 15.287 15.405 1.00 . A A . 31 ALA H 1 1 4 2170 1 1 31 ALA HA H 4.512 13.553 17.486 1.00 . A A . 31 ALA HA 1 1 4 2171 1 1 31 ALA HB1 H 2.977 12.632 15.092 1.00 . A A . 31 ALA HB1 1 1 4 2172 1 1 31 ALA HB2 H 2.459 12.803 16.788 1.00 . A A . 31 ALA HB2 1 1 4 2173 1 1 31 ALA HB3 H 2.573 14.239 15.741 1.00 . A A . 31 ALA HB3 1 1 4 2174 1 1 31 ALA N N 4.981 14.705 15.838 1.00 . A A . 31 ALA N 1 1 4 2175 1 1 31 ALA O O 6.113 12.425 14.990 1.00 . A A . 31 ALA O 1 1 4 2176 1 1 32 SER C C 5.579 9.399 15.084 1.00 . A A . 32 SER C 1 1 4 2177 1 1 32 SER CA C 6.056 10.028 16.395 1.00 . A A . 32 SER CA 1 1 4 2178 1 1 32 SER CB C 5.980 9.008 17.532 1.00 . A A . 32 SER CB 1 1 4 2179 1 1 32 SER H H 4.656 11.119 17.485 1.00 . A A . 32 SER H 1 1 4 2180 1 1 32 SER HA H 7.082 10.385 16.297 1.00 . A A . 32 SER HA 1 1 4 2181 1 1 32 SER HB2 H 6.644 8.171 17.315 1.00 . A A . 32 SER HB2 1 1 4 2182 1 1 32 SER HB3 H 6.336 9.465 18.454 1.00 . A A . 32 SER HB3 1 1 4 2183 1 1 32 SER HG H 3.997 9.144 17.299 1.00 . A A . 32 SER HG 1 1 4 2184 1 1 32 SER N N 5.265 11.208 16.697 1.00 . A A . 32 SER N 1 1 4 2185 1 1 32 SER O O 4.576 9.827 14.515 1.00 . A A . 32 SER O 1 1 4 2186 1 1 32 SER OG O 4.654 8.522 17.725 1.00 . A A . 32 SER OG 1 1 4 2187 1 1 33 LYS C C 5.020 6.554 13.721 1.00 . A A . 33 LYS C 1 1 4 2188 1 1 33 LYS CA C 5.984 7.700 13.411 1.00 . A A . 33 LYS CA 1 1 4 2189 1 1 33 LYS CB C 7.254 7.255 12.684 1.00 . A A . 33 LYS CB 1 1 4 2190 1 1 33 LYS CD C 7.853 5.850 14.692 1.00 . A A . 33 LYS CD 1 1 4 2191 1 1 33 LYS CE C 8.361 4.490 15.172 1.00 . A A . 33 LYS CE 1 1 4 2192 1 1 33 LYS CG C 7.709 5.876 13.169 1.00 . A A . 33 LYS CG 1 1 4 2193 1 1 33 LYS H H 7.133 8.050 15.113 1.00 . A A . 33 LYS H 1 1 4 2194 1 1 33 LYS HA H 5.475 8.413 12.763 1.00 . A A . 33 LYS HA 1 1 4 2195 1 1 33 LYS HB2 H 7.073 7.223 11.610 1.00 . A A . 33 LYS HB2 1 1 4 2196 1 1 33 LYS HB3 H 8.048 7.983 12.852 1.00 . A A . 33 LYS HB3 1 1 4 2197 1 1 33 LYS HD2 H 8.543 6.633 15.009 1.00 . A A . 33 LYS HD2 1 1 4 2198 1 1 33 LYS HD3 H 6.890 6.067 15.156 1.00 . A A . 33 LYS HD3 1 1 4 2199 1 1 33 LYS HE2 H 8.886 3.984 14.362 1.00 . A A . 33 LYS HE2 1 1 4 2200 1 1 33 LYS HE3 H 9.081 4.628 15.979 1.00 . A A . 33 LYS HE3 1 1 4 2201 1 1 33 LYS HG2 H 6.989 5.120 12.856 1.00 . A A . 33 LYS HG2 1 1 4 2202 1 1 33 LYS HG3 H 8.662 5.619 12.706 1.00 . A A . 33 LYS HG3 1 1 4 2203 1 1 33 LYS HZ1 H 6.416 3.753 15.054 1.00 . A A . 33 LYS HZ1 1 1 4 2204 1 1 33 LYS HZ2 H 7.473 2.667 15.650 1.00 . A A . 33 LYS HZ2 1 1 4 2205 1 1 33 LYS N N 6.319 8.392 14.644 1.00 . A A . 33 LYS N 1 1 4 2206 1 1 33 LYS NZ N 7.236 3.652 15.642 1.00 . A A . 33 LYS NZ 1 1 4 2207 1 1 33 LYS O O 4.813 5.669 12.892 1.00 . A A . 33 LYS O 1 1 4 2208 1 1 34 ASP C C 2.110 5.952 14.865 1.00 . A A . 34 ASP C 1 1 4 2209 1 1 34 ASP CA C 3.515 5.584 15.347 1.00 . A A . 34 ASP CA 1 1 4 2210 1 1 34 ASP CB C 3.476 5.478 16.873 1.00 . A A . 34 ASP CB 1 1 4 2211 1 1 34 ASP CG C 2.781 6.639 17.586 1.00 . A A . 34 ASP CG 1 1 4 2212 1 1 34 ASP H H 4.626 7.329 15.587 1.00 . A A . 34 ASP H 1 1 4 2213 1 1 34 ASP HA H 3.879 4.657 14.905 1.00 . A A . 34 ASP HA 1 1 4 2214 1 1 34 ASP HB2 H 2.973 4.550 17.145 1.00 . A A . 34 ASP HB2 1 1 4 2215 1 1 34 ASP HB3 H 4.500 5.405 17.244 1.00 . A A . 34 ASP HB3 1 1 4 2216 1 1 34 ASP HD2 H 1.506 6.535 18.969 1.00 . A A . 34 ASP HD2 1 1 4 2217 1 1 34 ASP N N 4.453 6.607 14.918 1.00 . A A . 34 ASP N 1 1 4 2218 1 1 34 ASP O O 1.248 5.084 14.734 1.00 . A A . 34 ASP O 1 1 4 2219 1 1 34 ASP OD1 O 2.529 7.697 16.989 1.00 . A A . 34 ASP OD1 1 1 4 2220 1 1 34 ASP OD2 O 2.489 6.424 18.824 1.00 . A A . 34 ASP OD2 1 1 4 2221 1 1 35 ALA C C 0.533 7.518 12.635 1.00 . A A . 35 ALA C 1 1 4 2222 1 1 35 ALA CA C 0.639 7.732 14.147 1.00 . A A . 35 ALA CA 1 1 4 2223 1 1 35 ALA CB C 0.482 9.202 14.540 1.00 . A A . 35 ALA CB 1 1 4 2224 1 1 35 ALA H H 2.629 7.938 14.722 1.00 . A A . 35 ALA H 1 1 4 2225 1 1 35 ALA HA H -0.139 7.151 14.643 1.00 . A A . 35 ALA HA 1 1 4 2226 1 1 35 ALA HB1 H -0.275 9.668 13.910 1.00 . A A . 35 ALA HB1 1 1 4 2227 1 1 35 ALA HB2 H 0.177 9.268 15.584 1.00 . A A . 35 ALA HB2 1 1 4 2228 1 1 35 ALA HB3 H 1.433 9.716 14.406 1.00 . A A . 35 ALA HB3 1 1 4 2229 1 1 35 ALA N N 1.923 7.239 14.613 1.00 . A A . 35 ALA N 1 1 4 2230 1 1 35 ALA O O -0.523 7.745 12.046 1.00 . A A . 35 ALA O 1 1 4 2231 1 1 36 PHE C C 1.126 5.452 10.286 1.00 . A A . 36 PHE C 1 1 4 2232 1 1 36 PHE CA C 1.685 6.836 10.621 1.00 . A A . 36 PHE CA 1 1 4 2233 1 1 36 PHE CB C 3.156 6.894 10.204 1.00 . A A . 36 PHE CB 1 1 4 2234 1 1 36 PHE CD1 C 3.577 9.188 11.116 1.00 . A A . 36 PHE CD1 1 1 4 2235 1 1 36 PHE CD2 C 4.343 8.702 8.942 1.00 . A A . 36 PHE CD2 1 1 4 2236 1 1 36 PHE CE1 C 4.094 10.506 11.003 1.00 . A A . 36 PHE CE1 1 1 4 2237 1 1 36 PHE CE2 C 4.861 10.019 8.829 1.00 . A A . 36 PHE CE2 1 1 4 2238 1 1 36 PHE CG C 3.713 8.314 10.082 1.00 . A A . 36 PHE CG 1 1 4 2239 1 1 36 PHE CZ C 4.725 10.893 9.862 1.00 . A A . 36 PHE CZ 1 1 4 2240 1 1 36 PHE H H 2.494 6.900 12.540 1.00 . A A . 36 PHE H 1 1 4 2241 1 1 36 PHE HA H 1.072 7.599 10.142 1.00 . A A . 36 PHE HA 1 1 4 2242 1 1 36 PHE HB2 H 3.752 6.342 10.931 1.00 . A A . 36 PHE HB2 1 1 4 2243 1 1 36 PHE HB3 H 3.271 6.386 9.246 1.00 . A A . 36 PHE HB3 1 1 4 2244 1 1 36 PHE HD1 H 3.072 8.877 12.030 1.00 . A A . 36 PHE HD1 1 1 4 2245 1 1 36 PHE HD2 H 4.452 8.001 8.114 1.00 . A A . 36 PHE HD2 1 1 4 2246 1 1 36 PHE HE1 H 3.985 11.206 11.830 1.00 . A A . 36 PHE HE1 1 1 4 2247 1 1 36 PHE HE2 H 5.366 10.330 7.915 1.00 . A A . 36 PHE HE2 1 1 4 2248 1 1 36 PHE HZ H 5.122 11.905 9.776 1.00 . A A . 36 PHE HZ 1 1 4 2249 1 1 36 PHE N N 1.640 7.082 12.053 1.00 . A A . 36 PHE N 1 1 4 2250 1 1 36 PHE O O 1.413 4.478 10.980 1.00 . A A . 36 PHE O 1 1 4 2251 1 1 37 GLU C C -0.550 4.206 7.283 1.00 . A A . 37 GLU C 1 1 4 2252 1 1 37 GLU CA C -0.264 4.161 8.786 1.00 . A A . 37 GLU CA 1 1 4 2253 1 1 37 GLU CB C -1.538 3.861 9.577 1.00 . A A . 37 GLU CB 1 1 4 2254 1 1 37 GLU CD C -2.367 2.084 11.163 1.00 . A A . 37 GLU CD 1 1 4 2255 1 1 37 GLU CG C -1.695 2.358 9.816 1.00 . A A . 37 GLU CG 1 1 4 2256 1 1 37 GLU H H 0.110 6.207 8.663 1.00 . A A . 37 GLU H 1 1 4 2257 1 1 37 GLU HA H 0.478 3.392 8.999 1.00 . A A . 37 GLU HA 1 1 4 2258 1 1 37 GLU HB2 H -1.509 4.384 10.533 1.00 . A A . 37 GLU HB2 1 1 4 2259 1 1 37 GLU HB3 H -2.406 4.238 9.035 1.00 . A A . 37 GLU HB3 1 1 4 2260 1 1 37 GLU HE2 H -2.458 0.895 12.621 1.00 . A A . 37 GLU HE2 1 1 4 2261 1 1 37 GLU HG2 H -2.287 1.918 9.015 1.00 . A A . 37 GLU HG2 1 1 4 2262 1 1 37 GLU HG3 H -0.716 1.879 9.790 1.00 . A A . 37 GLU HG3 1 1 4 2263 1 1 37 GLU N N 0.338 5.410 9.221 1.00 . A A . 37 GLU N 1 1 4 2264 1 1 37 GLU O O -0.751 5.278 6.718 1.00 . A A . 37 GLU O 1 1 4 2265 1 1 37 GLU OE1 O -3.287 2.816 11.558 1.00 . A A . 37 GLU OE1 1 1 4 2266 1 1 37 GLU OE2 O -1.902 1.067 11.808 1.00 . A A . 37 GLU OE2 1 1 4 2267 1 1 38 LYS C C -1.994 3.817 4.882 1.00 . A A . 38 LYS C 1 1 4 2268 1 1 38 LYS CA C -0.814 2.917 5.254 1.00 . A A . 38 LYS CA 1 1 4 2269 1 1 38 LYS CB C -1.009 1.453 4.855 1.00 . A A . 38 LYS CB 1 1 4 2270 1 1 38 LYS CD C -1.477 -0.139 2.955 1.00 . A A . 38 LYS CD 1 1 4 2271 1 1 38 LYS CE C -1.917 -0.260 1.495 1.00 . A A . 38 LYS CE 1 1 4 2272 1 1 38 LYS CG C -1.330 1.329 3.364 1.00 . A A . 38 LYS CG 1 1 4 2273 1 1 38 LYS H H -0.392 2.158 7.147 1.00 . A A . 38 LYS H 1 1 4 2274 1 1 38 LYS HA H 0.073 3.277 4.733 1.00 . A A . 38 LYS HA 1 1 4 2275 1 1 38 LYS HB2 H -0.107 0.886 5.085 1.00 . A A . 38 LYS HB2 1 1 4 2276 1 1 38 LYS HB3 H -1.817 1.016 5.442 1.00 . A A . 38 LYS HB3 1 1 4 2277 1 1 38 LYS HD2 H -0.529 -0.656 3.098 1.00 . A A . 38 LYS HD2 1 1 4 2278 1 1 38 LYS HD3 H -2.207 -0.628 3.601 1.00 . A A . 38 LYS HD3 1 1 4 2279 1 1 38 LYS HE2 H -2.618 -1.087 1.388 1.00 . A A . 38 LYS HE2 1 1 4 2280 1 1 38 LYS HE3 H -2.443 0.646 1.191 1.00 . A A . 38 LYS HE3 1 1 4 2281 1 1 38 LYS HG2 H -2.252 1.866 3.141 1.00 . A A . 38 LYS HG2 1 1 4 2282 1 1 38 LYS HG3 H -0.539 1.796 2.778 1.00 . A A . 38 LYS HG3 1 1 4 2283 1 1 38 LYS HZ1 H -0.885 -1.256 -0.017 1.00 . A A . 38 LYS HZ1 1 1 4 2284 1 1 38 LYS HZ2 H -0.543 0.335 0.045 1.00 . A A . 38 LYS HZ2 1 1 4 2285 1 1 38 LYS N N -0.558 3.026 6.680 1.00 . A A . 38 LYS N 1 1 4 2286 1 1 38 LYS NZ N -0.745 -0.477 0.618 1.00 . A A . 38 LYS NZ 1 1 4 2287 1 1 38 LYS O O -2.963 3.917 5.632 1.00 . A A . 38 LYS O 1 1 4 2288 1 1 39 GLN C C -2.845 5.468 1.722 1.00 . A A . 39 GLN C 1 1 4 2289 1 1 39 GLN CA C -2.918 5.338 3.244 1.00 . A A . 39 GLN CA 1 1 4 2290 1 1 39 GLN CB C -2.821 6.710 3.916 1.00 . A A . 39 GLN CB 1 1 4 2291 1 1 39 GLN CD C -4.428 7.371 5.744 1.00 . A A . 39 GLN CD 1 1 4 2292 1 1 39 GLN CG C -4.213 7.263 4.233 1.00 . A A . 39 GLN CG 1 1 4 2293 1 1 39 GLN H H -1.081 4.364 3.120 1.00 . A A . 39 GLN H 1 1 4 2294 1 1 39 GLN HA H -3.855 4.865 3.532 1.00 . A A . 39 GLN HA 1 1 4 2295 1 1 39 GLN HB2 H -2.240 6.630 4.835 1.00 . A A . 39 GLN HB2 1 1 4 2296 1 1 39 GLN HB3 H -2.291 7.403 3.262 1.00 . A A . 39 GLN HB3 1 1 4 2297 1 1 39 GLN HE21 H -6.339 7.933 5.384 1.00 . A A . 39 GLN HE21 1 1 4 2298 1 1 39 GLN HE22 H -5.894 7.847 7.056 1.00 . A A . 39 GLN HE22 1 1 4 2299 1 1 39 GLN HG2 H -4.330 8.246 3.775 1.00 . A A . 39 GLN HG2 1 1 4 2300 1 1 39 GLN HG3 H -4.973 6.615 3.799 1.00 . A A . 39 GLN HG3 1 1 4 2301 1 1 39 GLN N N -1.873 4.450 3.725 1.00 . A A . 39 GLN N 1 1 4 2302 1 1 39 GLN NE2 N -5.655 7.748 6.090 1.00 . A A . 39 GLN NE2 1 1 4 2303 1 1 39 GLN O O -2.180 6.361 1.201 1.00 . A A . 39 GLN O 1 1 4 2304 1 1 39 GLN OE1 O -3.539 7.128 6.544 1.00 . A A . 39 GLN OE1 1 1 5 2305 1 1 1 MET C C 6.519 0.973 0.608 1.00 . A A . 1 MET C 1 1 5 2306 1 1 1 MET CA C 6.868 0.297 1.935 1.00 . A A . 1 MET CA 1 1 5 2307 1 1 1 MET CB C 8.289 0.687 2.348 1.00 . A A . 1 MET CB 1 1 5 2308 1 1 1 MET CE C 11.257 -0.376 4.191 1.00 . A A . 1 MET CE 1 1 5 2309 1 1 1 MET CG C 8.614 0.171 3.750 1.00 . A A . 1 MET CG 1 1 5 2310 1 1 1 MET H1 H 5.995 -1.559 2.297 1.00 . A A . 1 MET H1 1 1 5 2311 1 1 1 MET HA H 6.141 0.580 2.698 1.00 . A A . 1 MET HA 1 1 5 2312 1 1 1 MET HB2 H 9.003 0.280 1.632 1.00 . A A . 1 MET HB2 1 1 5 2313 1 1 1 MET HB3 H 8.394 1.772 2.322 1.00 . A A . 1 MET HB3 1 1 5 2314 1 1 1 MET HE1 H 11.768 -1.003 4.922 1.00 . A A . 1 MET HE1 1 1 5 2315 1 1 1 MET HE2 H 11.911 -0.208 3.336 1.00 . A A . 1 MET HE2 1 1 5 2316 1 1 1 MET HE3 H 11.004 0.581 4.647 1.00 . A A . 1 MET HE3 1 1 5 2317 1 1 1 MET HG2 H 9.039 0.973 4.353 1.00 . A A . 1 MET HG2 1 1 5 2318 1 1 1 MET HG3 H 7.700 -0.151 4.249 1.00 . A A . 1 MET HG3 1 1 5 2319 1 1 1 MET N N 6.774 -1.148 1.824 1.00 . A A . 1 MET N 1 1 5 2320 1 1 1 MET O O 7.239 0.825 -0.378 1.00 . A A . 1 MET O 1 1 5 2321 1 1 1 MET SD S 9.764 -1.191 3.649 1.00 . A A . 1 MET SD 1 1 5 2322 1 1 2 ASP C C 4.825 3.893 -0.256 1.00 . A A . 2 ASP C 1 1 5 2323 1 1 2 ASP CA C 4.957 2.399 -0.566 1.00 . A A . 2 ASP CA 1 1 5 2324 1 1 2 ASP CB C 3.587 1.888 -1.015 1.00 . A A . 2 ASP CB 1 1 5 2325 1 1 2 ASP CG C 3.262 2.123 -2.492 1.00 . A A . 2 ASP CG 1 1 5 2326 1 1 2 ASP H H 4.830 1.817 1.430 1.00 . A A . 2 ASP H 1 1 5 2327 1 1 2 ASP HA H 5.713 2.196 -1.323 1.00 . A A . 2 ASP HA 1 1 5 2328 1 1 2 ASP HB2 H 3.532 0.818 -0.813 1.00 . A A . 2 ASP HB2 1 1 5 2329 1 1 2 ASP HB3 H 2.819 2.367 -0.409 1.00 . A A . 2 ASP HB3 1 1 5 2330 1 1 2 ASP HD2 H 1.887 2.571 -3.698 1.00 . A A . 2 ASP HD2 1 1 5 2331 1 1 2 ASP N N 5.411 1.701 0.624 1.00 . A A . 2 ASP N 1 1 5 2332 1 1 2 ASP O O 5.478 4.721 -0.889 1.00 . A A . 2 ASP O 1 1 5 2333 1 1 2 ASP OD1 O 4.163 2.191 -3.342 1.00 . A A . 2 ASP OD1 1 1 5 2334 1 1 2 ASP OD2 O 2.006 2.241 -2.762 1.00 . A A . 2 ASP OD2 1 1 5 2335 1 1 3 ILE C C 3.395 5.610 2.606 1.00 . A A . 3 ILE C 1 1 5 2336 1 1 3 ILE CA C 3.750 5.568 1.118 1.00 . A A . 3 ILE CA 1 1 5 2337 1 1 3 ILE CB C 2.702 6.223 0.216 1.00 . A A . 3 ILE CB 1 1 5 2338 1 1 3 ILE CD1 C 2.268 7.292 -2.026 1.00 . A A . 3 ILE CD1 1 1 5 2339 1 1 3 ILE CG1 C 3.299 6.581 -1.146 1.00 . A A . 3 ILE CG1 1 1 5 2340 1 1 3 ILE CG2 C 2.071 7.437 0.902 1.00 . A A . 3 ILE CG2 1 1 5 2341 1 1 3 ILE H H 3.450 3.510 1.227 1.00 . A A . 3 ILE H 1 1 5 2342 1 1 3 ILE HA H 4.686 6.108 0.971 1.00 . A A . 3 ILE HA 1 1 5 2343 1 1 3 ILE HB H 1.905 5.502 0.040 1.00 . A A . 3 ILE HB 1 1 5 2344 1 1 3 ILE HD11 H 2.451 8.366 -2.005 1.00 . A A . 3 ILE HD11 1 1 5 2345 1 1 3 ILE HD12 H 2.352 6.929 -3.050 1.00 . A A . 3 ILE HD12 1 1 5 2346 1 1 3 ILE HD13 H 1.265 7.087 -1.649 1.00 . A A . 3 ILE HD13 1 1 5 2347 1 1 3 ILE HG12 H 4.169 7.222 -1.010 1.00 . A A . 3 ILE HG12 1 1 5 2348 1 1 3 ILE HG13 H 3.645 5.675 -1.645 1.00 . A A . 3 ILE HG13 1 1 5 2349 1 1 3 ILE HG21 H 1.272 7.104 1.565 1.00 . A A . 3 ILE HG21 1 1 5 2350 1 1 3 ILE HG22 H 2.830 7.962 1.483 1.00 . A A . 3 ILE HG22 1 1 5 2351 1 1 3 ILE HG23 H 1.662 8.108 0.148 1.00 . A A . 3 ILE HG23 1 1 5 2352 1 1 3 ILE N N 3.976 4.189 0.717 1.00 . A A . 3 ILE N 1 1 5 2353 1 1 3 ILE O O 2.696 4.748 3.135 1.00 . A A . 3 ILE O 1 1 5 2354 1 1 4 TYR C C 3.101 8.224 4.946 1.00 . A A . 4 TYR C 1 1 5 2355 1 1 4 TYR CA C 3.658 6.830 4.694 1.00 . A A . 4 TYR CA 1 1 5 2356 1 1 4 TYR CB C 4.958 6.620 5.464 1.00 . A A . 4 TYR CB 1 1 5 2357 1 1 4 TYR CD1 C 4.667 4.275 6.340 1.00 . A A . 4 TYR CD1 1 1 5 2358 1 1 4 TYR CD2 C 6.499 4.732 4.819 1.00 . A A . 4 TYR CD2 1 1 5 2359 1 1 4 TYR CE1 C 5.061 2.933 6.413 1.00 . A A . 4 TYR CE1 1 1 5 2360 1 1 4 TYR CE2 C 6.894 3.391 4.892 1.00 . A A . 4 TYR CE2 1 1 5 2361 1 1 4 TYR CG C 5.385 5.173 5.542 1.00 . A A . 4 TYR CG 1 1 5 2362 1 1 4 TYR CZ C 6.175 2.492 5.689 1.00 . A A . 4 TYR CZ 1 1 5 2363 1 1 4 TYR H H 4.469 7.328 2.796 1.00 . A A . 4 TYR H 1 1 5 2364 1 1 4 TYR HA H 2.927 6.093 5.026 1.00 . A A . 4 TYR HA 1 1 5 2365 1 1 4 TYR HB2 H 5.749 7.190 4.972 1.00 . A A . 4 TYR HB2 1 1 5 2366 1 1 4 TYR HB3 H 4.830 7.000 6.477 1.00 . A A . 4 TYR HB3 1 1 5 2367 1 1 4 TYR HD1 H 3.807 4.616 6.898 1.00 . A A . 4 TYR HD1 1 1 5 2368 1 1 4 TYR HD2 H 7.053 5.425 4.204 1.00 . A A . 4 TYR HD2 1 1 5 2369 1 1 4 TYR HE1 H 4.507 2.240 7.027 1.00 . A A . 4 TYR HE1 1 1 5 2370 1 1 4 TYR HE2 H 7.753 3.050 4.333 1.00 . A A . 4 TYR HE2 1 1 5 2371 1 1 4 TYR HH H 6.559 0.842 6.657 1.00 . A A . 4 TYR HH 1 1 5 2372 1 1 4 TYR N N 3.900 6.648 3.277 1.00 . A A . 4 TYR N 1 1 5 2373 1 1 4 TYR O O 3.871 9.184 4.930 1.00 . A A . 4 TYR O 1 1 5 2374 1 1 4 TYR OH O 6.560 1.184 5.761 1.00 . A A . 4 TYR OH 1 1 5 2375 1 1 5 VAL C C 0.741 9.669 6.892 1.00 . A A . 5 VAL C 1 1 5 2376 1 1 5 VAL CA C 1.165 9.594 5.424 1.00 . A A . 5 VAL CA 1 1 5 2377 1 1 5 VAL CB C 0.002 9.804 4.454 1.00 . A A . 5 VAL CB 1 1 5 2378 1 1 5 VAL CG1 C -0.589 11.208 4.602 1.00 . A A . 5 VAL CG1 1 1 5 2379 1 1 5 VAL CG2 C 0.438 9.542 3.011 1.00 . A A . 5 VAL CG2 1 1 5 2380 1 1 5 VAL H H 1.179 7.525 5.183 1.00 . A A . 5 VAL H 1 1 5 2381 1 1 5 VAL HA H 1.908 10.370 5.234 1.00 . A A . 5 VAL HA 1 1 5 2382 1 1 5 VAL HB H -0.778 9.085 4.705 1.00 . A A . 5 VAL HB 1 1 5 2383 1 1 5 VAL HG11 H -0.078 11.891 3.922 1.00 . A A . 5 VAL HG11 1 1 5 2384 1 1 5 VAL HG12 H -1.651 11.182 4.360 1.00 . A A . 5 VAL HG12 1 1 5 2385 1 1 5 VAL HG13 H -0.457 11.551 5.628 1.00 . A A . 5 VAL HG13 1 1 5 2386 1 1 5 VAL HG21 H 0.357 8.476 2.795 1.00 . A A . 5 VAL HG21 1 1 5 2387 1 1 5 VAL HG22 H -0.206 10.100 2.330 1.00 . A A . 5 VAL HG22 1 1 5 2388 1 1 5 VAL HG23 H 1.471 9.863 2.879 1.00 . A A . 5 VAL HG23 1 1 5 2389 1 1 5 VAL N N 1.798 8.311 5.172 1.00 . A A . 5 VAL N 1 1 5 2390 1 1 5 VAL O O 0.095 8.754 7.403 1.00 . A A . 5 VAL O 1 1 5 2391 1 1 6 CYS C C -0.733 11.095 9.048 1.00 . A A . 6 CYS C 1 1 5 2392 1 1 6 CYS CA C 0.787 10.972 8.929 1.00 . A A . 6 CYS CA 1 1 5 2393 1 1 6 CYS CB C 1.504 12.193 9.509 1.00 . A A . 6 CYS CB 1 1 5 2394 1 1 6 CYS H H 1.646 11.505 7.107 1.00 . A A . 6 CYS H 1 1 5 2395 1 1 6 CYS HA H 1.147 10.096 9.469 1.00 . A A . 6 CYS HA 1 1 5 2396 1 1 6 CYS HB2 H 2.532 12.200 9.143 1.00 . A A . 6 CYS HB2 1 1 5 2397 1 1 6 CYS HB3 H 1.025 13.094 9.128 1.00 . A A . 6 CYS HB3 1 1 5 2398 1 1 6 CYS N N 1.121 10.767 7.530 1.00 . A A . 6 CYS N 1 1 5 2399 1 1 6 CYS O O -1.392 11.601 8.139 1.00 . A A . 6 CYS O 1 1 5 2400 1 1 6 CYS SG S 1.532 12.271 11.337 1.00 . A A . 6 CYS SG 1 1 5 2401 1 1 7 THR C C -2.999 11.739 11.474 1.00 . A A . 7 THR C 1 1 5 2402 1 1 7 THR CA C -2.678 10.675 10.423 1.00 . A A . 7 THR CA 1 1 5 2403 1 1 7 THR CB C -3.140 9.271 10.818 1.00 . A A . 7 THR CB 1 1 5 2404 1 1 7 THR CG2 C -2.694 8.204 9.817 1.00 . A A . 7 THR CG2 1 1 5 2405 1 1 7 THR H H -0.705 10.214 10.908 1.00 . A A . 7 THR H 1 1 5 2406 1 1 7 THR HA H -3.177 10.975 9.501 1.00 . A A . 7 THR HA 1 1 5 2407 1 1 7 THR HB H -4.220 9.242 10.964 1.00 . A A . 7 THR HB 1 1 5 2408 1 1 7 THR HG1 H -2.618 9.632 12.717 1.00 . A A . 7 THR HG1 1 1 5 2409 1 1 7 THR HG21 H -2.682 7.229 10.305 1.00 . A A . 7 THR HG21 1 1 5 2410 1 1 7 THR HG22 H -3.388 8.181 8.978 1.00 . A A . 7 THR HG22 1 1 5 2411 1 1 7 THR HG23 H -1.694 8.441 9.455 1.00 . A A . 7 THR HG23 1 1 5 2412 1 1 7 THR N N -1.248 10.624 10.174 1.00 . A A . 7 THR N 1 1 5 2413 1 1 7 THR O O -4.091 11.747 12.041 1.00 . A A . 7 THR O 1 1 5 2414 1 1 7 THR OG1 O -2.390 8.978 11.995 1.00 . A A . 7 THR OG1 1 1 5 2415 1 1 8 VAL C C -2.271 15.020 11.947 1.00 . A A . 8 VAL C 1 1 5 2416 1 1 8 VAL CA C -2.193 13.677 12.677 1.00 . A A . 8 VAL CA 1 1 5 2417 1 1 8 VAL CB C -1.066 13.622 13.709 1.00 . A A . 8 VAL CB 1 1 5 2418 1 1 8 VAL CG1 C -1.086 14.859 14.609 1.00 . A A . 8 VAL CG1 1 1 5 2419 1 1 8 VAL CG2 C -1.145 12.339 14.539 1.00 . A A . 8 VAL CG2 1 1 5 2420 1 1 8 VAL H H -1.143 12.597 11.238 1.00 . A A . 8 VAL H 1 1 5 2421 1 1 8 VAL HA H -3.137 13.505 13.196 1.00 . A A . 8 VAL HA 1 1 5 2422 1 1 8 VAL HB H -0.119 13.614 13.172 1.00 . A A . 8 VAL HB 1 1 5 2423 1 1 8 VAL HG11 H -1.177 14.549 15.651 1.00 . A A . 8 VAL HG11 1 1 5 2424 1 1 8 VAL HG12 H -0.162 15.421 14.476 1.00 . A A . 8 VAL HG12 1 1 5 2425 1 1 8 VAL HG13 H -1.936 15.488 14.343 1.00 . A A . 8 VAL HG13 1 1 5 2426 1 1 8 VAL HG21 H -1.333 11.491 13.881 1.00 . A A . 8 VAL HG21 1 1 5 2427 1 1 8 VAL HG22 H -0.203 12.188 15.066 1.00 . A A . 8 VAL HG22 1 1 5 2428 1 1 8 VAL HG23 H -1.957 12.423 15.262 1.00 . A A . 8 VAL HG23 1 1 5 2429 1 1 8 VAL N N -2.028 12.610 11.703 1.00 . A A . 8 VAL N 1 1 5 2430 1 1 8 VAL O O -3.181 15.811 12.191 1.00 . A A . 8 VAL O 1 1 5 2431 1 1 9 CYS C C -1.632 16.152 8.854 1.00 . A A . 9 CYS C 1 1 5 2432 1 1 9 CYS CA C -1.251 16.469 10.301 1.00 . A A . 9 CYS CA 1 1 5 2433 1 1 9 CYS CB C 0.122 17.136 10.397 1.00 . A A . 9 CYS CB 1 1 5 2434 1 1 9 CYS H H -0.568 14.587 10.875 1.00 . A A . 9 CYS H 1 1 5 2435 1 1 9 CYS HA H -1.975 17.148 10.752 1.00 . A A . 9 CYS HA 1 1 5 2436 1 1 9 CYS HB2 H 0.179 17.927 9.649 1.00 . A A . 9 CYS HB2 1 1 5 2437 1 1 9 CYS HB3 H 0.211 17.613 11.373 1.00 . A A . 9 CYS HB3 1 1 5 2438 1 1 9 CYS N N -1.304 15.235 11.067 1.00 . A A . 9 CYS N 1 1 5 2439 1 1 9 CYS O O -2.102 17.025 8.126 1.00 . A A . 9 CYS O 1 1 5 2440 1 1 9 CYS SG S 1.542 16.006 10.164 1.00 . A A . 9 CYS SG 1 1 5 2441 1 1 10 GLY C C -0.510 14.579 6.216 1.00 . A A . 10 GLY C 1 1 5 2442 1 1 10 GLY CA C -1.730 14.457 7.131 1.00 . A A . 10 GLY CA 1 1 5 2443 1 1 10 GLY H H -1.033 14.195 9.076 1.00 . A A . 10 GLY H 1 1 5 2444 1 1 10 GLY HA2 H -2.068 13.421 7.155 1.00 . A A . 10 GLY HA2 1 1 5 2445 1 1 10 GLY HA3 H -2.550 15.051 6.731 1.00 . A A . 10 GLY HA3 1 1 5 2446 1 1 10 GLY N N -1.415 14.900 8.478 1.00 . A A . 10 GLY N 1 1 5 2447 1 1 10 GLY O O -0.605 14.528 4.991 1.00 . A A . 10 GLY O 1 1 5 2448 1 1 11 TYR C C 2.065 13.717 5.153 1.00 . A A . 11 TYR C 1 1 5 2449 1 1 11 TYR CA C 1.902 14.880 6.121 1.00 . A A . 11 TYR CA 1 1 5 2450 1 1 11 TYR CB C 3.062 14.926 7.112 1.00 . A A . 11 TYR CB 1 1 5 2451 1 1 11 TYR CD1 C 4.546 16.314 5.621 1.00 . A A . 11 TYR CD1 1 1 5 2452 1 1 11 TYR CD2 C 5.484 14.360 6.708 1.00 . A A . 11 TYR CD2 1 1 5 2453 1 1 11 TYR CE1 C 5.784 16.574 5.020 1.00 . A A . 11 TYR CE1 1 1 5 2454 1 1 11 TYR CE2 C 6.722 14.620 6.107 1.00 . A A . 11 TYR CE2 1 1 5 2455 1 1 11 TYR CG C 4.397 15.207 6.465 1.00 . A A . 11 TYR CG 1 1 5 2456 1 1 11 TYR CZ C 6.873 15.728 5.264 1.00 . A A . 11 TYR CZ 1 1 5 2457 1 1 11 TYR H H 0.679 14.780 7.855 1.00 . A A . 11 TYR H 1 1 5 2458 1 1 11 TYR HA H 1.884 15.811 5.554 1.00 . A A . 11 TYR HA 1 1 5 2459 1 1 11 TYR HB2 H 2.861 15.705 7.847 1.00 . A A . 11 TYR HB2 1 1 5 2460 1 1 11 TYR HB3 H 3.120 13.966 7.625 1.00 . A A . 11 TYR HB3 1 1 5 2461 1 1 11 TYR HD1 H 3.707 16.968 5.434 1.00 . A A . 11 TYR HD1 1 1 5 2462 1 1 11 TYR HD2 H 5.370 13.507 7.359 1.00 . A A . 11 TYR HD2 1 1 5 2463 1 1 11 TYR HE1 H 5.899 17.429 4.370 1.00 . A A . 11 TYR HE1 1 1 5 2464 1 1 11 TYR HE2 H 7.562 13.968 6.295 1.00 . A A . 11 TYR HE2 1 1 5 2465 1 1 11 TYR HH H 8.079 16.785 4.154 1.00 . A A . 11 TYR HH 1 1 5 2466 1 1 11 TYR N N 0.654 14.745 6.846 1.00 . A A . 11 TYR N 1 1 5 2467 1 1 11 TYR O O 1.412 12.691 5.341 1.00 . A A . 11 TYR O 1 1 5 2468 1 1 11 TYR OH O 8.078 15.981 4.678 1.00 . A A . 11 TYR OH 1 1 5 2469 1 1 12 GLU C C 4.642 12.529 3.073 1.00 . A A . 12 GLU C 1 1 5 2470 1 1 12 GLU CA C 3.147 12.842 3.174 1.00 . A A . 12 GLU CA 1 1 5 2471 1 1 12 GLU CB C 2.574 13.232 1.811 1.00 . A A . 12 GLU CB 1 1 5 2472 1 1 12 GLU CD C 0.814 12.564 0.132 1.00 . A A . 12 GLU CD 1 1 5 2473 1 1 12 GLU CG C 1.173 12.648 1.617 1.00 . A A . 12 GLU CG 1 1 5 2474 1 1 12 GLU H H 3.445 14.727 4.009 1.00 . A A . 12 GLU H 1 1 5 2475 1 1 12 GLU HA H 2.611 11.972 3.551 1.00 . A A . 12 GLU HA 1 1 5 2476 1 1 12 GLU HB2 H 2.534 14.317 1.725 1.00 . A A . 12 GLU HB2 1 1 5 2477 1 1 12 GLU HB3 H 3.233 12.874 1.019 1.00 . A A . 12 GLU HB3 1 1 5 2478 1 1 12 GLU HE2 H -0.420 11.195 0.514 1.00 . A A . 12 GLU HE2 1 1 5 2479 1 1 12 GLU HG2 H 1.126 11.653 2.062 1.00 . A A . 12 GLU HG2 1 1 5 2480 1 1 12 GLU HG3 H 0.442 13.265 2.138 1.00 . A A . 12 GLU HG3 1 1 5 2481 1 1 12 GLU N N 2.918 13.891 4.154 1.00 . A A . 12 GLU N 1 1 5 2482 1 1 12 GLU O O 5.487 13.413 2.956 1.00 . A A . 12 GLU O 1 1 5 2483 1 1 12 GLU OE1 O 1.124 13.490 -0.633 1.00 . A A . 12 GLU OE1 1 1 5 2484 1 1 12 GLU OE2 O 0.192 11.491 -0.220 1.00 . A A . 12 GLU OE2 1 1 5 2485 1 1 13 TYR C C 6.534 10.013 1.735 1.00 . A A . 13 TYR C 1 1 5 2486 1 1 13 TYR CA C 6.321 10.770 3.037 1.00 . A A . 13 TYR CA 1 1 5 2487 1 1 13 TYR CB C 6.629 9.879 4.237 1.00 . A A . 13 TYR CB 1 1 5 2488 1 1 13 TYR CD1 C 9.095 10.331 4.508 1.00 . A A . 13 TYR CD1 1 1 5 2489 1 1 13 TYR CD2 C 8.363 8.053 4.113 1.00 . A A . 13 TYR CD2 1 1 5 2490 1 1 13 TYR CE1 C 10.424 9.896 4.554 1.00 . A A . 13 TYR CE1 1 1 5 2491 1 1 13 TYR CE2 C 9.692 7.618 4.159 1.00 . A A . 13 TYR CE2 1 1 5 2492 1 1 13 TYR CG C 8.064 9.409 4.288 1.00 . A A . 13 TYR CG 1 1 5 2493 1 1 13 TYR CZ C 10.723 8.540 4.379 1.00 . A A . 13 TYR CZ 1 1 5 2494 1 1 13 TYR H H 4.216 10.544 3.216 1.00 . A A . 13 TYR H 1 1 5 2495 1 1 13 TYR HA H 6.987 11.633 3.058 1.00 . A A . 13 TYR HA 1 1 5 2496 1 1 13 TYR HB2 H 6.413 10.436 5.150 1.00 . A A . 13 TYR HB2 1 1 5 2497 1 1 13 TYR HB3 H 5.978 9.005 4.199 1.00 . A A . 13 TYR HB3 1 1 5 2498 1 1 13 TYR HD1 H 8.863 11.378 4.642 1.00 . A A . 13 TYR HD1 1 1 5 2499 1 1 13 TYR HD2 H 7.567 7.342 3.944 1.00 . A A . 13 TYR HD2 1 1 5 2500 1 1 13 TYR HE1 H 11.219 10.607 4.723 1.00 . A A . 13 TYR HE1 1 1 5 2501 1 1 13 TYR HE2 H 9.923 6.571 4.025 1.00 . A A . 13 TYR HE2 1 1 5 2502 1 1 13 TYR HH H 12.643 8.784 4.134 1.00 . A A . 13 TYR HH 1 1 5 2503 1 1 13 TYR N N 4.950 11.231 3.119 1.00 . A A . 13 TYR N 1 1 5 2504 1 1 13 TYR O O 5.556 9.554 1.147 1.00 . A A . 13 TYR O 1 1 5 2505 1 1 13 TYR OH O 12.019 8.116 4.423 1.00 . A A . 13 TYR OH 1 1 5 2506 1 1 14 ASP C C 9.277 8.249 0.323 1.00 . A A . 14 ASP C 1 1 5 2507 1 1 14 ASP CA C 8.097 9.191 0.081 1.00 . A A . 14 ASP CA 1 1 5 2508 1 1 14 ASP CB C 8.492 10.169 -1.027 1.00 . A A . 14 ASP CB 1 1 5 2509 1 1 14 ASP CG C 8.266 9.657 -2.452 1.00 . A A . 14 ASP CG 1 1 5 2510 1 1 14 ASP H H 8.574 10.272 1.797 1.00 . A A . 14 ASP H 1 1 5 2511 1 1 14 ASP HA H 7.184 8.657 -0.183 1.00 . A A . 14 ASP HA 1 1 5 2512 1 1 14 ASP HB2 H 7.927 11.092 -0.895 1.00 . A A . 14 ASP HB2 1 1 5 2513 1 1 14 ASP HB3 H 9.546 10.420 -0.911 1.00 . A A . 14 ASP HB3 1 1 5 2514 1 1 14 ASP HD2 H 9.502 10.641 -3.476 1.00 . A A . 14 ASP HD2 1 1 5 2515 1 1 14 ASP N N 7.785 9.895 1.313 1.00 . A A . 14 ASP N 1 1 5 2516 1 1 14 ASP O O 10.442 8.608 0.171 1.00 . A A . 14 ASP O 1 1 5 2517 1 1 14 ASP OD1 O 7.155 9.243 -2.812 1.00 . A A . 14 ASP OD1 1 1 5 2518 1 1 14 ASP OD2 O 9.304 9.697 -3.216 1.00 . A A . 14 ASP OD2 1 1 5 2519 1 1 15 PRO C C 11.072 6.068 0.031 1.00 . A A . 15 PRO C 1 1 5 2520 1 1 15 PRO CA C 9.896 5.963 0.992 1.00 . A A . 15 PRO CA 1 1 5 2521 1 1 15 PRO CB C 9.123 4.665 0.772 1.00 . A A . 15 PRO CB 1 1 5 2522 1 1 15 PRO CD C 7.584 6.558 0.901 1.00 . A A . 15 PRO CD 1 1 5 2523 1 1 15 PRO CG C 7.713 5.084 1.279 1.00 . A A . 15 PRO CG 1 1 5 2524 1 1 15 PRO HA H 10.253 6.022 2.021 1.00 . A A . 15 PRO HA 1 1 5 2525 1 1 15 PRO HB2 H 9.129 4.352 -0.273 1.00 . A A . 15 PRO HB2 1 1 5 2526 1 1 15 PRO HB3 H 9.541 3.885 1.410 1.00 . A A . 15 PRO HB3 1 1 5 2527 1 1 15 PRO HD2 H 6.991 6.675 -0.007 1.00 . A A . 15 PRO HD2 1 1 5 2528 1 1 15 PRO HD3 H 7.133 7.113 1.723 1.00 . A A . 15 PRO HD3 1 1 5 2529 1 1 15 PRO HG2 H 7.052 4.492 0.647 1.00 . A A . 15 PRO HG2 1 1 5 2530 1 1 15 PRO HG3 H 7.498 4.908 2.334 1.00 . A A . 15 PRO HG3 1 1 5 2531 1 1 15 PRO N N 8.943 7.015 0.710 1.00 . A A . 15 PRO N 1 1 5 2532 1 1 15 PRO O O 10.983 5.539 -1.076 1.00 . A A . 15 PRO O 1 1 5 2533 1 1 16 ALA C C 14.388 7.646 0.401 1.00 . A A . 16 ALA C 1 1 5 2534 1 1 16 ALA CA C 13.307 6.896 -0.379 1.00 . A A . 16 ALA CA 1 1 5 2535 1 1 16 ALA CB C 12.916 7.616 -1.672 1.00 . A A . 16 ALA CB 1 1 5 2536 1 1 16 ALA H H 12.197 7.163 1.363 1.00 . A A . 16 ALA H 1 1 5 2537 1 1 16 ALA HA H 13.675 5.901 -0.630 1.00 . A A . 16 ALA HA 1 1 5 2538 1 1 16 ALA HB1 H 13.791 7.707 -2.315 1.00 . A A . 16 ALA HB1 1 1 5 2539 1 1 16 ALA HB2 H 12.144 7.044 -2.186 1.00 . A A . 16 ALA HB2 1 1 5 2540 1 1 16 ALA HB3 H 12.535 8.609 -1.434 1.00 . A A . 16 ALA HB3 1 1 5 2541 1 1 16 ALA N N 12.132 6.736 0.461 1.00 . A A . 16 ALA N 1 1 5 2542 1 1 16 ALA O O 14.689 8.800 0.100 1.00 . A A . 16 ALA O 1 1 5 2543 1 1 17 PHE C C 16.953 6.473 2.720 1.00 . A A . 17 PHE C 1 1 5 2544 1 1 17 PHE CA C 15.986 7.546 2.214 1.00 . A A . 17 PHE CA 1 1 5 2545 1 1 17 PHE CB C 15.294 8.197 3.412 1.00 . A A . 17 PHE CB 1 1 5 2546 1 1 17 PHE CD1 C 13.774 9.909 2.398 1.00 . A A . 17 PHE CD1 1 1 5 2547 1 1 17 PHE CD2 C 15.565 10.667 3.726 1.00 . A A . 17 PHE CD2 1 1 5 2548 1 1 17 PHE CE1 C 13.373 11.253 2.172 1.00 . A A . 17 PHE CE1 1 1 5 2549 1 1 17 PHE CE2 C 15.164 12.010 3.502 1.00 . A A . 17 PHE CE2 1 1 5 2550 1 1 17 PHE CG C 14.861 9.644 3.170 1.00 . A A . 17 PHE CG 1 1 5 2551 1 1 17 PHE CZ C 14.077 12.274 2.730 1.00 . A A . 17 PHE CZ 1 1 5 2552 1 1 17 PHE H H 14.695 6.020 1.626 1.00 . A A . 17 PHE H 1 1 5 2553 1 1 17 PHE HA H 16.529 8.258 1.593 1.00 . A A . 17 PHE HA 1 1 5 2554 1 1 17 PHE HB2 H 14.417 7.606 3.678 1.00 . A A . 17 PHE HB2 1 1 5 2555 1 1 17 PHE HB3 H 15.967 8.168 4.269 1.00 . A A . 17 PHE HB3 1 1 5 2556 1 1 17 PHE HD1 H 13.210 9.090 1.952 1.00 . A A . 17 PHE HD1 1 1 5 2557 1 1 17 PHE HD2 H 16.437 10.454 4.346 1.00 . A A . 17 PHE HD2 1 1 5 2558 1 1 17 PHE HE1 H 12.502 11.465 1.554 1.00 . A A . 17 PHE HE1 1 1 5 2559 1 1 17 PHE HE2 H 15.728 12.829 3.949 1.00 . A A . 17 PHE HE2 1 1 5 2560 1 1 17 PHE HZ H 13.769 13.306 2.557 1.00 . A A . 17 PHE HZ 1 1 5 2561 1 1 17 PHE N N 14.945 6.959 1.388 1.00 . A A . 17 PHE N 1 1 5 2562 1 1 17 PHE O O 16.893 5.323 2.288 1.00 . A A . 17 PHE O 1 1 5 2563 1 1 18 GLU C C 18.935 6.215 5.704 1.00 . A A . 18 GLU C 1 1 5 2564 1 1 18 GLU CA C 18.802 5.977 4.199 1.00 . A A . 18 GLU CA 1 1 5 2565 1 1 18 GLU CB C 20.155 6.119 3.499 1.00 . A A . 18 GLU CB 1 1 5 2566 1 1 18 GLU CD C 22.514 5.882 4.360 1.00 . A A . 18 GLU CD 1 1 5 2567 1 1 18 GLU CG C 21.187 5.164 4.103 1.00 . A A . 18 GLU CG 1 1 5 2568 1 1 18 GLU H H 17.866 7.825 3.976 1.00 . A A . 18 GLU H 1 1 5 2569 1 1 18 GLU HA H 18.409 4.977 4.015 1.00 . A A . 18 GLU HA 1 1 5 2570 1 1 18 GLU HB2 H 20.042 5.912 2.435 1.00 . A A . 18 GLU HB2 1 1 5 2571 1 1 18 GLU HB3 H 20.509 7.146 3.589 1.00 . A A . 18 GLU HB3 1 1 5 2572 1 1 18 GLU HE2 H 22.190 6.987 5.850 1.00 . A A . 18 GLU HE2 1 1 5 2573 1 1 18 GLU HG2 H 20.805 4.752 5.037 1.00 . A A . 18 GLU HG2 1 1 5 2574 1 1 18 GLU HG3 H 21.349 4.323 3.428 1.00 . A A . 18 GLU HG3 1 1 5 2575 1 1 18 GLU N N 17.823 6.888 3.629 1.00 . A A . 18 GLU N 1 1 5 2576 1 1 18 GLU O O 20.033 6.459 6.203 1.00 . A A . 18 GLU O 1 1 5 2577 1 1 18 GLU OE1 O 23.280 6.125 3.417 1.00 . A A . 18 GLU OE1 1 1 5 2578 1 1 18 GLU OE2 O 22.737 6.190 5.593 1.00 . A A . 18 GLU OE2 1 1 5 2579 1 1 19 ASP C C 16.340 6.214 8.330 1.00 . A A . 19 ASP C 1 1 5 2580 1 1 19 ASP CA C 17.778 6.339 7.825 1.00 . A A . 19 ASP CA 1 1 5 2581 1 1 19 ASP CB C 18.289 7.734 8.192 1.00 . A A . 19 ASP CB 1 1 5 2582 1 1 19 ASP CG C 19.426 7.757 9.216 1.00 . A A . 19 ASP CG 1 1 5 2583 1 1 19 ASP H H 16.914 5.936 5.973 1.00 . A A . 19 ASP H 1 1 5 2584 1 1 19 ASP HA H 18.432 5.569 8.234 1.00 . A A . 19 ASP HA 1 1 5 2585 1 1 19 ASP HB2 H 18.629 8.231 7.283 1.00 . A A . 19 ASP HB2 1 1 5 2586 1 1 19 ASP HB3 H 17.457 8.318 8.583 1.00 . A A . 19 ASP HB3 1 1 5 2587 1 1 19 ASP HD2 H 18.286 6.916 10.457 1.00 . A A . 19 ASP HD2 1 1 5 2588 1 1 19 ASP N N 17.802 6.136 6.387 1.00 . A A . 19 ASP N 1 1 5 2589 1 1 19 ASP O O 15.587 7.188 8.319 1.00 . A A . 19 ASP O 1 1 5 2590 1 1 19 ASP OD1 O 20.596 7.969 8.866 1.00 . A A . 19 ASP OD1 1 1 5 2591 1 1 19 ASP OD2 O 19.065 7.543 10.436 1.00 . A A . 19 ASP OD2 1 1 5 2592 1 1 20 LEU C C 14.765 3.908 10.546 1.00 . A A . 20 LEU C 1 1 5 2593 1 1 20 LEU CA C 14.664 4.745 9.269 1.00 . A A . 20 LEU CA 1 1 5 2594 1 1 20 LEU CB C 13.794 4.107 8.183 1.00 . A A . 20 LEU CB 1 1 5 2595 1 1 20 LEU CD1 C 11.570 4.064 6.995 1.00 . A A . 20 LEU CD1 1 1 5 2596 1 1 20 LEU CD2 C 11.717 3.450 9.453 1.00 . A A . 20 LEU CD2 1 1 5 2597 1 1 20 LEU CG C 12.285 4.313 8.325 1.00 . A A . 20 LEU CG 1 1 5 2598 1 1 20 LEU H H 16.617 4.223 8.766 1.00 . A A . 20 LEU H 1 1 5 2599 1 1 20 LEU HA H 14.214 5.705 9.519 1.00 . A A . 20 LEU HA 1 1 5 2600 1 1 20 LEU HB2 H 14.106 4.502 7.216 1.00 . A A . 20 LEU HB2 1 1 5 2601 1 1 20 LEU HB3 H 13.995 3.035 8.168 1.00 . A A . 20 LEU HB3 1 1 5 2602 1 1 20 LEU HD11 H 12.124 3.324 6.418 1.00 . A A . 20 LEU HD11 1 1 5 2603 1 1 20 LEU HD12 H 10.563 3.695 7.189 1.00 . A A . 20 LEU HD12 1 1 5 2604 1 1 20 LEU HD13 H 11.513 4.995 6.433 1.00 . A A . 20 LEU HD13 1 1 5 2605 1 1 20 LEU HD21 H 10.687 3.178 9.219 1.00 . A A . 20 LEU HD21 1 1 5 2606 1 1 20 LEU HD22 H 12.317 2.546 9.555 1.00 . A A . 20 LEU HD22 1 1 5 2607 1 1 20 LEU HD23 H 11.742 4.010 10.388 1.00 . A A . 20 LEU HD23 1 1 5 2608 1 1 20 LEU HG H 12.107 5.354 8.596 1.00 . A A . 20 LEU HG 1 1 5 2609 1 1 20 LEU N N 16.000 5.009 8.761 1.00 . A A . 20 LEU N 1 1 5 2610 1 1 20 LEU O O 14.644 2.686 10.536 1.00 . A A . 20 LEU O 1 1 5 2611 1 1 21 PRO C C 13.741 3.809 13.581 1.00 . A A . 21 PRO C 1 1 5 2612 1 1 21 PRO CA C 15.123 4.022 12.977 1.00 . A A . 21 PRO CA 1 1 5 2613 1 1 21 PRO CB C 15.921 5.044 13.784 1.00 . A A . 21 PRO CB 1 1 5 2614 1 1 21 PRO CD C 15.141 6.045 11.707 1.00 . A A . 21 PRO CD 1 1 5 2615 1 1 21 PRO CG C 15.525 6.356 13.152 1.00 . A A . 21 PRO CG 1 1 5 2616 1 1 21 PRO HA H 15.658 3.073 12.933 1.00 . A A . 21 PRO HA 1 1 5 2617 1 1 21 PRO HB2 H 15.691 5.001 14.848 1.00 . A A . 21 PRO HB2 1 1 5 2618 1 1 21 PRO HB3 H 16.985 4.885 13.611 1.00 . A A . 21 PRO HB3 1 1 5 2619 1 1 21 PRO HD2 H 14.216 6.552 11.434 1.00 . A A . 21 PRO HD2 1 1 5 2620 1 1 21 PRO HD3 H 15.948 6.343 11.038 1.00 . A A . 21 PRO HD3 1 1 5 2621 1 1 21 PRO HG2 H 14.657 6.756 13.676 1.00 . A A . 21 PRO HG2 1 1 5 2622 1 1 21 PRO HG3 H 16.368 7.044 13.218 1.00 . A A . 21 PRO HG3 1 1 5 2623 1 1 21 PRO N N 14.993 4.607 11.661 1.00 . A A . 21 PRO N 1 1 5 2624 1 1 21 PRO O O 12.754 4.180 12.947 1.00 . A A . 21 PRO O 1 1 5 2625 1 1 22 ASP C C 12.105 4.142 16.367 1.00 . A A . 22 ASP C 1 1 5 2626 1 1 22 ASP CA C 12.426 2.975 15.430 1.00 . A A . 22 ASP CA 1 1 5 2627 1 1 22 ASP CB C 12.485 1.698 16.270 1.00 . A A . 22 ASP CB 1 1 5 2628 1 1 22 ASP CG C 13.775 1.509 17.071 1.00 . A A . 22 ASP CG 1 1 5 2629 1 1 22 ASP H H 14.503 2.927 15.277 1.00 . A A . 22 ASP H 1 1 5 2630 1 1 22 ASP HA H 11.699 2.875 14.626 1.00 . A A . 22 ASP HA 1 1 5 2631 1 1 22 ASP HB2 H 11.643 1.696 16.962 1.00 . A A . 22 ASP HB2 1 1 5 2632 1 1 22 ASP HB3 H 12.357 0.840 15.610 1.00 . A A . 22 ASP HB3 1 1 5 2633 1 1 22 ASP HD2 H 15.326 0.440 17.058 1.00 . A A . 22 ASP HD2 1 1 5 2634 1 1 22 ASP N N 13.696 3.226 14.769 1.00 . A A . 22 ASP N 1 1 5 2635 1 1 22 ASP O O 11.887 3.942 17.562 1.00 . A A . 22 ASP O 1 1 5 2636 1 1 22 ASP OD1 O 14.222 2.418 17.786 1.00 . A A . 22 ASP OD1 1 1 5 2637 1 1 22 ASP OD2 O 14.337 0.356 16.935 1.00 . A A . 22 ASP OD2 1 1 5 2638 1 1 23 ASP C C 11.801 7.746 15.625 1.00 . A A . 23 ASP C 1 1 5 2639 1 1 23 ASP CA C 11.796 6.533 16.558 1.00 . A A . 23 ASP CA 1 1 5 2640 1 1 23 ASP CB C 12.854 6.764 17.639 1.00 . A A . 23 ASP CB 1 1 5 2641 1 1 23 ASP CG C 12.346 7.467 18.900 1.00 . A A . 23 ASP CG 1 1 5 2642 1 1 23 ASP H H 12.265 5.488 14.818 1.00 . A A . 23 ASP H 1 1 5 2643 1 1 23 ASP HA H 10.819 6.356 17.007 1.00 . A A . 23 ASP HA 1 1 5 2644 1 1 23 ASP HB2 H 13.278 5.802 17.923 1.00 . A A . 23 ASP HB2 1 1 5 2645 1 1 23 ASP HB3 H 13.664 7.356 17.213 1.00 . A A . 23 ASP HB3 1 1 5 2646 1 1 23 ASP HD2 H 13.618 8.600 19.704 1.00 . A A . 23 ASP HD2 1 1 5 2647 1 1 23 ASP N N 12.086 5.335 15.790 1.00 . A A . 23 ASP N 1 1 5 2648 1 1 23 ASP O O 12.597 8.666 15.801 1.00 . A A . 23 ASP O 1 1 5 2649 1 1 23 ASP OD1 O 11.156 7.794 19.014 1.00 . A A . 23 ASP OD1 1 1 5 2650 1 1 23 ASP OD2 O 13.242 7.679 19.804 1.00 . A A . 23 ASP OD2 1 1 5 2651 1 1 24 TRP C C 9.608 9.668 14.100 1.00 . A A . 24 TRP C 1 1 5 2652 1 1 24 TRP CA C 10.793 8.791 13.691 1.00 . A A . 24 TRP CA 1 1 5 2653 1 1 24 TRP CB C 10.672 8.249 12.265 1.00 . A A . 24 TRP CB 1 1 5 2654 1 1 24 TRP CD1 C 12.209 9.966 11.102 1.00 . A A . 24 TRP CD1 1 1 5 2655 1 1 24 TRP CD2 C 10.307 9.621 10.019 1.00 . A A . 24 TRP CD2 1 1 5 2656 1 1 24 TRP CE2 C 11.029 10.550 9.299 1.00 . A A . 24 TRP CE2 1 1 5 2657 1 1 24 TRP CE3 C 9.042 9.185 9.591 1.00 . A A . 24 TRP CE3 1 1 5 2658 1 1 24 TRP CG C 11.078 9.251 11.182 1.00 . A A . 24 TRP CG 1 1 5 2659 1 1 24 TRP CH2 C 9.310 10.702 7.661 1.00 . A A . 24 TRP CH2 1 1 5 2660 1 1 24 TRP CZ2 C 10.569 11.123 8.107 1.00 . A A . 24 TRP CZ2 1 1 5 2661 1 1 24 TRP CZ3 C 8.596 9.766 8.398 1.00 . A A . 24 TRP CZ3 1 1 5 2662 1 1 24 TRP H H 10.258 6.955 14.516 1.00 . A A . 24 TRP H 1 1 5 2663 1 1 24 TRP HA H 11.716 9.369 13.733 1.00 . A A . 24 TRP HA 1 1 5 2664 1 1 24 TRP HB2 H 11.292 7.358 12.172 1.00 . A A . 24 TRP HB2 1 1 5 2665 1 1 24 TRP HB3 H 9.641 7.940 12.091 1.00 . A A . 24 TRP HB3 1 1 5 2666 1 1 24 TRP HD1 H 13.016 9.922 11.833 1.00 . A A . 24 TRP HD1 1 1 5 2667 1 1 24 TRP HE1 H 13.022 11.446 9.680 1.00 . A A . 24 TRP HE1 1 1 5 2668 1 1 24 TRP HE3 H 8.452 8.451 10.142 1.00 . A A . 24 TRP HE3 1 1 5 2669 1 1 24 TRP HH2 H 8.893 11.109 6.740 1.00 . A A . 24 TRP HH2 1 1 5 2670 1 1 24 TRP HZ2 H 11.158 11.855 7.557 1.00 . A A . 24 TRP HZ2 1 1 5 2671 1 1 24 TRP HZ3 H 7.619 9.462 8.021 1.00 . A A . 24 TRP HZ3 1 1 5 2672 1 1 24 TRP N N 10.902 7.707 14.652 1.00 . A A . 24 TRP N 1 1 5 2673 1 1 24 TRP NE1 N 12.223 10.767 9.979 1.00 . A A . 24 TRP NE1 1 1 5 2674 1 1 24 TRP O O 8.563 9.157 14.502 1.00 . A A . 24 TRP O 1 1 5 2675 1 1 25 ALA C C 8.503 12.846 13.142 1.00 . A A . 25 ALA C 1 1 5 2676 1 1 25 ALA CA C 8.769 11.925 14.335 1.00 . A A . 25 ALA CA 1 1 5 2677 1 1 25 ALA CB C 9.188 12.697 15.586 1.00 . A A . 25 ALA CB 1 1 5 2678 1 1 25 ALA H H 10.662 11.379 13.654 1.00 . A A . 25 ALA H 1 1 5 2679 1 1 25 ALA HA H 7.864 11.361 14.556 1.00 . A A . 25 ALA HA 1 1 5 2680 1 1 25 ALA HB1 H 8.995 12.089 16.470 1.00 . A A . 25 ALA HB1 1 1 5 2681 1 1 25 ALA HB2 H 10.251 12.930 15.532 1.00 . A A . 25 ALA HB2 1 1 5 2682 1 1 25 ALA HB3 H 8.617 13.622 15.651 1.00 . A A . 25 ALA HB3 1 1 5 2683 1 1 25 ALA N N 9.809 10.972 13.982 1.00 . A A . 25 ALA N 1 1 5 2684 1 1 25 ALA O O 9.438 13.299 12.482 1.00 . A A . 25 ALA O 1 1 5 2685 1 1 26 CYS C C 7.577 15.283 11.930 1.00 . A A . 26 CYS C 1 1 5 2686 1 1 26 CYS CA C 6.823 13.957 11.803 1.00 . A A . 26 CYS CA 1 1 5 2687 1 1 26 CYS CB C 5.308 14.163 11.769 1.00 . A A . 26 CYS CB 1 1 5 2688 1 1 26 CYS H H 6.471 12.725 13.445 1.00 . A A . 26 CYS H 1 1 5 2689 1 1 26 CYS HA H 7.102 13.440 10.884 1.00 . A A . 26 CYS HA 1 1 5 2690 1 1 26 CYS HB2 H 4.829 13.309 12.247 1.00 . A A . 26 CYS HB2 1 1 5 2691 1 1 26 CYS HB3 H 5.061 15.041 12.365 1.00 . A A . 26 CYS HB3 1 1 5 2692 1 1 26 CYS N N 7.225 13.097 12.904 1.00 . A A . 26 CYS N 1 1 5 2693 1 1 26 CYS O O 7.669 15.881 12.999 1.00 . A A . 26 CYS O 1 1 5 2694 1 1 26 CYS SG S 4.598 14.371 10.095 1.00 . A A . 26 CYS SG 1 1 5 2695 1 1 27 PRO C C 7.928 18.150 10.773 1.00 . A A . 27 PRO C 1 1 5 2696 1 1 27 PRO CA C 8.875 16.963 10.686 1.00 . A A . 27 PRO CA 1 1 5 2697 1 1 27 PRO CB C 9.540 16.892 9.313 1.00 . A A . 27 PRO CB 1 1 5 2698 1 1 27 PRO CD C 8.033 15.053 9.522 1.00 . A A . 27 PRO CD 1 1 5 2699 1 1 27 PRO CG C 8.434 16.103 8.488 1.00 . A A . 27 PRO CG 1 1 5 2700 1 1 27 PRO HA H 9.629 17.033 11.470 1.00 . A A . 27 PRO HA 1 1 5 2701 1 1 27 PRO HB2 H 9.743 17.881 8.901 1.00 . A A . 27 PRO HB2 1 1 5 2702 1 1 27 PRO HB3 H 10.459 16.310 9.390 1.00 . A A . 27 PRO HB3 1 1 5 2703 1 1 27 PRO HD2 H 7.024 14.686 9.332 1.00 . A A . 27 PRO HD2 1 1 5 2704 1 1 27 PRO HD3 H 8.745 14.229 9.507 1.00 . A A . 27 PRO HD3 1 1 5 2705 1 1 27 PRO HG2 H 7.536 16.567 8.081 1.00 . A A . 27 PRO HG2 1 1 5 2706 1 1 27 PRO HG3 H 9.047 15.685 7.690 1.00 . A A . 27 PRO HG3 1 1 5 2707 1 1 27 PRO N N 8.122 15.732 10.796 1.00 . A A . 27 PRO N 1 1 5 2708 1 1 27 PRO O O 8.393 19.288 10.707 1.00 . A A . 27 PRO O 1 1 5 2709 1 1 28 VAL C C 5.026 18.926 12.403 1.00 . A A . 28 VAL C 1 1 5 2710 1 1 28 VAL CA C 5.652 18.936 11.007 1.00 . A A . 28 VAL CA 1 1 5 2711 1 1 28 VAL CB C 4.619 18.787 9.888 1.00 . A A . 28 VAL CB 1 1 5 2712 1 1 28 VAL CG1 C 3.598 19.926 9.929 1.00 . A A . 28 VAL CG1 1 1 5 2713 1 1 28 VAL CG2 C 5.299 18.710 8.520 1.00 . A A . 28 VAL CG2 1 1 5 2714 1 1 28 VAL H H 6.269 16.947 10.968 1.00 . A A . 28 VAL H 1 1 5 2715 1 1 28 VAL HA H 6.172 19.882 10.862 1.00 . A A . 28 VAL HA 1 1 5 2716 1 1 28 VAL HB H 4.083 17.852 10.049 1.00 . A A . 28 VAL HB 1 1 5 2717 1 1 28 VAL HG11 H 3.742 20.510 10.838 1.00 . A A . 28 VAL HG11 1 1 5 2718 1 1 28 VAL HG12 H 3.735 20.569 9.060 1.00 . A A . 28 VAL HG12 1 1 5 2719 1 1 28 VAL HG13 H 2.590 19.512 9.920 1.00 . A A . 28 VAL HG13 1 1 5 2720 1 1 28 VAL HG21 H 5.264 17.684 8.154 1.00 . A A . 28 VAL HG21 1 1 5 2721 1 1 28 VAL HG22 H 4.781 19.364 7.818 1.00 . A A . 28 VAL HG22 1 1 5 2722 1 1 28 VAL HG23 H 6.338 19.027 8.612 1.00 . A A . 28 VAL HG23 1 1 5 2723 1 1 28 VAL N N 6.640 17.874 10.915 1.00 . A A . 28 VAL N 1 1 5 2724 1 1 28 VAL O O 5.549 19.550 13.325 1.00 . A A . 28 VAL O 1 1 5 2725 1 1 29 CYS C C 4.245 17.842 14.882 1.00 . A A . 29 CYS C 1 1 5 2726 1 1 29 CYS CA C 3.215 18.112 13.783 1.00 . A A . 29 CYS CA 1 1 5 2727 1 1 29 CYS CB C 2.126 17.038 13.744 1.00 . A A . 29 CYS CB 1 1 5 2728 1 1 29 CYS H H 3.499 17.707 11.759 1.00 . A A . 29 CYS H 1 1 5 2729 1 1 29 CYS HA H 2.720 19.070 13.944 1.00 . A A . 29 CYS HA 1 1 5 2730 1 1 29 CYS HB2 H 1.609 17.030 14.704 1.00 . A A . 29 CYS HB2 1 1 5 2731 1 1 29 CYS HB3 H 1.391 17.313 12.989 1.00 . A A . 29 CYS HB3 1 1 5 2732 1 1 29 CYS N N 3.917 18.211 12.514 1.00 . A A . 29 CYS N 1 1 5 2733 1 1 29 CYS O O 4.191 18.448 15.952 1.00 . A A . 29 CYS O 1 1 5 2734 1 1 29 CYS SG S 2.728 15.346 13.389 1.00 . A A . 29 CYS SG 1 1 5 2735 1 1 30 GLY C C 5.735 15.446 16.454 1.00 . A A . 30 GLY C 1 1 5 2736 1 1 30 GLY CA C 6.200 16.573 15.530 1.00 . A A . 30 GLY CA 1 1 5 2737 1 1 30 GLY H H 5.196 16.443 13.709 1.00 . A A . 30 GLY H 1 1 5 2738 1 1 30 GLY HA2 H 7.095 16.261 14.992 1.00 . A A . 30 GLY HA2 1 1 5 2739 1 1 30 GLY HA3 H 6.471 17.447 16.123 1.00 . A A . 30 GLY HA3 1 1 5 2740 1 1 30 GLY N N 5.159 16.932 14.581 1.00 . A A . 30 GLY N 1 1 5 2741 1 1 30 GLY O O 6.122 15.394 17.620 1.00 . A A . 30 GLY O 1 1 5 2742 1 1 31 ALA C C 5.277 12.223 16.425 1.00 . A A . 31 ALA C 1 1 5 2743 1 1 31 ALA CA C 4.388 13.447 16.657 1.00 . A A . 31 ALA CA 1 1 5 2744 1 1 31 ALA CB C 2.932 13.194 16.260 1.00 . A A . 31 ALA CB 1 1 5 2745 1 1 31 ALA H H 4.599 14.619 14.948 1.00 . A A . 31 ALA H 1 1 5 2746 1 1 31 ALA HA H 4.422 13.716 17.713 1.00 . A A . 31 ALA HA 1 1 5 2747 1 1 31 ALA HB1 H 2.476 14.129 15.936 1.00 . A A . 31 ALA HB1 1 1 5 2748 1 1 31 ALA HB2 H 2.899 12.472 15.443 1.00 . A A . 31 ALA HB2 1 1 5 2749 1 1 31 ALA HB3 H 2.385 12.800 17.116 1.00 . A A . 31 ALA HB3 1 1 5 2750 1 1 31 ALA N N 4.910 14.570 15.898 1.00 . A A . 31 ALA N 1 1 5 2751 1 1 31 ALA O O 6.053 12.187 15.472 1.00 . A A . 31 ALA O 1 1 5 2752 1 1 32 SER C C 5.458 9.211 16.008 1.00 . A A . 32 SER C 1 1 5 2753 1 1 32 SER CA C 5.914 10.029 17.219 1.00 . A A . 32 SER CA 1 1 5 2754 1 1 32 SER CB C 5.794 9.197 18.497 1.00 . A A . 32 SER CB 1 1 5 2755 1 1 32 SER H H 4.500 11.288 18.087 1.00 . A A . 32 SER H 1 1 5 2756 1 1 32 SER HA H 6.946 10.354 17.093 1.00 . A A . 32 SER HA 1 1 5 2757 1 1 32 SER HB2 H 6.392 8.291 18.397 1.00 . A A . 32 SER HB2 1 1 5 2758 1 1 32 SER HB3 H 6.204 9.761 19.335 1.00 . A A . 32 SER HB3 1 1 5 2759 1 1 32 SER HG H 4.029 9.527 19.381 1.00 . A A . 32 SER HG 1 1 5 2760 1 1 32 SER N N 5.133 11.250 17.314 1.00 . A A . 32 SER N 1 1 5 2761 1 1 32 SER O O 4.303 9.300 15.593 1.00 . A A . 32 SER O 1 1 5 2762 1 1 32 SER OG O 4.443 8.844 18.779 1.00 . A A . 32 SER OG 1 1 5 2763 1 1 33 LYS C C 4.701 6.993 14.476 1.00 . A A . 33 LYS C 1 1 5 2764 1 1 33 LYS CA C 6.097 7.598 14.322 1.00 . A A . 33 LYS CA 1 1 5 2765 1 1 33 LYS CB C 7.200 6.557 14.121 1.00 . A A . 33 LYS CB 1 1 5 2766 1 1 33 LYS CD C 6.408 4.290 13.350 1.00 . A A . 33 LYS CD 1 1 5 2767 1 1 33 LYS CE C 6.466 3.292 12.193 1.00 . A A . 33 LYS CE 1 1 5 2768 1 1 33 LYS CG C 6.902 5.670 12.910 1.00 . A A . 33 LYS CG 1 1 5 2769 1 1 33 LYS H H 7.325 8.365 15.820 1.00 . A A . 33 LYS H 1 1 5 2770 1 1 33 LYS HA H 6.100 8.244 13.444 1.00 . A A . 33 LYS HA 1 1 5 2771 1 1 33 LYS HB2 H 8.158 7.058 13.982 1.00 . A A . 33 LYS HB2 1 1 5 2772 1 1 33 LYS HB3 H 7.291 5.940 15.016 1.00 . A A . 33 LYS HB3 1 1 5 2773 1 1 33 LYS HD2 H 7.017 3.929 14.179 1.00 . A A . 33 LYS HD2 1 1 5 2774 1 1 33 LYS HD3 H 5.385 4.368 13.718 1.00 . A A . 33 LYS HD3 1 1 5 2775 1 1 33 LYS HE2 H 5.905 3.680 11.342 1.00 . A A . 33 LYS HE2 1 1 5 2776 1 1 33 LYS HE3 H 7.498 3.167 11.864 1.00 . A A . 33 LYS HE3 1 1 5 2777 1 1 33 LYS HG2 H 6.151 6.147 12.282 1.00 . A A . 33 LYS HG2 1 1 5 2778 1 1 33 LYS HG3 H 7.802 5.562 12.305 1.00 . A A . 33 LYS HG3 1 1 5 2779 1 1 33 LYS HZ1 H 6.093 1.260 11.923 1.00 . A A . 33 LYS HZ1 1 1 5 2780 1 1 33 LYS HZ2 H 6.302 1.666 13.486 1.00 . A A . 33 LYS HZ2 1 1 5 2781 1 1 33 LYS N N 6.389 8.431 15.476 1.00 . A A . 33 LYS N 1 1 5 2782 1 1 33 LYS NZ N 5.909 1.985 12.607 1.00 . A A . 33 LYS NZ 1 1 5 2783 1 1 33 LYS O O 3.877 7.084 13.566 1.00 . A A . 33 LYS O 1 1 5 2784 1 1 34 ASP C C 2.071 6.727 15.524 1.00 . A A . 34 ASP C 1 1 5 2785 1 1 34 ASP CA C 3.194 5.767 15.918 1.00 . A A . 34 ASP CA 1 1 5 2786 1 1 34 ASP CB C 3.051 5.457 17.408 1.00 . A A . 34 ASP CB 1 1 5 2787 1 1 34 ASP CG C 3.880 6.346 18.336 1.00 . A A . 34 ASP CG 1 1 5 2788 1 1 34 ASP H H 5.152 6.317 16.367 1.00 . A A . 34 ASP H 1 1 5 2789 1 1 34 ASP HA H 3.184 4.849 15.329 1.00 . A A . 34 ASP HA 1 1 5 2790 1 1 34 ASP HB2 H 2.000 5.548 17.684 1.00 . A A . 34 ASP HB2 1 1 5 2791 1 1 34 ASP HB3 H 3.335 4.417 17.576 1.00 . A A . 34 ASP HB3 1 1 5 2792 1 1 34 ASP HD2 H 3.870 7.269 19.978 1.00 . A A . 34 ASP HD2 1 1 5 2793 1 1 34 ASP N N 4.477 6.387 15.633 1.00 . A A . 34 ASP N 1 1 5 2794 1 1 34 ASP O O 1.687 7.594 16.307 1.00 . A A . 34 ASP O 1 1 5 2795 1 1 34 ASP OD1 O 5.085 6.549 18.119 1.00 . A A . 34 ASP OD1 1 1 5 2796 1 1 34 ASP OD2 O 3.232 6.847 19.333 1.00 . A A . 34 ASP OD2 1 1 5 2797 1 1 35 ALA C C 0.439 7.256 12.280 1.00 . A A . 35 ALA C 1 1 5 2798 1 1 35 ALA CA C 0.499 7.378 13.804 1.00 . A A . 35 ALA CA 1 1 5 2799 1 1 35 ALA CB C 0.717 8.821 14.267 1.00 . A A . 35 ALA CB 1 1 5 2800 1 1 35 ALA H H 1.889 5.832 13.679 1.00 . A A . 35 ALA H 1 1 5 2801 1 1 35 ALA HA H -0.437 7.011 14.227 1.00 . A A . 35 ALA HA 1 1 5 2802 1 1 35 ALA HB1 H 0.086 9.024 15.131 1.00 . A A . 35 ALA HB1 1 1 5 2803 1 1 35 ALA HB2 H 1.763 8.960 14.539 1.00 . A A . 35 ALA HB2 1 1 5 2804 1 1 35 ALA HB3 H 0.458 9.504 13.458 1.00 . A A . 35 ALA HB3 1 1 5 2805 1 1 35 ALA N N 1.572 6.540 14.310 1.00 . A A . 35 ALA N 1 1 5 2806 1 1 35 ALA O O -0.623 7.419 11.682 1.00 . A A . 35 ALA O 1 1 5 2807 1 1 36 PHE C C 1.118 5.481 9.799 1.00 . A A . 36 PHE C 1 1 5 2808 1 1 36 PHE CA C 1.686 6.828 10.252 1.00 . A A . 36 PHE CA 1 1 5 2809 1 1 36 PHE CB C 3.171 6.890 9.890 1.00 . A A . 36 PHE CB 1 1 5 2810 1 1 36 PHE CD1 C 3.903 9.008 11.007 1.00 . A A . 36 PHE CD1 1 1 5 2811 1 1 36 PHE CD2 C 4.094 8.868 8.664 1.00 . A A . 36 PHE CD2 1 1 5 2812 1 1 36 PHE CE1 C 4.434 10.325 10.972 1.00 . A A . 36 PHE CE1 1 1 5 2813 1 1 36 PHE CE2 C 4.625 10.185 8.628 1.00 . A A . 36 PHE CE2 1 1 5 2814 1 1 36 PHE CG C 3.744 8.308 9.853 1.00 . A A . 36 PHE CG 1 1 5 2815 1 1 36 PHE CZ C 4.784 10.885 9.783 1.00 . A A . 36 PHE CZ 1 1 5 2816 1 1 36 PHE H H 2.453 6.841 12.189 1.00 . A A . 36 PHE H 1 1 5 2817 1 1 36 PHE HA H 1.102 7.634 9.809 1.00 . A A . 36 PHE HA 1 1 5 2818 1 1 36 PHE HB2 H 3.735 6.301 10.613 1.00 . A A . 36 PHE HB2 1 1 5 2819 1 1 36 PHE HB3 H 3.317 6.424 8.916 1.00 . A A . 36 PHE HB3 1 1 5 2820 1 1 36 PHE HD1 H 3.622 8.559 11.960 1.00 . A A . 36 PHE HD1 1 1 5 2821 1 1 36 PHE HD2 H 3.966 8.307 7.738 1.00 . A A . 36 PHE HD2 1 1 5 2822 1 1 36 PHE HE1 H 4.561 10.886 11.897 1.00 . A A . 36 PHE HE1 1 1 5 2823 1 1 36 PHE HE2 H 4.906 10.634 7.675 1.00 . A A . 36 PHE HE2 1 1 5 2824 1 1 36 PHE HZ H 5.192 11.895 9.756 1.00 . A A . 36 PHE HZ 1 1 5 2825 1 1 36 PHE N N 1.593 6.972 11.694 1.00 . A A . 36 PHE N 1 1 5 2826 1 1 36 PHE O O 1.319 4.464 10.460 1.00 . A A . 36 PHE O 1 1 5 2827 1 1 37 GLU C C -0.136 4.350 6.595 1.00 . A A . 37 GLU C 1 1 5 2828 1 1 37 GLU CA C -0.178 4.313 8.124 1.00 . A A . 37 GLU CA 1 1 5 2829 1 1 37 GLU CB C -1.611 4.133 8.628 1.00 . A A . 37 GLU CB 1 1 5 2830 1 1 37 GLU CD C -2.211 2.643 10.573 1.00 . A A . 37 GLU CD 1 1 5 2831 1 1 37 GLU CG C -1.854 2.693 9.086 1.00 . A A . 37 GLU CG 1 1 5 2832 1 1 37 GLU H H 0.262 6.350 8.140 1.00 . A A . 37 GLU H 1 1 5 2833 1 1 37 GLU HA H 0.437 3.491 8.491 1.00 . A A . 37 GLU HA 1 1 5 2834 1 1 37 GLU HB2 H -1.798 4.817 9.456 1.00 . A A . 37 GLU HB2 1 1 5 2835 1 1 37 GLU HB3 H -2.313 4.391 7.837 1.00 . A A . 37 GLU HB3 1 1 5 2836 1 1 37 GLU HE2 H -4.088 2.616 10.429 1.00 . A A . 37 GLU HE2 1 1 5 2837 1 1 37 GLU HG2 H -2.660 2.253 8.499 1.00 . A A . 37 GLU HG2 1 1 5 2838 1 1 37 GLU HG3 H -0.962 2.094 8.902 1.00 . A A . 37 GLU HG3 1 1 5 2839 1 1 37 GLU N N 0.420 5.518 8.673 1.00 . A A . 37 GLU N 1 1 5 2840 1 1 37 GLU O O -0.213 5.419 5.993 1.00 . A A . 37 GLU O 1 1 5 2841 1 1 37 GLU OE1 O -1.414 2.150 11.385 1.00 . A A . 37 GLU OE1 1 1 5 2842 1 1 37 GLU OE2 O -3.362 3.141 10.874 1.00 . A A . 37 GLU OE2 1 1 5 2843 1 1 38 LYS C C -1.159 3.777 3.952 1.00 . A A . 38 LYS C 1 1 5 2844 1 1 38 LYS CA C 0.041 3.049 4.562 1.00 . A A . 38 LYS CA 1 1 5 2845 1 1 38 LYS CB C 0.147 1.581 4.147 1.00 . A A . 38 LYS CB 1 1 5 2846 1 1 38 LYS CD C -0.614 0.218 2.167 1.00 . A A . 38 LYS CD 1 1 5 2847 1 1 38 LYS CE C -0.468 0.000 0.659 1.00 . A A . 38 LYS CE 1 1 5 2848 1 1 38 LYS CG C 0.180 1.443 2.624 1.00 . A A . 38 LYS CG 1 1 5 2849 1 1 38 LYS H H 0.050 2.301 6.505 1.00 . A A . 38 LYS H 1 1 5 2850 1 1 38 LYS HA H 0.952 3.546 4.228 1.00 . A A . 38 LYS HA 1 1 5 2851 1 1 38 LYS HB2 H 1.048 1.142 4.576 1.00 . A A . 38 LYS HB2 1 1 5 2852 1 1 38 LYS HB3 H -0.700 1.024 4.548 1.00 . A A . 38 LYS HB3 1 1 5 2853 1 1 38 LYS HD2 H -0.265 -0.667 2.700 1.00 . A A . 38 LYS HD2 1 1 5 2854 1 1 38 LYS HD3 H -1.667 0.347 2.419 1.00 . A A . 38 LYS HD3 1 1 5 2855 1 1 38 LYS HE2 H 0.053 0.848 0.212 1.00 . A A . 38 LYS HE2 1 1 5 2856 1 1 38 LYS HE3 H 0.141 -0.883 0.470 1.00 . A A . 38 LYS HE3 1 1 5 2857 1 1 38 LYS HG2 H -0.234 2.341 2.165 1.00 . A A . 38 LYS HG2 1 1 5 2858 1 1 38 LYS HG3 H 1.213 1.359 2.285 1.00 . A A . 38 LYS HG3 1 1 5 2859 1 1 38 LYS HZ1 H -2.552 -0.025 0.691 1.00 . A A . 38 LYS HZ1 1 1 5 2860 1 1 38 LYS HZ2 H -1.943 0.503 -0.725 1.00 . A A . 38 LYS HZ2 1 1 5 2861 1 1 38 LYS N N -0.013 3.167 6.009 1.00 . A A . 38 LYS N 1 1 5 2862 1 1 38 LYS NZ N -1.797 -0.160 0.027 1.00 . A A . 38 LYS NZ 1 1 5 2863 1 1 38 LYS O O -2.269 3.698 4.476 1.00 . A A . 38 LYS O 1 1 5 2864 1 1 39 GLN C C -1.733 5.136 0.651 1.00 . A A . 39 GLN C 1 1 5 2865 1 1 39 GLN CA C -1.940 5.208 2.165 1.00 . A A . 39 GLN CA 1 1 5 2866 1 1 39 GLN CB C -1.988 6.661 2.644 1.00 . A A . 39 GLN CB 1 1 5 2867 1 1 39 GLN CD C -2.900 8.626 1.352 1.00 . A A . 39 GLN CD 1 1 5 2868 1 1 39 GLN CG C -3.251 7.362 2.140 1.00 . A A . 39 GLN CG 1 1 5 2869 1 1 39 GLN H H 0.010 4.527 2.433 1.00 . A A . 39 GLN H 1 1 5 2870 1 1 39 GLN HA H -2.871 4.712 2.435 1.00 . A A . 39 GLN HA 1 1 5 2871 1 1 39 GLN HB2 H -1.961 6.690 3.732 1.00 . A A . 39 GLN HB2 1 1 5 2872 1 1 39 GLN HB3 H -1.105 7.193 2.289 1.00 . A A . 39 GLN HB3 1 1 5 2873 1 1 39 GLN HE21 H -4.842 9.184 1.472 1.00 . A A . 39 GLN HE21 1 1 5 2874 1 1 39 GLN HE22 H -3.806 10.283 0.624 1.00 . A A . 39 GLN HE22 1 1 5 2875 1 1 39 GLN HG2 H -3.822 6.682 1.507 1.00 . A A . 39 GLN HG2 1 1 5 2876 1 1 39 GLN HG3 H -3.888 7.621 2.985 1.00 . A A . 39 GLN HG3 1 1 5 2877 1 1 39 GLN N N -0.895 4.468 2.852 1.00 . A A . 39 GLN N 1 1 5 2878 1 1 39 GLN NE2 N -3.935 9.431 1.131 1.00 . A A . 39 GLN NE2 1 1 5 2879 1 1 39 GLN O O -2.378 4.340 -0.030 1.00 . A A . 39 GLN O 1 1 5 2880 1 1 39 GLN OE1 O -1.763 8.855 0.971 1.00 . A A . 39 GLN OE1 1 1 6 2881 1 1 1 MET C C 1.881 1.205 -0.540 1.00 . A A . 1 MET C 1 1 6 2882 1 1 1 MET CA C 0.960 1.053 -1.752 1.00 . A A . 1 MET CA 1 1 6 2883 1 1 1 MET CB C 0.062 2.286 -1.869 1.00 . A A . 1 MET CB 1 1 6 2884 1 1 1 MET CE C -0.484 2.717 -5.935 1.00 . A A . 1 MET CE 1 1 6 2885 1 1 1 MET CG C -0.631 2.333 -3.231 1.00 . A A . 1 MET CG 1 1 6 2886 1 1 1 MET H1 H -0.374 -0.215 -0.777 1.00 . A A . 1 MET H1 1 1 6 2887 1 1 1 MET HA H 1.556 0.909 -2.653 1.00 . A A . 1 MET HA 1 1 6 2888 1 1 1 MET HB2 H -0.686 2.273 -1.076 1.00 . A A . 1 MET HB2 1 1 6 2889 1 1 1 MET HB3 H 0.658 3.189 -1.729 1.00 . A A . 1 MET HB3 1 1 6 2890 1 1 1 MET HE1 H -0.244 3.479 -6.677 1.00 . A A . 1 MET HE1 1 1 6 2891 1 1 1 MET HE2 H -0.252 1.732 -6.338 1.00 . A A . 1 MET HE2 1 1 6 2892 1 1 1 MET HE3 H -1.546 2.770 -5.691 1.00 . A A . 1 MET HE3 1 1 6 2893 1 1 1 MET HG2 H -0.949 1.332 -3.521 1.00 . A A . 1 MET HG2 1 1 6 2894 1 1 1 MET HG3 H -1.530 2.947 -3.171 1.00 . A A . 1 MET HG3 1 1 6 2895 1 1 1 MET N N 0.136 -0.137 -1.634 1.00 . A A . 1 MET N 1 1 6 2896 1 1 1 MET O O 1.559 0.735 0.551 1.00 . A A . 1 MET O 1 1 6 2897 1 1 1 MET SD S 0.480 2.999 -4.460 1.00 . A A . 1 MET SD 1 1 6 2898 1 1 2 ASP C C 4.074 3.579 0.585 1.00 . A A . 2 ASP C 1 1 6 2899 1 1 2 ASP CA C 3.977 2.081 0.289 1.00 . A A . 2 ASP CA 1 1 6 2900 1 1 2 ASP CB C 5.366 1.591 -0.124 1.00 . A A . 2 ASP CB 1 1 6 2901 1 1 2 ASP CG C 5.780 1.950 -1.552 1.00 . A A . 2 ASP CG 1 1 6 2902 1 1 2 ASP H H 3.261 2.241 -1.661 1.00 . A A . 2 ASP H 1 1 6 2903 1 1 2 ASP HA H 3.605 1.511 1.140 1.00 . A A . 2 ASP HA 1 1 6 2904 1 1 2 ASP HB2 H 6.101 2.004 0.566 1.00 . A A . 2 ASP HB2 1 1 6 2905 1 1 2 ASP HB3 H 5.399 0.506 -0.014 1.00 . A A . 2 ASP HB3 1 1 6 2906 1 1 2 ASP HD2 H 6.931 3.320 -0.967 1.00 . A A . 2 ASP HD2 1 1 6 2907 1 1 2 ASP N N 3.007 1.862 -0.770 1.00 . A A . 2 ASP N 1 1 6 2908 1 1 2 ASP O O 4.934 4.269 0.040 1.00 . A A . 2 ASP O 1 1 6 2909 1 1 2 ASP OD1 O 5.074 1.632 -2.521 1.00 . A A . 2 ASP OD1 1 1 6 2910 1 1 2 ASP OD2 O 6.894 2.593 -1.652 1.00 . A A . 2 ASP OD2 1 1 6 2911 1 1 3 ILE C C 2.866 5.561 3.320 1.00 . A A . 3 ILE C 1 1 6 2912 1 1 3 ILE CA C 3.153 5.443 1.821 1.00 . A A . 3 ILE CA 1 1 6 2913 1 1 3 ILE CB C 2.165 6.213 0.943 1.00 . A A . 3 ILE CB 1 1 6 2914 1 1 3 ILE CD1 C 1.676 6.637 -1.494 1.00 . A A . 3 ILE CD1 1 1 6 2915 1 1 3 ILE CG1 C 2.769 6.512 -0.430 1.00 . A A . 3 ILE CG1 1 1 6 2916 1 1 3 ILE CG2 C 1.681 7.483 1.646 1.00 . A A . 3 ILE CG2 1 1 6 2917 1 1 3 ILE H H 2.482 3.471 1.886 1.00 . A A . 3 ILE H 1 1 6 2918 1 1 3 ILE HA H 4.144 5.852 1.626 1.00 . A A . 3 ILE HA 1 1 6 2919 1 1 3 ILE HB H 1.289 5.583 0.780 1.00 . A A . 3 ILE HB 1 1 6 2920 1 1 3 ILE HD11 H 1.298 7.658 -1.508 1.00 . A A . 3 ILE HD11 1 1 6 2921 1 1 3 ILE HD12 H 2.092 6.390 -2.471 1.00 . A A . 3 ILE HD12 1 1 6 2922 1 1 3 ILE HD13 H 0.863 5.950 -1.262 1.00 . A A . 3 ILE HD13 1 1 6 2923 1 1 3 ILE HG12 H 3.344 7.436 -0.384 1.00 . A A . 3 ILE HG12 1 1 6 2924 1 1 3 ILE HG13 H 3.462 5.718 -0.707 1.00 . A A . 3 ILE HG13 1 1 6 2925 1 1 3 ILE HG21 H 2.516 8.174 1.763 1.00 . A A . 3 ILE HG21 1 1 6 2926 1 1 3 ILE HG22 H 0.901 7.955 1.048 1.00 . A A . 3 ILE HG22 1 1 6 2927 1 1 3 ILE HG23 H 1.281 7.226 2.627 1.00 . A A . 3 ILE HG23 1 1 6 2928 1 1 3 ILE N N 3.179 4.039 1.447 1.00 . A A . 3 ILE N 1 1 6 2929 1 1 3 ILE O O 2.081 4.811 3.896 1.00 . A A . 3 ILE O 1 1 6 2930 1 1 4 TYR C C 2.729 8.138 5.588 1.00 . A A . 4 TYR C 1 1 6 2931 1 1 4 TYR CA C 3.371 6.777 5.365 1.00 . A A . 4 TYR CA 1 1 6 2932 1 1 4 TYR CB C 4.733 6.704 6.049 1.00 . A A . 4 TYR CB 1 1 6 2933 1 1 4 TYR CD1 C 4.516 4.539 7.323 1.00 . A A . 4 TYR CD1 1 1 6 2934 1 1 4 TYR CD2 C 6.263 4.739 5.653 1.00 . A A . 4 TYR CD2 1 1 6 2935 1 1 4 TYR CE1 C 4.931 3.231 7.600 1.00 . A A . 4 TYR CE1 1 1 6 2936 1 1 4 TYR CE2 C 6.679 3.432 5.930 1.00 . A A . 4 TYR CE2 1 1 6 2937 1 1 4 TYR CG C 5.182 5.292 6.349 1.00 . A A . 4 TYR CG 1 1 6 2938 1 1 4 TYR CZ C 6.013 2.677 6.905 1.00 . A A . 4 TYR CZ 1 1 6 2939 1 1 4 TYR H H 4.165 7.124 3.426 1.00 . A A . 4 TYR H 1 1 6 2940 1 1 4 TYR HA H 2.723 6.007 5.786 1.00 . A A . 4 TYR HA 1 1 6 2941 1 1 4 TYR HB2 H 5.474 7.173 5.401 1.00 . A A . 4 TYR HB2 1 1 6 2942 1 1 4 TYR HB3 H 4.684 7.258 6.986 1.00 . A A . 4 TYR HB3 1 1 6 2943 1 1 4 TYR HD1 H 3.682 4.966 7.859 1.00 . A A . 4 TYR HD1 1 1 6 2944 1 1 4 TYR HD2 H 6.777 5.321 4.902 1.00 . A A . 4 TYR HD2 1 1 6 2945 1 1 4 TYR HE1 H 4.418 2.648 8.351 1.00 . A A . 4 TYR HE1 1 1 6 2946 1 1 4 TYR HE2 H 7.513 3.004 5.394 1.00 . A A . 4 TYR HE2 1 1 6 2947 1 1 4 TYR HH H 6.019 1.043 7.970 1.00 . A A . 4 TYR HH 1 1 6 2948 1 1 4 TYR N N 3.530 6.535 3.946 1.00 . A A . 4 TYR N 1 1 6 2949 1 1 4 TYR O O 3.413 9.050 6.049 1.00 . A A . 4 TYR O 1 1 6 2950 1 1 4 TYR OH O 6.418 1.403 7.175 1.00 . A A . 4 TYR OH 1 1 6 2951 1 1 5 VAL C C 0.414 9.704 6.921 1.00 . A A . 5 VAL C 1 1 6 2952 1 1 5 VAL CA C 0.741 9.508 5.438 1.00 . A A . 5 VAL CA 1 1 6 2953 1 1 5 VAL CB C -0.501 9.537 4.544 1.00 . A A . 5 VAL CB 1 1 6 2954 1 1 5 VAL CG1 C -1.357 10.771 4.835 1.00 . A A . 5 VAL CG1 1 1 6 2955 1 1 5 VAL CG2 C -0.113 9.473 3.065 1.00 . A A . 5 VAL CG2 1 1 6 2956 1 1 5 VAL H H 0.899 7.505 4.890 1.00 . A A . 5 VAL H 1 1 6 2957 1 1 5 VAL HA H 1.407 10.308 5.117 1.00 . A A . 5 VAL HA 1 1 6 2958 1 1 5 VAL HB H -1.098 8.654 4.772 1.00 . A A . 5 VAL HB 1 1 6 2959 1 1 5 VAL HG11 H -1.896 10.627 5.771 1.00 . A A . 5 VAL HG11 1 1 6 2960 1 1 5 VAL HG12 H -0.715 11.648 4.916 1.00 . A A . 5 VAL HG12 1 1 6 2961 1 1 5 VAL HG13 H -2.070 10.918 4.023 1.00 . A A . 5 VAL HG13 1 1 6 2962 1 1 5 VAL HG21 H -0.656 10.241 2.514 1.00 . A A . 5 VAL HG21 1 1 6 2963 1 1 5 VAL HG22 H 0.959 9.642 2.963 1.00 . A A . 5 VAL HG22 1 1 6 2964 1 1 5 VAL HG23 H -0.365 8.491 2.665 1.00 . A A . 5 VAL HG23 1 1 6 2965 1 1 5 VAL N N 1.449 8.251 5.264 1.00 . A A . 5 VAL N 1 1 6 2966 1 1 5 VAL O O -0.324 8.914 7.507 1.00 . A A . 5 VAL O 1 1 6 2967 1 1 6 CYS C C -0.747 11.170 9.124 1.00 . A A . 6 CYS C 1 1 6 2968 1 1 6 CYS CA C 0.761 11.071 8.885 1.00 . A A . 6 CYS CA 1 1 6 2969 1 1 6 CYS CB C 1.490 12.349 9.304 1.00 . A A . 6 CYS CB 1 1 6 2970 1 1 6 CYS H H 1.581 11.397 6.998 1.00 . A A . 6 CYS H 1 1 6 2971 1 1 6 CYS HA H 1.190 10.249 9.459 1.00 . A A . 6 CYS HA 1 1 6 2972 1 1 6 CYS HB2 H 2.506 12.317 8.910 1.00 . A A . 6 CYS HB2 1 1 6 2973 1 1 6 CYS HB3 H 0.996 13.201 8.838 1.00 . A A . 6 CYS HB3 1 1 6 2974 1 1 6 CYS N N 0.981 10.760 7.483 1.00 . A A . 6 CYS N 1 1 6 2975 1 1 6 CYS O O -1.504 11.489 8.208 1.00 . A A . 6 CYS O 1 1 6 2976 1 1 6 CYS SG S 1.569 12.630 11.110 1.00 . A A . 6 CYS SG 1 1 6 2977 1 1 7 THR C C -2.799 12.116 11.679 1.00 . A A . 7 THR C 1 1 6 2978 1 1 7 THR CA C -2.543 10.945 10.729 1.00 . A A . 7 THR CA 1 1 6 2979 1 1 7 THR CB C -2.929 9.587 11.318 1.00 . A A . 7 THR CB 1 1 6 2980 1 1 7 THR CG2 C -2.854 8.458 10.288 1.00 . A A . 7 THR CG2 1 1 6 2981 1 1 7 THR H H -0.517 10.633 11.097 1.00 . A A . 7 THR H 1 1 6 2982 1 1 7 THR HA H -3.129 11.131 9.828 1.00 . A A . 7 THR HA 1 1 6 2983 1 1 7 THR HB H -3.915 9.629 11.778 1.00 . A A . 7 THR HB 1 1 6 2984 1 1 7 THR HG1 H -1.920 9.911 13.016 1.00 . A A . 7 THR HG1 1 1 6 2985 1 1 7 THR HG21 H -2.107 7.730 10.600 1.00 . A A . 7 THR HG21 1 1 6 2986 1 1 7 THR HG22 H -3.826 7.971 10.210 1.00 . A A . 7 THR HG22 1 1 6 2987 1 1 7 THR HG23 H -2.577 8.870 9.317 1.00 . A A . 7 THR HG23 1 1 6 2988 1 1 7 THR N N -1.138 10.891 10.358 1.00 . A A . 7 THR N 1 1 6 2989 1 1 7 THR O O -3.846 12.180 12.321 1.00 . A A . 7 THR O 1 1 6 2990 1 1 7 THR OG1 O -1.875 9.293 12.232 1.00 . A A . 7 THR OG1 1 1 6 2991 1 1 8 VAL C C -2.083 15.430 11.741 1.00 . A A . 8 VAL C 1 1 6 2992 1 1 8 VAL CA C -1.932 14.175 12.602 1.00 . A A . 8 VAL CA 1 1 6 2993 1 1 8 VAL CB C -0.729 14.240 13.546 1.00 . A A . 8 VAL CB 1 1 6 2994 1 1 8 VAL CG1 C -0.749 15.528 14.372 1.00 . A A . 8 VAL CG1 1 1 6 2995 1 1 8 VAL CG2 C -0.677 13.009 14.452 1.00 . A A . 8 VAL CG2 1 1 6 2996 1 1 8 VAL H H -0.976 12.950 11.215 1.00 . A A . 8 VAL H 1 1 6 2997 1 1 8 VAL HA H -2.830 14.055 13.208 1.00 . A A . 8 VAL HA 1 1 6 2998 1 1 8 VAL HB H 0.175 14.247 12.937 1.00 . A A . 8 VAL HB 1 1 6 2999 1 1 8 VAL HG11 H -0.171 15.383 15.285 1.00 . A A . 8 VAL HG11 1 1 6 3000 1 1 8 VAL HG12 H -0.311 16.339 13.791 1.00 . A A . 8 VAL HG12 1 1 6 3001 1 1 8 VAL HG13 H -1.778 15.780 14.629 1.00 . A A . 8 VAL HG13 1 1 6 3002 1 1 8 VAL HG21 H -1.537 12.371 14.249 1.00 . A A . 8 VAL HG21 1 1 6 3003 1 1 8 VAL HG22 H 0.241 12.454 14.257 1.00 . A A . 8 VAL HG22 1 1 6 3004 1 1 8 VAL HG23 H -0.697 13.324 15.495 1.00 . A A . 8 VAL HG23 1 1 6 3005 1 1 8 VAL N N -1.824 13.011 11.741 1.00 . A A . 8 VAL N 1 1 6 3006 1 1 8 VAL O O -3.018 16.208 11.927 1.00 . A A . 8 VAL O 1 1 6 3007 1 1 9 CYS C C -1.543 16.252 8.523 1.00 . A A . 9 CYS C 1 1 6 3008 1 1 9 CYS CA C -1.167 16.738 9.923 1.00 . A A . 9 CYS CA 1 1 6 3009 1 1 9 CYS CB C 0.172 17.479 9.929 1.00 . A A . 9 CYS CB 1 1 6 3010 1 1 9 CYS H H -0.391 14.954 10.669 1.00 . A A . 9 CYS H 1 1 6 3011 1 1 9 CYS HA H -1.920 17.423 10.311 1.00 . A A . 9 CYS HA 1 1 6 3012 1 1 9 CYS HB2 H 0.268 18.035 8.996 1.00 . A A . 9 CYS HB2 1 1 6 3013 1 1 9 CYS HB3 H 0.162 18.212 10.736 1.00 . A A . 9 CYS HB3 1 1 6 3014 1 1 9 CYS N N -1.149 15.591 10.815 1.00 . A A . 9 CYS N 1 1 6 3015 1 1 9 CYS O O -1.969 17.042 7.682 1.00 . A A . 9 CYS O 1 1 6 3016 1 1 9 CYS SG S 1.642 16.408 10.128 1.00 . A A . 9 CYS SG 1 1 6 3017 1 1 10 GLY C C -0.461 14.325 6.121 1.00 . A A . 10 GLY C 1 1 6 3018 1 1 10 GLY CA C -1.691 14.354 7.030 1.00 . A A . 10 GLY CA 1 1 6 3019 1 1 10 GLY H H -1.026 14.319 9.004 1.00 . A A . 10 GLY H 1 1 6 3020 1 1 10 GLY HA2 H -2.060 13.340 7.181 1.00 . A A . 10 GLY HA2 1 1 6 3021 1 1 10 GLY HA3 H -2.490 14.918 6.549 1.00 . A A . 10 GLY HA3 1 1 6 3022 1 1 10 GLY N N -1.373 14.955 8.315 1.00 . A A . 10 GLY N 1 1 6 3023 1 1 10 GLY O O -0.538 14.045 4.926 1.00 . A A . 10 GLY O 1 1 6 3024 1 1 11 TYR C C 1.993 13.483 5.012 1.00 . A A . 11 TYR C 1 1 6 3025 1 1 11 TYR CA C 1.948 14.643 5.997 1.00 . A A . 11 TYR CA 1 1 6 3026 1 1 11 TYR CB C 3.106 14.556 6.987 1.00 . A A . 11 TYR CB 1 1 6 3027 1 1 11 TYR CD1 C 4.660 15.708 5.372 1.00 . A A . 11 TYR CD1 1 1 6 3028 1 1 11 TYR CD2 C 5.522 13.887 6.722 1.00 . A A . 11 TYR CD2 1 1 6 3029 1 1 11 TYR CE1 C 5.918 15.861 4.776 1.00 . A A . 11 TYR CE1 1 1 6 3030 1 1 11 TYR CE2 C 6.779 14.039 6.125 1.00 . A A . 11 TYR CE2 1 1 6 3031 1 1 11 TYR CG C 4.462 14.721 6.345 1.00 . A A . 11 TYR CG 1 1 6 3032 1 1 11 TYR CZ C 6.977 15.026 5.152 1.00 . A A . 11 TYR CZ 1 1 6 3033 1 1 11 TYR H H 0.703 14.848 7.706 1.00 . A A . 11 TYR H 1 1 6 3034 1 1 11 TYR HA H 2.025 15.579 5.445 1.00 . A A . 11 TYR HA 1 1 6 3035 1 1 11 TYR HB2 H 2.980 15.335 7.739 1.00 . A A . 11 TYR HB2 1 1 6 3036 1 1 11 TYR HB3 H 3.071 13.584 7.481 1.00 . A A . 11 TYR HB3 1 1 6 3037 1 1 11 TYR HD1 H 3.844 16.352 5.081 1.00 . A A . 11 TYR HD1 1 1 6 3038 1 1 11 TYR HD2 H 5.369 13.125 7.472 1.00 . A A . 11 TYR HD2 1 1 6 3039 1 1 11 TYR HE1 H 6.071 16.622 4.025 1.00 . A A . 11 TYR HE1 1 1 6 3040 1 1 11 TYR HE2 H 7.596 13.395 6.416 1.00 . A A . 11 TYR HE2 1 1 6 3041 1 1 11 TYR HH H 8.243 14.812 3.683 1.00 . A A . 11 TYR HH 1 1 6 3042 1 1 11 TYR N N 0.693 14.625 6.721 1.00 . A A . 11 TYR N 1 1 6 3043 1 1 11 TYR O O 1.292 12.494 5.226 1.00 . A A . 11 TYR O 1 1 6 3044 1 1 11 TYR OH O 8.203 15.175 4.571 1.00 . A A . 11 TYR OH 1 1 6 3045 1 1 12 GLU C C 4.385 12.196 2.766 1.00 . A A . 12 GLU C 1 1 6 3046 1 1 12 GLU CA C 2.916 12.573 2.971 1.00 . A A . 12 GLU CA 1 1 6 3047 1 1 12 GLU CB C 2.270 12.998 1.651 1.00 . A A . 12 GLU CB 1 1 6 3048 1 1 12 GLU CD C 0.145 12.999 0.293 1.00 . A A . 12 GLU CD 1 1 6 3049 1 1 12 GLU CG C 0.850 12.441 1.530 1.00 . A A . 12 GLU CG 1 1 6 3050 1 1 12 GLU H H 3.364 14.428 3.803 1.00 . A A . 12 GLU H 1 1 6 3051 1 1 12 GLU HA H 2.369 11.722 3.378 1.00 . A A . 12 GLU HA 1 1 6 3052 1 1 12 GLU HB2 H 2.243 14.086 1.590 1.00 . A A . 12 GLU HB2 1 1 6 3053 1 1 12 GLU HB3 H 2.875 12.646 0.815 1.00 . A A . 12 GLU HB3 1 1 6 3054 1 1 12 GLU HE2 H 0.870 11.740 -0.905 1.00 . A A . 12 GLU HE2 1 1 6 3055 1 1 12 GLU HG2 H 0.886 11.353 1.472 1.00 . A A . 12 GLU HG2 1 1 6 3056 1 1 12 GLU HG3 H 0.279 12.693 2.424 1.00 . A A . 12 GLU HG3 1 1 6 3057 1 1 12 GLU N N 2.799 13.620 3.970 1.00 . A A . 12 GLU N 1 1 6 3058 1 1 12 GLU O O 5.189 12.964 2.243 1.00 . A A . 12 GLU O 1 1 6 3059 1 1 12 GLU OE1 O -0.896 13.662 0.419 1.00 . A A . 12 GLU OE1 1 1 6 3060 1 1 12 GLU OE2 O 0.717 12.726 -0.831 1.00 . A A . 12 GLU OE2 1 1 6 3061 1 1 13 TYR C C 6.163 9.517 1.893 1.00 . A A . 13 TYR C 1 1 6 3062 1 1 13 TYR CA C 6.072 10.471 3.075 1.00 . A A . 13 TYR CA 1 1 6 3063 1 1 13 TYR CB C 6.466 9.767 4.370 1.00 . A A . 13 TYR CB 1 1 6 3064 1 1 13 TYR CD1 C 8.963 10.116 4.369 1.00 . A A . 13 TYR CD1 1 1 6 3065 1 1 13 TYR CD2 C 8.102 7.849 4.340 1.00 . A A . 13 TYR CD2 1 1 6 3066 1 1 13 TYR CE1 C 10.272 9.619 4.357 1.00 . A A . 13 TYR CE1 1 1 6 3067 1 1 13 TYR CE2 C 9.411 7.352 4.328 1.00 . A A . 13 TYR CE2 1 1 6 3068 1 1 13 TYR CG C 7.878 9.231 4.360 1.00 . A A . 13 TYR CG 1 1 6 3069 1 1 13 TYR CZ C 10.496 8.237 4.337 1.00 . A A . 13 TYR CZ 1 1 6 3070 1 1 13 TYR H H 4.020 10.384 3.617 1.00 . A A . 13 TYR H 1 1 6 3071 1 1 13 TYR HA H 6.749 11.308 2.907 1.00 . A A . 13 TYR HA 1 1 6 3072 1 1 13 TYR HB2 H 6.369 10.474 5.195 1.00 . A A . 13 TYR HB2 1 1 6 3073 1 1 13 TYR HB3 H 5.781 8.937 4.539 1.00 . A A . 13 TYR HB3 1 1 6 3074 1 1 13 TYR HD1 H 8.790 11.182 4.384 1.00 . A A . 13 TYR HD1 1 1 6 3075 1 1 13 TYR HD2 H 7.265 7.166 4.332 1.00 . A A . 13 TYR HD2 1 1 6 3076 1 1 13 TYR HE1 H 11.109 10.301 4.364 1.00 . A A . 13 TYR HE1 1 1 6 3077 1 1 13 TYR HE2 H 9.584 6.286 4.312 1.00 . A A . 13 TYR HE2 1 1 6 3078 1 1 13 TYR HH H 11.825 6.834 4.598 1.00 . A A . 13 TYR HH 1 1 6 3079 1 1 13 TYR N N 4.720 10.977 3.195 1.00 . A A . 13 TYR N 1 1 6 3080 1 1 13 TYR O O 5.133 8.993 1.471 1.00 . A A . 13 TYR O 1 1 6 3081 1 1 13 TYR OH O 11.771 7.752 4.327 1.00 . A A . 13 TYR OH 1 1 6 3082 1 1 14 ASP C C 8.752 7.492 0.548 1.00 . A A . 14 ASP C 1 1 6 3083 1 1 14 ASP CA C 7.568 8.417 0.260 1.00 . A A . 14 ASP CA 1 1 6 3084 1 1 14 ASP CB C 7.881 9.203 -1.015 1.00 . A A . 14 ASP CB 1 1 6 3085 1 1 14 ASP CG C 7.526 8.486 -2.320 1.00 . A A . 14 ASP CG 1 1 6 3086 1 1 14 ASP H H 8.203 9.739 1.739 1.00 . A A . 14 ASP H 1 1 6 3087 1 1 14 ASP HA H 6.629 7.874 0.157 1.00 . A A . 14 ASP HA 1 1 6 3088 1 1 14 ASP HB2 H 7.345 10.151 -0.981 1.00 . A A . 14 ASP HB2 1 1 6 3089 1 1 14 ASP HB3 H 8.946 9.439 -1.026 1.00 . A A . 14 ASP HB3 1 1 6 3090 1 1 14 ASP HD2 H 6.469 9.936 -2.894 1.00 . A A . 14 ASP HD2 1 1 6 3091 1 1 14 ASP N N 7.371 9.310 1.389 1.00 . A A . 14 ASP N 1 1 6 3092 1 1 14 ASP O O 9.907 7.802 0.266 1.00 . A A . 14 ASP O 1 1 6 3093 1 1 14 ASP OD1 O 8.217 7.547 -2.741 1.00 . A A . 14 ASP OD1 1 1 6 3094 1 1 14 ASP OD2 O 6.476 8.936 -2.919 1.00 . A A . 14 ASP OD2 1 1 6 3095 1 1 15 PRO C C 10.516 5.279 0.458 1.00 . A A . 15 PRO C 1 1 6 3096 1 1 15 PRO CA C 9.391 5.307 1.483 1.00 . A A . 15 PRO CA 1 1 6 3097 1 1 15 PRO CB C 8.598 4.003 1.459 1.00 . A A . 15 PRO CB 1 1 6 3098 1 1 15 PRO CD C 7.085 5.933 1.470 1.00 . A A . 15 PRO CD 1 1 6 3099 1 1 15 PRO CG C 7.223 4.523 2.036 1.00 . A A . 15 PRO CG 1 1 6 3100 1 1 15 PRO HA H 9.801 5.486 2.477 1.00 . A A . 15 PRO HA 1 1 6 3101 1 1 15 PRO HB2 H 8.527 3.579 0.459 1.00 . A A . 15 PRO HB2 1 1 6 3102 1 1 15 PRO HB3 H 9.055 3.293 2.149 1.00 . A A . 15 PRO HB3 1 1 6 3103 1 1 15 PRO HD2 H 6.429 5.940 0.599 1.00 . A A . 15 PRO HD2 1 1 6 3104 1 1 15 PRO HD3 H 6.702 6.603 2.239 1.00 . A A . 15 PRO HD3 1 1 6 3105 1 1 15 PRO HG2 H 6.498 3.868 1.550 1.00 . A A . 15 PRO HG2 1 1 6 3106 1 1 15 PRO HG3 H 7.102 4.496 3.119 1.00 . A A . 15 PRO HG3 1 1 6 3107 1 1 15 PRO N N 8.433 6.331 1.124 1.00 . A A . 15 PRO N 1 1 6 3108 1 1 15 PRO O O 10.307 4.765 -0.640 1.00 . A A . 15 PRO O 1 1 6 3109 1 1 16 ALA C C 13.828 6.868 0.426 1.00 . A A . 16 ALA C 1 1 6 3110 1 1 16 ALA CA C 12.804 5.851 -0.080 1.00 . A A . 16 ALA CA 1 1 6 3111 1 1 16 ALA CB C 12.321 6.167 -1.497 1.00 . A A . 16 ALA CB 1 1 6 3112 1 1 16 ALA H H 11.829 6.241 1.719 1.00 . A A . 16 ALA H 1 1 6 3113 1 1 16 ALA HA H 13.255 4.860 -0.076 1.00 . A A . 16 ALA HA 1 1 6 3114 1 1 16 ALA HB1 H 12.332 5.256 -2.096 1.00 . A A . 16 ALA HB1 1 1 6 3115 1 1 16 ALA HB2 H 11.307 6.562 -1.456 1.00 . A A . 16 ALA HB2 1 1 6 3116 1 1 16 ALA HB3 H 12.981 6.907 -1.949 1.00 . A A . 16 ALA HB3 1 1 6 3117 1 1 16 ALA N N 11.667 5.824 0.825 1.00 . A A . 16 ALA N 1 1 6 3118 1 1 16 ALA O O 14.027 7.915 -0.189 1.00 . A A . 16 ALA O 1 1 6 3119 1 1 17 PHE C C 16.665 6.591 2.615 1.00 . A A . 17 PHE C 1 1 6 3120 1 1 17 PHE CA C 15.453 7.394 2.140 1.00 . A A . 17 PHE CA 1 1 6 3121 1 1 17 PHE CB C 14.797 8.068 3.347 1.00 . A A . 17 PHE CB 1 1 6 3122 1 1 17 PHE CD1 C 12.759 9.075 2.296 1.00 . A A . 17 PHE CD1 1 1 6 3123 1 1 17 PHE CD2 C 14.284 10.519 3.362 1.00 . A A . 17 PHE CD2 1 1 6 3124 1 1 17 PHE CE1 C 11.940 10.185 1.963 1.00 . A A . 17 PHE CE1 1 1 6 3125 1 1 17 PHE CE2 C 13.466 11.630 3.029 1.00 . A A . 17 PHE CE2 1 1 6 3126 1 1 17 PHE CG C 13.915 9.265 2.988 1.00 . A A . 17 PHE CG 1 1 6 3127 1 1 17 PHE CZ C 12.310 11.440 2.337 1.00 . A A . 17 PHE CZ 1 1 6 3128 1 1 17 PHE H H 14.287 5.672 2.038 1.00 . A A . 17 PHE H 1 1 6 3129 1 1 17 PHE HA H 15.767 8.102 1.372 1.00 . A A . 17 PHE HA 1 1 6 3130 1 1 17 PHE HB2 H 14.195 7.331 3.878 1.00 . A A . 17 PHE HB2 1 1 6 3131 1 1 17 PHE HB3 H 15.577 8.397 4.034 1.00 . A A . 17 PHE HB3 1 1 6 3132 1 1 17 PHE HD1 H 12.462 8.069 1.998 1.00 . A A . 17 PHE HD1 1 1 6 3133 1 1 17 PHE HD2 H 15.211 10.671 3.916 1.00 . A A . 17 PHE HD2 1 1 6 3134 1 1 17 PHE HE1 H 11.013 10.033 1.409 1.00 . A A . 17 PHE HE1 1 1 6 3135 1 1 17 PHE HE2 H 13.763 12.635 3.328 1.00 . A A . 17 PHE HE2 1 1 6 3136 1 1 17 PHE HZ H 11.681 12.292 2.081 1.00 . A A . 17 PHE HZ 1 1 6 3137 1 1 17 PHE N N 14.453 6.524 1.543 1.00 . A A . 17 PHE N 1 1 6 3138 1 1 17 PHE O O 16.769 5.396 2.342 1.00 . A A . 17 PHE O 1 1 6 3139 1 1 18 GLU C C 18.966 7.023 5.300 1.00 . A A . 18 GLU C 1 1 6 3140 1 1 18 GLU CA C 18.754 6.645 3.833 1.00 . A A . 18 GLU CA 1 1 6 3141 1 1 18 GLU CB C 19.975 7.016 2.989 1.00 . A A . 18 GLU CB 1 1 6 3142 1 1 18 GLU CD C 22.439 6.908 3.515 1.00 . A A . 18 GLU CD 1 1 6 3143 1 1 18 GLU CG C 21.159 6.098 3.305 1.00 . A A . 18 GLU CG 1 1 6 3144 1 1 18 GLU H H 17.461 8.252 3.534 1.00 . A A . 18 GLU H 1 1 6 3145 1 1 18 GLU HA H 18.574 5.573 3.749 1.00 . A A . 18 GLU HA 1 1 6 3146 1 1 18 GLU HB2 H 19.726 6.943 1.930 1.00 . A A . 18 GLU HB2 1 1 6 3147 1 1 18 GLU HB3 H 20.253 8.052 3.180 1.00 . A A . 18 GLU HB3 1 1 6 3148 1 1 18 GLU HE2 H 23.350 6.076 2.093 1.00 . A A . 18 GLU HE2 1 1 6 3149 1 1 18 GLU HG2 H 20.942 5.514 4.199 1.00 . A A . 18 GLU HG2 1 1 6 3150 1 1 18 GLU HG3 H 21.302 5.390 2.488 1.00 . A A . 18 GLU HG3 1 1 6 3151 1 1 18 GLU N N 17.553 7.279 3.317 1.00 . A A . 18 GLU N 1 1 6 3152 1 1 18 GLU O O 19.036 8.205 5.637 1.00 . A A . 18 GLU O 1 1 6 3153 1 1 18 GLU OE1 O 22.395 7.994 4.113 1.00 . A A . 18 GLU OE1 1 1 6 3154 1 1 18 GLU OE2 O 23.509 6.372 3.034 1.00 . A A . 18 GLU OE2 1 1 6 3155 1 1 19 ASP C C 17.925 6.540 8.216 1.00 . A A . 19 ASP C 1 1 6 3156 1 1 19 ASP CA C 19.266 6.210 7.558 1.00 . A A . 19 ASP CA 1 1 6 3157 1 1 19 ASP CB C 20.217 7.380 7.812 1.00 . A A . 19 ASP CB 1 1 6 3158 1 1 19 ASP CG C 21.163 7.199 9.000 1.00 . A A . 19 ASP CG 1 1 6 3159 1 1 19 ASP H H 19.005 5.042 5.853 1.00 . A A . 19 ASP H 1 1 6 3160 1 1 19 ASP HA H 19.693 5.278 7.927 1.00 . A A . 19 ASP HA 1 1 6 3161 1 1 19 ASP HB2 H 20.813 7.545 6.914 1.00 . A A . 19 ASP HB2 1 1 6 3162 1 1 19 ASP HB3 H 19.626 8.282 7.972 1.00 . A A . 19 ASP HB3 1 1 6 3163 1 1 19 ASP HD2 H 22.993 6.870 8.700 1.00 . A A . 19 ASP HD2 1 1 6 3164 1 1 19 ASP N N 19.062 5.999 6.135 1.00 . A A . 19 ASP N 1 1 6 3165 1 1 19 ASP O O 17.525 7.702 8.273 1.00 . A A . 19 ASP O 1 1 6 3166 1 1 19 ASP OD1 O 20.983 7.816 10.060 1.00 . A A . 19 ASP OD1 1 1 6 3167 1 1 19 ASP OD2 O 22.133 6.371 8.803 1.00 . A A . 19 ASP OD2 1 1 6 3168 1 1 20 LEU C C 16.071 5.150 10.790 1.00 . A A . 20 LEU C 1 1 6 3169 1 1 20 LEU CA C 15.977 5.660 9.351 1.00 . A A . 20 LEU CA 1 1 6 3170 1 1 20 LEU CB C 14.872 4.990 8.531 1.00 . A A . 20 LEU CB 1 1 6 3171 1 1 20 LEU CD1 C 12.576 5.583 7.674 1.00 . A A . 20 LEU CD1 1 1 6 3172 1 1 20 LEU CD2 C 12.835 4.295 9.844 1.00 . A A . 20 LEU CD2 1 1 6 3173 1 1 20 LEU CG C 13.438 5.353 8.918 1.00 . A A . 20 LEU CG 1 1 6 3174 1 1 20 LEU H H 17.597 4.554 8.648 1.00 . A A . 20 LEU H 1 1 6 3175 1 1 20 LEU HA H 15.758 6.727 9.377 1.00 . A A . 20 LEU HA 1 1 6 3176 1 1 20 LEU HB2 H 15.020 5.245 7.482 1.00 . A A . 20 LEU HB2 1 1 6 3177 1 1 20 LEU HB3 H 14.989 3.910 8.616 1.00 . A A . 20 LEU HB3 1 1 6 3178 1 1 20 LEU HD11 H 13.006 6.387 7.078 1.00 . A A . 20 LEU HD11 1 1 6 3179 1 1 20 LEU HD12 H 12.542 4.669 7.081 1.00 . A A . 20 LEU HD12 1 1 6 3180 1 1 20 LEU HD13 H 11.565 5.857 7.978 1.00 . A A . 20 LEU HD13 1 1 6 3181 1 1 20 LEU HD21 H 12.021 3.784 9.331 1.00 . A A . 20 LEU HD21 1 1 6 3182 1 1 20 LEU HD22 H 13.603 3.572 10.119 1.00 . A A . 20 LEU HD22 1 1 6 3183 1 1 20 LEU HD23 H 12.451 4.776 10.744 1.00 . A A . 20 LEU HD23 1 1 6 3184 1 1 20 LEU HG H 13.459 6.291 9.472 1.00 . A A . 20 LEU HG 1 1 6 3185 1 1 20 LEU N N 17.265 5.495 8.698 1.00 . A A . 20 LEU N 1 1 6 3186 1 1 20 LEU O O 15.701 4.021 11.108 1.00 . A A . 20 LEU O 1 1 6 3187 1 1 21 PRO C C 15.485 5.142 13.643 1.00 . A A . 21 PRO C 1 1 6 3188 1 1 21 PRO CA C 16.760 5.748 13.075 1.00 . A A . 21 PRO CA 1 1 6 3189 1 1 21 PRO CB C 17.046 7.110 13.703 1.00 . A A . 21 PRO CB 1 1 6 3190 1 1 21 PRO CD C 17.028 7.353 11.325 1.00 . A A . 21 PRO CD 1 1 6 3191 1 1 21 PRO CG C 17.712 7.873 12.587 1.00 . A A . 21 PRO CG 1 1 6 3192 1 1 21 PRO HA H 17.597 5.070 13.241 1.00 . A A . 21 PRO HA 1 1 6 3193 1 1 21 PRO HB2 H 16.140 7.597 14.064 1.00 . A A . 21 PRO HB2 1 1 6 3194 1 1 21 PRO HB3 H 17.767 6.989 14.511 1.00 . A A . 21 PRO HB3 1 1 6 3195 1 1 21 PRO HD2 H 16.193 7.994 11.043 1.00 . A A . 21 PRO HD2 1 1 6 3196 1 1 21 PRO HD3 H 17.751 7.291 10.511 1.00 . A A . 21 PRO HD3 1 1 6 3197 1 1 21 PRO HG2 H 17.605 8.957 12.633 1.00 . A A . 21 PRO HG2 1 1 6 3198 1 1 21 PRO HG3 H 18.763 7.586 12.637 1.00 . A A . 21 PRO HG3 1 1 6 3199 1 1 21 PRO N N 16.582 6.018 11.665 1.00 . A A . 21 PRO N 1 1 6 3200 1 1 21 PRO O O 14.462 5.165 12.962 1.00 . A A . 21 PRO O 1 1 6 3201 1 1 22 ASP C C 13.689 5.064 16.340 1.00 . A A . 22 ASP C 1 1 6 3202 1 1 22 ASP CA C 14.407 4.014 15.491 1.00 . A A . 22 ASP CA 1 1 6 3203 1 1 22 ASP CB C 14.820 2.863 16.411 1.00 . A A . 22 ASP CB 1 1 6 3204 1 1 22 ASP CG C 16.235 2.328 16.183 1.00 . A A . 22 ASP CG 1 1 6 3205 1 1 22 ASP H H 16.402 4.604 15.405 1.00 . A A . 22 ASP H 1 1 6 3206 1 1 22 ASP HA H 13.789 3.649 14.670 1.00 . A A . 22 ASP HA 1 1 6 3207 1 1 22 ASP HB2 H 14.734 3.196 17.446 1.00 . A A . 22 ASP HB2 1 1 6 3208 1 1 22 ASP HB3 H 14.113 2.042 16.282 1.00 . A A . 22 ASP HB3 1 1 6 3209 1 1 22 ASP HD2 H 17.222 1.304 17.416 1.00 . A A . 22 ASP HD2 1 1 6 3210 1 1 22 ASP N N 15.566 4.619 14.858 1.00 . A A . 22 ASP N 1 1 6 3211 1 1 22 ASP O O 13.186 4.756 17.420 1.00 . A A . 22 ASP O 1 1 6 3212 1 1 22 ASP OD1 O 16.620 2.001 15.052 1.00 . A A . 22 ASP OD1 1 1 6 3213 1 1 22 ASP OD2 O 16.967 2.254 17.244 1.00 . A A . 22 ASP OD2 1 1 6 3214 1 1 23 ASP C C 12.763 8.525 15.536 1.00 . A A . 23 ASP C 1 1 6 3215 1 1 23 ASP CA C 13.015 7.380 16.519 1.00 . A A . 23 ASP CA 1 1 6 3216 1 1 23 ASP CB C 13.899 7.913 17.649 1.00 . A A . 23 ASP CB 1 1 6 3217 1 1 23 ASP CG C 15.403 7.869 17.369 1.00 . A A . 23 ASP CG 1 1 6 3218 1 1 23 ASP H H 14.075 6.525 14.943 1.00 . A A . 23 ASP H 1 1 6 3219 1 1 23 ASP HA H 12.091 6.960 16.918 1.00 . A A . 23 ASP HA 1 1 6 3220 1 1 23 ASP HB2 H 13.614 8.944 17.857 1.00 . A A . 23 ASP HB2 1 1 6 3221 1 1 23 ASP HB3 H 13.695 7.337 18.552 1.00 . A A . 23 ASP HB3 1 1 6 3222 1 1 23 ASP HD2 H 16.690 8.225 16.041 1.00 . A A . 23 ASP HD2 1 1 6 3223 1 1 23 ASP N N 13.664 6.283 15.821 1.00 . A A . 23 ASP N 1 1 6 3224 1 1 23 ASP O O 13.267 9.631 15.722 1.00 . A A . 23 ASP O 1 1 6 3225 1 1 23 ASP OD1 O 16.171 7.230 18.105 1.00 . A A . 23 ASP OD1 1 1 6 3226 1 1 23 ASP OD2 O 15.785 8.535 16.333 1.00 . A A . 23 ASP OD2 1 1 6 3227 1 1 24 TRP C C 10.400 9.956 13.953 1.00 . A A . 24 TRP C 1 1 6 3228 1 1 24 TRP CA C 11.655 9.210 13.498 1.00 . A A . 24 TRP CA 1 1 6 3229 1 1 24 TRP CB C 11.497 8.556 12.124 1.00 . A A . 24 TRP CB 1 1 6 3230 1 1 24 TRP CD1 C 12.711 10.332 10.698 1.00 . A A . 24 TRP CD1 1 1 6 3231 1 1 24 TRP CD2 C 10.738 9.749 9.875 1.00 . A A . 24 TRP CD2 1 1 6 3232 1 1 24 TRP CE2 C 11.277 10.695 9.026 1.00 . A A . 24 TRP CE2 1 1 6 3233 1 1 24 TRP CE3 C 9.480 9.174 9.627 1.00 . A A . 24 TRP CE3 1 1 6 3234 1 1 24 TRP CG C 11.673 9.523 10.951 1.00 . A A . 24 TRP CG 1 1 6 3235 1 1 24 TRP CH2 C 9.371 10.590 7.605 1.00 . A A . 24 TRP CH2 1 1 6 3236 1 1 24 TRP CZ2 C 10.626 11.149 7.873 1.00 . A A . 24 TRP CZ2 1 1 6 3237 1 1 24 TRP CZ3 C 8.842 9.638 8.470 1.00 . A A . 24 TRP CZ3 1 1 6 3238 1 1 24 TRP H H 11.574 7.318 14.366 1.00 . A A . 24 TRP H 1 1 6 3239 1 1 24 TRP HA H 12.494 9.901 13.426 1.00 . A A . 24 TRP HA 1 1 6 3240 1 1 24 TRP HB2 H 12.223 7.750 12.030 1.00 . A A . 24 TRP HB2 1 1 6 3241 1 1 24 TRP HB3 H 10.508 8.102 12.061 1.00 . A A . 24 TRP HB3 1 1 6 3242 1 1 24 TRP HD1 H 13.599 10.406 11.326 1.00 . A A . 24 TRP HD1 1 1 6 3243 1 1 24 TRP HE1 H 13.203 11.789 9.115 1.00 . A A . 24 TRP HE1 1 1 6 3244 1 1 24 TRP HE3 H 9.034 8.425 10.281 1.00 . A A . 24 TRP HE3 1 1 6 3245 1 1 24 TRP HH2 H 8.810 10.899 6.723 1.00 . A A . 24 TRP HH2 1 1 6 3246 1 1 24 TRP HZ2 H 11.072 11.898 7.218 1.00 . A A . 24 TRP HZ2 1 1 6 3247 1 1 24 TRP HZ3 H 7.863 9.224 8.230 1.00 . A A . 24 TRP HZ3 1 1 6 3248 1 1 24 TRP N N 11.981 8.220 14.511 1.00 . A A . 24 TRP N 1 1 6 3249 1 1 24 TRP NE1 N 12.514 11.061 9.543 1.00 . A A . 24 TRP NE1 1 1 6 3250 1 1 24 TRP O O 9.472 9.349 14.487 1.00 . A A . 24 TRP O 1 1 6 3251 1 1 25 ALA C C 8.877 12.968 12.917 1.00 . A A . 25 ALA C 1 1 6 3252 1 1 25 ALA CA C 9.285 12.098 14.107 1.00 . A A . 25 ALA CA 1 1 6 3253 1 1 25 ALA CB C 9.658 12.928 15.337 1.00 . A A . 25 ALA CB 1 1 6 3254 1 1 25 ALA H H 11.170 11.747 13.292 1.00 . A A . 25 ALA H 1 1 6 3255 1 1 25 ALA HA H 8.456 11.439 14.366 1.00 . A A . 25 ALA HA 1 1 6 3256 1 1 25 ALA HB1 H 8.871 12.841 16.086 1.00 . A A . 25 ALA HB1 1 1 6 3257 1 1 25 ALA HB2 H 10.597 12.562 15.751 1.00 . A A . 25 ALA HB2 1 1 6 3258 1 1 25 ALA HB3 H 9.772 13.973 15.048 1.00 . A A . 25 ALA HB3 1 1 6 3259 1 1 25 ALA N N 10.411 11.261 13.726 1.00 . A A . 25 ALA N 1 1 6 3260 1 1 25 ALA O O 9.731 13.511 12.218 1.00 . A A . 25 ALA O 1 1 6 3261 1 1 26 CYS C C 7.730 15.233 11.647 1.00 . A A . 26 CYS C 1 1 6 3262 1 1 26 CYS CA C 7.039 13.869 11.629 1.00 . A A . 26 CYS CA 1 1 6 3263 1 1 26 CYS CB C 5.517 13.999 11.712 1.00 . A A . 26 CYS CB 1 1 6 3264 1 1 26 CYS H H 6.882 12.628 13.295 1.00 . A A . 26 CYS H 1 1 6 3265 1 1 26 CYS HA H 7.268 13.330 10.710 1.00 . A A . 26 CYS HA 1 1 6 3266 1 1 26 CYS HB2 H 5.086 13.004 11.831 1.00 . A A . 26 CYS HB2 1 1 6 3267 1 1 26 CYS HB3 H 5.262 14.564 12.610 1.00 . A A . 26 CYS HB3 1 1 6 3268 1 1 26 CYS N N 7.570 13.073 12.722 1.00 . A A . 26 CYS N 1 1 6 3269 1 1 26 CYS O O 7.871 15.879 12.682 1.00 . A A . 26 CYS O 1 1 6 3270 1 1 26 CYS SG S 4.735 14.809 10.270 1.00 . A A . 26 CYS SG 1 1 6 3271 1 1 27 PRO C C 7.844 18.065 10.364 1.00 . A A . 27 PRO C 1 1 6 3272 1 1 27 PRO CA C 8.841 16.922 10.244 1.00 . A A . 27 PRO CA 1 1 6 3273 1 1 27 PRO CB C 9.400 16.830 8.826 1.00 . A A . 27 PRO CB 1 1 6 3274 1 1 27 PRO CD C 8.013 14.927 9.222 1.00 . A A . 27 PRO CD 1 1 6 3275 1 1 27 PRO CG C 8.274 15.953 8.121 1.00 . A A . 27 PRO CG 1 1 6 3276 1 1 27 PRO HA H 9.650 17.059 10.962 1.00 . A A . 27 PRO HA 1 1 6 3277 1 1 27 PRO HB2 H 9.506 17.808 8.358 1.00 . A A . 27 PRO HB2 1 1 6 3278 1 1 27 PRO HB3 H 10.357 16.308 8.850 1.00 . A A . 27 PRO HB3 1 1 6 3279 1 1 27 PRO HD2 H 7.015 14.501 9.126 1.00 . A A . 27 PRO HD2 1 1 6 3280 1 1 27 PRO HD3 H 8.767 14.141 9.180 1.00 . A A . 27 PRO HD3 1 1 6 3281 1 1 27 PRO HG2 H 7.324 16.367 7.784 1.00 . A A . 27 PRO HG2 1 1 6 3282 1 1 27 PRO HG3 H 8.831 15.530 7.283 1.00 . A A . 27 PRO HG3 1 1 6 3283 1 1 27 PRO N N 8.163 15.662 10.459 1.00 . A A . 27 PRO N 1 1 6 3284 1 1 27 PRO O O 8.245 19.220 10.226 1.00 . A A . 27 PRO O 1 1 6 3285 1 1 28 VAL C C 5.029 18.752 12.182 1.00 . A A . 28 VAL C 1 1 6 3286 1 1 28 VAL CA C 5.555 18.748 10.745 1.00 . A A . 28 VAL CA 1 1 6 3287 1 1 28 VAL CB C 4.456 18.516 9.706 1.00 . A A . 28 VAL CB 1 1 6 3288 1 1 28 VAL CG1 C 3.389 19.609 9.784 1.00 . A A . 28 VAL CG1 1 1 6 3289 1 1 28 VAL CG2 C 5.045 18.423 8.297 1.00 . A A . 28 VAL CG2 1 1 6 3290 1 1 28 VAL H H 6.268 16.791 10.724 1.00 . A A . 28 VAL H 1 1 6 3291 1 1 28 VAL HA H 6.017 19.714 10.539 1.00 . A A . 28 VAL HA 1 1 6 3292 1 1 28 VAL HB H 3.977 17.563 9.932 1.00 . A A . 28 VAL HB 1 1 6 3293 1 1 28 VAL HG11 H 3.703 20.374 10.494 1.00 . A A . 28 VAL HG11 1 1 6 3294 1 1 28 VAL HG12 H 3.258 20.060 8.800 1.00 . A A . 28 VAL HG12 1 1 6 3295 1 1 28 VAL HG13 H 2.445 19.174 10.113 1.00 . A A . 28 VAL HG13 1 1 6 3296 1 1 28 VAL HG21 H 5.338 17.394 8.093 1.00 . A A . 28 VAL HG21 1 1 6 3297 1 1 28 VAL HG22 H 4.297 18.740 7.570 1.00 . A A . 28 VAL HG22 1 1 6 3298 1 1 28 VAL HG23 H 5.919 19.071 8.225 1.00 . A A . 28 VAL HG23 1 1 6 3299 1 1 28 VAL N N 6.586 17.733 10.613 1.00 . A A . 28 VAL N 1 1 6 3300 1 1 28 VAL O O 5.595 19.410 13.053 1.00 . A A . 28 VAL O 1 1 6 3301 1 1 29 CYS C C 4.451 17.681 14.728 1.00 . A A . 29 CYS C 1 1 6 3302 1 1 29 CYS CA C 3.342 17.916 13.700 1.00 . A A . 29 CYS CA 1 1 6 3303 1 1 29 CYS CB C 2.273 16.823 13.755 1.00 . A A . 29 CYS CB 1 1 6 3304 1 1 29 CYS H H 3.497 17.475 11.670 1.00 . A A . 29 CYS H 1 1 6 3305 1 1 29 CYS HA H 2.843 18.868 13.881 1.00 . A A . 29 CYS HA 1 1 6 3306 1 1 29 CYS HB2 H 1.919 16.730 14.781 1.00 . A A . 29 CYS HB2 1 1 6 3307 1 1 29 CYS HB3 H 1.422 17.137 13.151 1.00 . A A . 29 CYS HB3 1 1 6 3308 1 1 29 CYS N N 3.952 18.007 12.385 1.00 . A A . 29 CYS N 1 1 6 3309 1 1 29 CYS O O 4.472 18.316 15.781 1.00 . A A . 29 CYS O 1 1 6 3310 1 1 29 CYS SG S 2.828 15.177 13.177 1.00 . A A . 29 CYS SG 1 1 6 3311 1 1 30 GLY C C 6.199 15.127 16.009 1.00 . A A . 30 GLY C 1 1 6 3312 1 1 30 GLY CA C 6.456 16.439 15.266 1.00 . A A . 30 GLY CA 1 1 6 3313 1 1 30 GLY H H 5.323 16.254 13.527 1.00 . A A . 30 GLY H 1 1 6 3314 1 1 30 GLY HA2 H 7.374 16.358 14.683 1.00 . A A . 30 GLY HA2 1 1 6 3315 1 1 30 GLY HA3 H 6.606 17.245 15.984 1.00 . A A . 30 GLY HA3 1 1 6 3316 1 1 30 GLY N N 5.347 16.766 14.386 1.00 . A A . 30 GLY N 1 1 6 3317 1 1 30 GLY O O 7.073 14.626 16.713 1.00 . A A . 30 GLY O 1 1 6 3318 1 1 31 ALA C C 5.562 12.250 16.031 1.00 . A A . 31 ALA C 1 1 6 3319 1 1 31 ALA CA C 4.609 13.363 16.472 1.00 . A A . 31 ALA CA 1 1 6 3320 1 1 31 ALA CB C 3.149 13.046 16.140 1.00 . A A . 31 ALA CB 1 1 6 3321 1 1 31 ALA H H 4.287 15.021 15.252 1.00 . A A . 31 ALA H 1 1 6 3322 1 1 31 ALA HA H 4.702 13.505 17.548 1.00 . A A . 31 ALA HA 1 1 6 3323 1 1 31 ALA HB1 H 2.729 13.853 15.539 1.00 . A A . 31 ALA HB1 1 1 6 3324 1 1 31 ALA HB2 H 3.099 12.112 15.581 1.00 . A A . 31 ALA HB2 1 1 6 3325 1 1 31 ALA HB3 H 2.580 12.948 17.064 1.00 . A A . 31 ALA HB3 1 1 6 3326 1 1 31 ALA N N 4.993 14.607 15.827 1.00 . A A . 31 ALA N 1 1 6 3327 1 1 31 ALA O O 6.281 12.399 15.045 1.00 . A A . 31 ALA O 1 1 6 3328 1 1 32 SER C C 5.827 9.249 15.290 1.00 . A A . 32 SER C 1 1 6 3329 1 1 32 SER CA C 6.389 10.023 16.484 1.00 . A A . 32 SER CA 1 1 6 3330 1 1 32 SER CB C 6.525 9.101 17.697 1.00 . A A . 32 SER CB 1 1 6 3331 1 1 32 SER H H 4.948 11.048 17.585 1.00 . A A . 32 SER H 1 1 6 3332 1 1 32 SER HA H 7.363 10.449 16.240 1.00 . A A . 32 SER HA 1 1 6 3333 1 1 32 SER HB2 H 7.125 8.232 17.427 1.00 . A A . 32 SER HB2 1 1 6 3334 1 1 32 SER HB3 H 7.060 9.624 18.491 1.00 . A A . 32 SER HB3 1 1 6 3335 1 1 32 SER HG H 4.981 9.234 18.963 1.00 . A A . 32 SER HG 1 1 6 3336 1 1 32 SER N N 5.537 11.160 16.784 1.00 . A A . 32 SER N 1 1 6 3337 1 1 32 SER O O 4.738 9.551 14.806 1.00 . A A . 32 SER O 1 1 6 3338 1 1 32 SER OG O 5.258 8.670 18.185 1.00 . A A . 32 SER OG 1 1 6 3339 1 1 33 LYS C C 5.264 6.330 14.214 1.00 . A A . 33 LYS C 1 1 6 3340 1 1 33 LYS CA C 6.189 7.444 13.721 1.00 . A A . 33 LYS CA 1 1 6 3341 1 1 33 LYS CB C 7.414 6.934 12.959 1.00 . A A . 33 LYS CB 1 1 6 3342 1 1 33 LYS CD C 9.525 6.102 14.060 1.00 . A A . 33 LYS CD 1 1 6 3343 1 1 33 LYS CE C 9.933 5.426 15.372 1.00 . A A . 33 LYS CE 1 1 6 3344 1 1 33 LYS CG C 8.075 5.770 13.701 1.00 . A A . 33 LYS CG 1 1 6 3345 1 1 33 LYS H H 7.481 8.024 15.248 1.00 . A A . 33 LYS H 1 1 6 3346 1 1 33 LYS HA H 5.628 8.083 13.038 1.00 . A A . 33 LYS HA 1 1 6 3347 1 1 33 LYS HB2 H 7.119 6.613 11.961 1.00 . A A . 33 LYS HB2 1 1 6 3348 1 1 33 LYS HB3 H 8.132 7.744 12.833 1.00 . A A . 33 LYS HB3 1 1 6 3349 1 1 33 LYS HD2 H 10.186 5.775 13.258 1.00 . A A . 33 LYS HD2 1 1 6 3350 1 1 33 LYS HD3 H 9.643 7.181 14.151 1.00 . A A . 33 LYS HD3 1 1 6 3351 1 1 33 LYS HE2 H 10.539 6.109 15.966 1.00 . A A . 33 LYS HE2 1 1 6 3352 1 1 33 LYS HE3 H 9.044 5.194 15.959 1.00 . A A . 33 LYS HE3 1 1 6 3353 1 1 33 LYS HG2 H 7.514 5.546 14.607 1.00 . A A . 33 LYS HG2 1 1 6 3354 1 1 33 LYS HG3 H 8.046 4.875 13.079 1.00 . A A . 33 LYS HG3 1 1 6 3355 1 1 33 LYS HZ1 H 10.551 3.852 14.153 1.00 . A A . 33 LYS HZ1 1 1 6 3356 1 1 33 LYS HZ2 H 11.692 4.320 15.217 1.00 . A A . 33 LYS HZ2 1 1 6 3357 1 1 33 LYS N N 6.596 8.264 14.849 1.00 . A A . 33 LYS N 1 1 6 3358 1 1 33 LYS NZ N 10.693 4.185 15.100 1.00 . A A . 33 LYS NZ 1 1 6 3359 1 1 33 LYS O O 5.471 5.160 13.897 1.00 . A A . 33 LYS O 1 1 6 3360 1 1 34 ASP C C 1.934 6.029 14.882 1.00 . A A . 34 ASP C 1 1 6 3361 1 1 34 ASP CA C 3.302 5.783 15.520 1.00 . A A . 34 ASP CA 1 1 6 3362 1 1 34 ASP CB C 3.156 5.950 17.034 1.00 . A A . 34 ASP CB 1 1 6 3363 1 1 34 ASP CG C 2.222 4.941 17.707 1.00 . A A . 34 ASP CG 1 1 6 3364 1 1 34 ASP H H 4.098 7.687 15.233 1.00 . A A . 34 ASP H 1 1 6 3365 1 1 34 ASP HA H 3.706 4.801 15.277 1.00 . A A . 34 ASP HA 1 1 6 3366 1 1 34 ASP HB2 H 4.142 5.871 17.491 1.00 . A A . 34 ASP HB2 1 1 6 3367 1 1 34 ASP HB3 H 2.788 6.955 17.240 1.00 . A A . 34 ASP HB3 1 1 6 3368 1 1 34 ASP HD2 H 0.392 4.951 17.263 1.00 . A A . 34 ASP HD2 1 1 6 3369 1 1 34 ASP N N 4.261 6.733 14.981 1.00 . A A . 34 ASP N 1 1 6 3370 1 1 34 ASP O O 1.316 5.104 14.356 1.00 . A A . 34 ASP O 1 1 6 3371 1 1 34 ASP OD1 O 2.622 3.808 18.014 1.00 . A A . 34 ASP OD1 1 1 6 3372 1 1 34 ASP OD2 O 1.023 5.364 17.920 1.00 . A A . 34 ASP OD2 1 1 6 3373 1 1 35 ALA C C 0.208 7.341 12.888 1.00 . A A . 35 ALA C 1 1 6 3374 1 1 35 ALA CA C 0.215 7.657 14.386 1.00 . A A . 35 ALA CA 1 1 6 3375 1 1 35 ALA CB C -0.053 9.135 14.671 1.00 . A A . 35 ALA CB 1 1 6 3376 1 1 35 ALA H H 2.008 8.024 15.381 1.00 . A A . 35 ALA H 1 1 6 3377 1 1 35 ALA HA H -0.552 7.059 14.878 1.00 . A A . 35 ALA HA 1 1 6 3378 1 1 35 ALA HB1 H 0.590 9.471 15.485 1.00 . A A . 35 ALA HB1 1 1 6 3379 1 1 35 ALA HB2 H 0.156 9.721 13.776 1.00 . A A . 35 ALA HB2 1 1 6 3380 1 1 35 ALA HB3 H -1.097 9.267 14.956 1.00 . A A . 35 ALA HB3 1 1 6 3381 1 1 35 ALA N N 1.500 7.279 14.950 1.00 . A A . 35 ALA N 1 1 6 3382 1 1 35 ALA O O -0.853 7.148 12.296 1.00 . A A . 35 ALA O 1 1 6 3383 1 1 36 PHE C C 1.028 5.609 10.573 1.00 . A A . 36 PHE C 1 1 6 3384 1 1 36 PHE CA C 1.550 7.009 10.904 1.00 . A A . 36 PHE CA 1 1 6 3385 1 1 36 PHE CB C 3.044 7.072 10.585 1.00 . A A . 36 PHE CB 1 1 6 3386 1 1 36 PHE CD1 C 3.936 9.209 11.537 1.00 . A A . 36 PHE CD1 1 1 6 3387 1 1 36 PHE CD2 C 3.726 9.042 9.197 1.00 . A A . 36 PHE CD2 1 1 6 3388 1 1 36 PHE CE1 C 4.443 10.529 11.396 1.00 . A A . 36 PHE CE1 1 1 6 3389 1 1 36 PHE CE2 C 4.232 10.361 9.057 1.00 . A A . 36 PHE CE2 1 1 6 3390 1 1 36 PHE CG C 3.589 8.494 10.433 1.00 . A A . 36 PHE CG 1 1 6 3391 1 1 36 PHE CZ C 4.579 11.076 10.159 1.00 . A A . 36 PHE CZ 1 1 6 3392 1 1 36 PHE H H 2.263 7.456 12.809 1.00 . A A . 36 PHE H 1 1 6 3393 1 1 36 PHE HA H 0.963 7.750 10.360 1.00 . A A . 36 PHE HA 1 1 6 3394 1 1 36 PHE HB2 H 3.596 6.565 11.377 1.00 . A A . 36 PHE HB2 1 1 6 3395 1 1 36 PHE HB3 H 3.233 6.521 9.662 1.00 . A A . 36 PHE HB3 1 1 6 3396 1 1 36 PHE HD1 H 3.827 8.770 12.528 1.00 . A A . 36 PHE HD1 1 1 6 3397 1 1 36 PHE HD2 H 3.448 8.468 8.312 1.00 . A A . 36 PHE HD2 1 1 6 3398 1 1 36 PHE HE1 H 4.721 11.103 12.281 1.00 . A A . 36 PHE HE1 1 1 6 3399 1 1 36 PHE HE2 H 4.342 10.799 8.065 1.00 . A A . 36 PHE HE2 1 1 6 3400 1 1 36 PHE HZ H 4.967 12.089 10.051 1.00 . A A . 36 PHE HZ 1 1 6 3401 1 1 36 PHE N N 1.404 7.298 12.321 1.00 . A A . 36 PHE N 1 1 6 3402 1 1 36 PHE O O 1.335 4.646 11.275 1.00 . A A . 36 PHE O 1 1 6 3403 1 1 37 GLU C C 0.130 3.950 7.646 1.00 . A A . 37 GLU C 1 1 6 3404 1 1 37 GLU CA C -0.319 4.273 9.072 1.00 . A A . 37 GLU CA 1 1 6 3405 1 1 37 GLU CB C -1.846 4.293 9.176 1.00 . A A . 37 GLU CB 1 1 6 3406 1 1 37 GLU CD C -1.790 1.786 9.452 1.00 . A A . 37 GLU CD 1 1 6 3407 1 1 37 GLU CG C -2.443 2.960 8.719 1.00 . A A . 37 GLU CG 1 1 6 3408 1 1 37 GLU H H 0.003 6.327 8.939 1.00 . A A . 37 GLU H 1 1 6 3409 1 1 37 GLU HA H 0.077 3.529 9.763 1.00 . A A . 37 GLU HA 1 1 6 3410 1 1 37 GLU HB2 H -2.141 4.494 10.206 1.00 . A A . 37 GLU HB2 1 1 6 3411 1 1 37 GLU HB3 H -2.245 5.102 8.566 1.00 . A A . 37 GLU HB3 1 1 6 3412 1 1 37 GLU HE2 H -2.052 -0.078 9.445 1.00 . A A . 37 GLU HE2 1 1 6 3413 1 1 37 GLU HG2 H -3.517 2.957 8.903 1.00 . A A . 37 GLU HG2 1 1 6 3414 1 1 37 GLU HG3 H -2.304 2.844 7.645 1.00 . A A . 37 GLU HG3 1 1 6 3415 1 1 37 GLU N N 0.248 5.539 9.505 1.00 . A A . 37 GLU N 1 1 6 3416 1 1 37 GLU O O 0.330 4.853 6.835 1.00 . A A . 37 GLU O 1 1 6 3417 1 1 37 GLU OE1 O -1.289 1.958 10.574 1.00 . A A . 37 GLU OE1 1 1 6 3418 1 1 37 GLU OE2 O -1.816 0.664 8.818 1.00 . A A . 37 GLU OE2 1 1 6 3419 1 1 38 LYS C C -0.534 2.013 5.182 1.00 . A A . 38 LYS C 1 1 6 3420 1 1 38 LYS CA C 0.697 2.206 6.070 1.00 . A A . 38 LYS CA 1 1 6 3421 1 1 38 LYS CB C 1.571 0.955 6.189 1.00 . A A . 38 LYS CB 1 1 6 3422 1 1 38 LYS CD C 1.951 0.027 3.875 1.00 . A A . 38 LYS CD 1 1 6 3423 1 1 38 LYS CE C 2.564 -1.374 3.835 1.00 . A A . 38 LYS CE 1 1 6 3424 1 1 38 LYS CG C 2.547 0.854 5.016 1.00 . A A . 38 LYS CG 1 1 6 3425 1 1 38 LYS H H 0.111 1.931 8.050 1.00 . A A . 38 LYS H 1 1 6 3426 1 1 38 LYS HA H 1.317 2.991 5.636 1.00 . A A . 38 LYS HA 1 1 6 3427 1 1 38 LYS HB2 H 2.125 0.982 7.128 1.00 . A A . 38 LYS HB2 1 1 6 3428 1 1 38 LYS HB3 H 0.938 0.067 6.219 1.00 . A A . 38 LYS HB3 1 1 6 3429 1 1 38 LYS HD2 H 0.870 -0.048 4.002 1.00 . A A . 38 LYS HD2 1 1 6 3430 1 1 38 LYS HD3 H 2.125 0.532 2.926 1.00 . A A . 38 LYS HD3 1 1 6 3431 1 1 38 LYS HE2 H 3.016 -1.551 2.859 1.00 . A A . 38 LYS HE2 1 1 6 3432 1 1 38 LYS HE3 H 3.361 -1.451 4.574 1.00 . A A . 38 LYS HE3 1 1 6 3433 1 1 38 LYS HG2 H 2.793 1.853 4.656 1.00 . A A . 38 LYS HG2 1 1 6 3434 1 1 38 LYS HG3 H 3.479 0.398 5.352 1.00 . A A . 38 LYS HG3 1 1 6 3435 1 1 38 LYS HZ1 H 1.450 -3.065 3.342 1.00 . A A . 38 LYS HZ1 1 1 6 3436 1 1 38 LYS HZ2 H 1.735 -2.935 4.939 1.00 . A A . 38 LYS HZ2 1 1 6 3437 1 1 38 LYS N N 0.275 2.659 7.384 1.00 . A A . 38 LYS N 1 1 6 3438 1 1 38 LYS NZ N 1.531 -2.399 4.103 1.00 . A A . 38 LYS NZ 1 1 6 3439 1 1 38 LYS O O -1.201 0.982 5.255 1.00 . A A . 38 LYS O 1 1 6 3440 1 1 39 GLN C C -1.567 3.583 2.108 1.00 . A A . 39 GLN C 1 1 6 3441 1 1 39 GLN CA C -1.937 2.976 3.463 1.00 . A A . 39 GLN CA 1 1 6 3442 1 1 39 GLN CB C -3.146 3.689 4.072 1.00 . A A . 39 GLN CB 1 1 6 3443 1 1 39 GLN CD C -4.816 1.845 3.651 1.00 . A A . 39 GLN CD 1 1 6 3444 1 1 39 GLN CG C -4.106 2.686 4.716 1.00 . A A . 39 GLN CG 1 1 6 3445 1 1 39 GLN H H -0.250 3.856 4.311 1.00 . A A . 39 GLN H 1 1 6 3446 1 1 39 GLN HA H -2.169 1.918 3.343 1.00 . A A . 39 GLN HA 1 1 6 3447 1 1 39 GLN HB2 H -2.810 4.407 4.819 1.00 . A A . 39 GLN HB2 1 1 6 3448 1 1 39 GLN HB3 H -3.668 4.253 3.298 1.00 . A A . 39 GLN HB3 1 1 6 3449 1 1 39 GLN HE21 H -6.517 2.869 4.044 1.00 . A A . 39 GLN HE21 1 1 6 3450 1 1 39 GLN HE22 H -6.650 1.653 2.818 1.00 . A A . 39 GLN HE22 1 1 6 3451 1 1 39 GLN HG2 H -3.556 2.033 5.393 1.00 . A A . 39 GLN HG2 1 1 6 3452 1 1 39 GLN HG3 H -4.845 3.218 5.315 1.00 . A A . 39 GLN HG3 1 1 6 3453 1 1 39 GLN N N -0.797 3.021 4.364 1.00 . A A . 39 GLN N 1 1 6 3454 1 1 39 GLN NE2 N -6.101 2.147 3.491 1.00 . A A . 39 GLN NE2 1 1 6 3455 1 1 39 GLN O O -1.992 3.089 1.066 1.00 . A A . 39 GLN O 1 1 6 3456 1 1 39 GLN OE1 O -4.234 0.980 3.017 1.00 . A A . 39 GLN OE1 1 1 7 3457 1 1 1 MET C C 1.881 1.205 -0.540 1.00 . A A . 1 MET C 1 1 7 3458 1 1 1 MET CA C 0.960 1.053 -1.752 1.00 . A A . 1 MET CA 1 1 7 3459 1 1 1 MET CB C 0.062 2.286 -1.869 1.00 . A A . 1 MET CB 1 1 7 3460 1 1 1 MET CE C -0.484 2.717 -5.935 1.00 . A A . 1 MET CE 1 1 7 3461 1 1 1 MET CG C -0.631 2.333 -3.231 1.00 . A A . 1 MET CG 1 1 7 3462 1 1 1 MET H1 H -0.374 -0.215 -0.777 1.00 . A A . 1 MET H1 1 1 7 3463 1 1 1 MET HA H 1.556 0.909 -2.653 1.00 . A A . 1 MET HA 1 1 7 3464 1 1 1 MET HB2 H -0.686 2.273 -1.076 1.00 . A A . 1 MET HB2 1 1 7 3465 1 1 1 MET HB3 H 0.658 3.189 -1.729 1.00 . A A . 1 MET HB3 1 1 7 3466 1 1 1 MET HE1 H -0.244 3.479 -6.677 1.00 . A A . 1 MET HE1 1 1 7 3467 1 1 1 MET HE2 H -0.252 1.732 -6.338 1.00 . A A . 1 MET HE2 1 1 7 3468 1 1 1 MET HE3 H -1.546 2.770 -5.691 1.00 . A A . 1 MET HE3 1 1 7 3469 1 1 1 MET HG2 H -0.949 1.332 -3.521 1.00 . A A . 1 MET HG2 1 1 7 3470 1 1 1 MET HG3 H -1.530 2.947 -3.171 1.00 . A A . 1 MET HG3 1 1 7 3471 1 1 1 MET N N 0.136 -0.137 -1.634 1.00 . A A . 1 MET N 1 1 7 3472 1 1 1 MET O O 1.559 0.735 0.551 1.00 . A A . 1 MET O 1 1 7 3473 1 1 1 MET SD S 0.480 2.999 -4.460 1.00 . A A . 1 MET SD 1 1 7 3474 1 1 2 ASP C C 4.074 3.579 0.585 1.00 . A A . 2 ASP C 1 1 7 3475 1 1 2 ASP CA C 3.977 2.081 0.289 1.00 . A A . 2 ASP CA 1 1 7 3476 1 1 2 ASP CB C 5.366 1.591 -0.124 1.00 . A A . 2 ASP CB 1 1 7 3477 1 1 2 ASP CG C 5.780 1.950 -1.552 1.00 . A A . 2 ASP CG 1 1 7 3478 1 1 2 ASP H H 3.261 2.241 -1.661 1.00 . A A . 2 ASP H 1 1 7 3479 1 1 2 ASP HA H 3.605 1.511 1.140 1.00 . A A . 2 ASP HA 1 1 7 3480 1 1 2 ASP HB2 H 6.101 2.004 0.566 1.00 . A A . 2 ASP HB2 1 1 7 3481 1 1 2 ASP HB3 H 5.399 0.506 -0.014 1.00 . A A . 2 ASP HB3 1 1 7 3482 1 1 2 ASP HD2 H 6.931 3.320 -0.967 1.00 . A A . 2 ASP HD2 1 1 7 3483 1 1 2 ASP N N 3.007 1.862 -0.770 1.00 . A A . 2 ASP N 1 1 7 3484 1 1 2 ASP O O 4.934 4.269 0.040 1.00 . A A . 2 ASP O 1 1 7 3485 1 1 2 ASP OD1 O 5.074 1.632 -2.521 1.00 . A A . 2 ASP OD1 1 1 7 3486 1 1 2 ASP OD2 O 6.894 2.593 -1.652 1.00 . A A . 2 ASP OD2 1 1 7 3487 1 1 3 ILE C C 2.866 5.561 3.320 1.00 . A A . 3 ILE C 1 1 7 3488 1 1 3 ILE CA C 3.153 5.443 1.821 1.00 . A A . 3 ILE CA 1 1 7 3489 1 1 3 ILE CB C 2.165 6.213 0.943 1.00 . A A . 3 ILE CB 1 1 7 3490 1 1 3 ILE CD1 C 1.676 6.637 -1.494 1.00 . A A . 3 ILE CD1 1 1 7 3491 1 1 3 ILE CG1 C 2.769 6.512 -0.430 1.00 . A A . 3 ILE CG1 1 1 7 3492 1 1 3 ILE CG2 C 1.681 7.483 1.646 1.00 . A A . 3 ILE CG2 1 1 7 3493 1 1 3 ILE H H 2.482 3.471 1.886 1.00 . A A . 3 ILE H 1 1 7 3494 1 1 3 ILE HA H 4.144 5.852 1.626 1.00 . A A . 3 ILE HA 1 1 7 3495 1 1 3 ILE HB H 1.289 5.583 0.780 1.00 . A A . 3 ILE HB 1 1 7 3496 1 1 3 ILE HD11 H 1.298 7.658 -1.508 1.00 . A A . 3 ILE HD11 1 1 7 3497 1 1 3 ILE HD12 H 2.092 6.390 -2.471 1.00 . A A . 3 ILE HD12 1 1 7 3498 1 1 3 ILE HD13 H 0.863 5.950 -1.262 1.00 . A A . 3 ILE HD13 1 1 7 3499 1 1 3 ILE HG12 H 3.344 7.436 -0.384 1.00 . A A . 3 ILE HG12 1 1 7 3500 1 1 3 ILE HG13 H 3.462 5.718 -0.707 1.00 . A A . 3 ILE HG13 1 1 7 3501 1 1 3 ILE HG21 H 2.516 8.174 1.763 1.00 . A A . 3 ILE HG21 1 1 7 3502 1 1 3 ILE HG22 H 0.901 7.955 1.048 1.00 . A A . 3 ILE HG22 1 1 7 3503 1 1 3 ILE HG23 H 1.281 7.226 2.627 1.00 . A A . 3 ILE HG23 1 1 7 3504 1 1 3 ILE N N 3.179 4.039 1.447 1.00 . A A . 3 ILE N 1 1 7 3505 1 1 3 ILE O O 2.081 4.811 3.896 1.00 . A A . 3 ILE O 1 1 7 3506 1 1 4 TYR C C 2.729 8.138 5.588 1.00 . A A . 4 TYR C 1 1 7 3507 1 1 4 TYR CA C 3.371 6.777 5.365 1.00 . A A . 4 TYR CA 1 1 7 3508 1 1 4 TYR CB C 4.733 6.704 6.049 1.00 . A A . 4 TYR CB 1 1 7 3509 1 1 4 TYR CD1 C 4.516 4.539 7.323 1.00 . A A . 4 TYR CD1 1 1 7 3510 1 1 4 TYR CD2 C 6.263 4.739 5.653 1.00 . A A . 4 TYR CD2 1 1 7 3511 1 1 4 TYR CE1 C 4.931 3.231 7.600 1.00 . A A . 4 TYR CE1 1 1 7 3512 1 1 4 TYR CE2 C 6.679 3.432 5.930 1.00 . A A . 4 TYR CE2 1 1 7 3513 1 1 4 TYR CG C 5.182 5.292 6.349 1.00 . A A . 4 TYR CG 1 1 7 3514 1 1 4 TYR CZ C 6.013 2.677 6.905 1.00 . A A . 4 TYR CZ 1 1 7 3515 1 1 4 TYR H H 4.165 7.124 3.426 1.00 . A A . 4 TYR H 1 1 7 3516 1 1 4 TYR HA H 2.723 6.007 5.786 1.00 . A A . 4 TYR HA 1 1 7 3517 1 1 4 TYR HB2 H 5.474 7.173 5.401 1.00 . A A . 4 TYR HB2 1 1 7 3518 1 1 4 TYR HB3 H 4.684 7.258 6.986 1.00 . A A . 4 TYR HB3 1 1 7 3519 1 1 4 TYR HD1 H 3.682 4.966 7.859 1.00 . A A . 4 TYR HD1 1 1 7 3520 1 1 4 TYR HD2 H 6.777 5.321 4.902 1.00 . A A . 4 TYR HD2 1 1 7 3521 1 1 4 TYR HE1 H 4.418 2.648 8.351 1.00 . A A . 4 TYR HE1 1 1 7 3522 1 1 4 TYR HE2 H 7.513 3.004 5.394 1.00 . A A . 4 TYR HE2 1 1 7 3523 1 1 4 TYR HH H 6.019 1.043 7.970 1.00 . A A . 4 TYR HH 1 1 7 3524 1 1 4 TYR N N 3.530 6.535 3.946 1.00 . A A . 4 TYR N 1 1 7 3525 1 1 4 TYR O O 3.413 9.050 6.049 1.00 . A A . 4 TYR O 1 1 7 3526 1 1 4 TYR OH O 6.418 1.403 7.175 1.00 . A A . 4 TYR OH 1 1 7 3527 1 1 5 VAL C C 0.414 9.704 6.921 1.00 . A A . 5 VAL C 1 1 7 3528 1 1 5 VAL CA C 0.741 9.508 5.438 1.00 . A A . 5 VAL CA 1 1 7 3529 1 1 5 VAL CB C -0.501 9.537 4.544 1.00 . A A . 5 VAL CB 1 1 7 3530 1 1 5 VAL CG1 C -1.357 10.771 4.835 1.00 . A A . 5 VAL CG1 1 1 7 3531 1 1 5 VAL CG2 C -0.113 9.473 3.065 1.00 . A A . 5 VAL CG2 1 1 7 3532 1 1 5 VAL H H 0.899 7.505 4.890 1.00 . A A . 5 VAL H 1 1 7 3533 1 1 5 VAL HA H 1.407 10.308 5.117 1.00 . A A . 5 VAL HA 1 1 7 3534 1 1 5 VAL HB H -1.098 8.654 4.772 1.00 . A A . 5 VAL HB 1 1 7 3535 1 1 5 VAL HG11 H -1.896 10.627 5.771 1.00 . A A . 5 VAL HG11 1 1 7 3536 1 1 5 VAL HG12 H -0.715 11.648 4.916 1.00 . A A . 5 VAL HG12 1 1 7 3537 1 1 5 VAL HG13 H -2.070 10.918 4.023 1.00 . A A . 5 VAL HG13 1 1 7 3538 1 1 5 VAL HG21 H -0.656 10.241 2.514 1.00 . A A . 5 VAL HG21 1 1 7 3539 1 1 5 VAL HG22 H 0.959 9.642 2.963 1.00 . A A . 5 VAL HG22 1 1 7 3540 1 1 5 VAL HG23 H -0.365 8.491 2.665 1.00 . A A . 5 VAL HG23 1 1 7 3541 1 1 5 VAL N N 1.449 8.251 5.264 1.00 . A A . 5 VAL N 1 1 7 3542 1 1 5 VAL O O -0.324 8.914 7.507 1.00 . A A . 5 VAL O 1 1 7 3543 1 1 6 CYS C C -0.747 11.170 9.124 1.00 . A A . 6 CYS C 1 1 7 3544 1 1 6 CYS CA C 0.761 11.071 8.885 1.00 . A A . 6 CYS CA 1 1 7 3545 1 1 6 CYS CB C 1.490 12.349 9.304 1.00 . A A . 6 CYS CB 1 1 7 3546 1 1 6 CYS H H 1.581 11.397 6.998 1.00 . A A . 6 CYS H 1 1 7 3547 1 1 6 CYS HA H 1.190 10.249 9.459 1.00 . A A . 6 CYS HA 1 1 7 3548 1 1 6 CYS HB2 H 2.506 12.317 8.910 1.00 . A A . 6 CYS HB2 1 1 7 3549 1 1 6 CYS HB3 H 0.996 13.201 8.838 1.00 . A A . 6 CYS HB3 1 1 7 3550 1 1 6 CYS N N 0.981 10.760 7.483 1.00 . A A . 6 CYS N 1 1 7 3551 1 1 6 CYS O O -1.504 11.489 8.208 1.00 . A A . 6 CYS O 1 1 7 3552 1 1 6 CYS SG S 1.569 12.630 11.110 1.00 . A A . 6 CYS SG 1 1 7 3553 1 1 7 THR C C -2.799 12.116 11.679 1.00 . A A . 7 THR C 1 1 7 3554 1 1 7 THR CA C -2.543 10.945 10.729 1.00 . A A . 7 THR CA 1 1 7 3555 1 1 7 THR CB C -2.929 9.587 11.318 1.00 . A A . 7 THR CB 1 1 7 3556 1 1 7 THR CG2 C -2.854 8.458 10.288 1.00 . A A . 7 THR CG2 1 1 7 3557 1 1 7 THR H H -0.517 10.633 11.097 1.00 . A A . 7 THR H 1 1 7 3558 1 1 7 THR HA H -3.129 11.131 9.828 1.00 . A A . 7 THR HA 1 1 7 3559 1 1 7 THR HB H -3.915 9.629 11.778 1.00 . A A . 7 THR HB 1 1 7 3560 1 1 7 THR HG1 H -1.920 9.911 13.016 1.00 . A A . 7 THR HG1 1 1 7 3561 1 1 7 THR HG21 H -2.107 7.730 10.600 1.00 . A A . 7 THR HG21 1 1 7 3562 1 1 7 THR HG22 H -3.826 7.971 10.210 1.00 . A A . 7 THR HG22 1 1 7 3563 1 1 7 THR HG23 H -2.577 8.870 9.317 1.00 . A A . 7 THR HG23 1 1 7 3564 1 1 7 THR N N -1.138 10.891 10.358 1.00 . A A . 7 THR N 1 1 7 3565 1 1 7 THR O O -3.846 12.180 12.321 1.00 . A A . 7 THR O 1 1 7 3566 1 1 7 THR OG1 O -1.875 9.293 12.232 1.00 . A A . 7 THR OG1 1 1 7 3567 1 1 8 VAL C C -2.083 15.430 11.741 1.00 . A A . 8 VAL C 1 1 7 3568 1 1 8 VAL CA C -1.932 14.175 12.602 1.00 . A A . 8 VAL CA 1 1 7 3569 1 1 8 VAL CB C -0.729 14.240 13.546 1.00 . A A . 8 VAL CB 1 1 7 3570 1 1 8 VAL CG1 C -0.749 15.528 14.372 1.00 . A A . 8 VAL CG1 1 1 7 3571 1 1 8 VAL CG2 C -0.677 13.009 14.452 1.00 . A A . 8 VAL CG2 1 1 7 3572 1 1 8 VAL H H -0.976 12.950 11.215 1.00 . A A . 8 VAL H 1 1 7 3573 1 1 8 VAL HA H -2.830 14.055 13.208 1.00 . A A . 8 VAL HA 1 1 7 3574 1 1 8 VAL HB H 0.175 14.247 12.937 1.00 . A A . 8 VAL HB 1 1 7 3575 1 1 8 VAL HG11 H -0.171 15.383 15.285 1.00 . A A . 8 VAL HG11 1 1 7 3576 1 1 8 VAL HG12 H -0.311 16.339 13.791 1.00 . A A . 8 VAL HG12 1 1 7 3577 1 1 8 VAL HG13 H -1.778 15.780 14.629 1.00 . A A . 8 VAL HG13 1 1 7 3578 1 1 8 VAL HG21 H -1.537 12.371 14.249 1.00 . A A . 8 VAL HG21 1 1 7 3579 1 1 8 VAL HG22 H 0.241 12.454 14.257 1.00 . A A . 8 VAL HG22 1 1 7 3580 1 1 8 VAL HG23 H -0.697 13.324 15.495 1.00 . A A . 8 VAL HG23 1 1 7 3581 1 1 8 VAL N N -1.824 13.011 11.741 1.00 . A A . 8 VAL N 1 1 7 3582 1 1 8 VAL O O -3.018 16.208 11.927 1.00 . A A . 8 VAL O 1 1 7 3583 1 1 9 CYS C C -1.543 16.252 8.523 1.00 . A A . 9 CYS C 1 1 7 3584 1 1 9 CYS CA C -1.167 16.738 9.923 1.00 . A A . 9 CYS CA 1 1 7 3585 1 1 9 CYS CB C 0.172 17.479 9.929 1.00 . A A . 9 CYS CB 1 1 7 3586 1 1 9 CYS H H -0.391 14.954 10.669 1.00 . A A . 9 CYS H 1 1 7 3587 1 1 9 CYS HA H -1.920 17.423 10.311 1.00 . A A . 9 CYS HA 1 1 7 3588 1 1 9 CYS HB2 H 0.268 18.035 8.996 1.00 . A A . 9 CYS HB2 1 1 7 3589 1 1 9 CYS HB3 H 0.162 18.212 10.736 1.00 . A A . 9 CYS HB3 1 1 7 3590 1 1 9 CYS N N -1.149 15.591 10.815 1.00 . A A . 9 CYS N 1 1 7 3591 1 1 9 CYS O O -1.969 17.042 7.682 1.00 . A A . 9 CYS O 1 1 7 3592 1 1 9 CYS SG S 1.642 16.408 10.128 1.00 . A A . 9 CYS SG 1 1 7 3593 1 1 10 GLY C C -0.461 14.325 6.121 1.00 . A A . 10 GLY C 1 1 7 3594 1 1 10 GLY CA C -1.691 14.354 7.030 1.00 . A A . 10 GLY CA 1 1 7 3595 1 1 10 GLY H H -1.026 14.319 9.004 1.00 . A A . 10 GLY H 1 1 7 3596 1 1 10 GLY HA2 H -2.060 13.340 7.181 1.00 . A A . 10 GLY HA2 1 1 7 3597 1 1 10 GLY HA3 H -2.490 14.918 6.549 1.00 . A A . 10 GLY HA3 1 1 7 3598 1 1 10 GLY N N -1.373 14.955 8.315 1.00 . A A . 10 GLY N 1 1 7 3599 1 1 10 GLY O O -0.538 14.045 4.926 1.00 . A A . 10 GLY O 1 1 7 3600 1 1 11 TYR C C 1.993 13.483 5.012 1.00 . A A . 11 TYR C 1 1 7 3601 1 1 11 TYR CA C 1.948 14.643 5.997 1.00 . A A . 11 TYR CA 1 1 7 3602 1 1 11 TYR CB C 3.106 14.556 6.987 1.00 . A A . 11 TYR CB 1 1 7 3603 1 1 11 TYR CD1 C 4.660 15.708 5.372 1.00 . A A . 11 TYR CD1 1 1 7 3604 1 1 11 TYR CD2 C 5.522 13.887 6.722 1.00 . A A . 11 TYR CD2 1 1 7 3605 1 1 11 TYR CE1 C 5.918 15.861 4.776 1.00 . A A . 11 TYR CE1 1 1 7 3606 1 1 11 TYR CE2 C 6.779 14.039 6.125 1.00 . A A . 11 TYR CE2 1 1 7 3607 1 1 11 TYR CG C 4.462 14.721 6.345 1.00 . A A . 11 TYR CG 1 1 7 3608 1 1 11 TYR CZ C 6.977 15.026 5.152 1.00 . A A . 11 TYR CZ 1 1 7 3609 1 1 11 TYR H H 0.703 14.848 7.706 1.00 . A A . 11 TYR H 1 1 7 3610 1 1 11 TYR HA H 2.025 15.579 5.445 1.00 . A A . 11 TYR HA 1 1 7 3611 1 1 11 TYR HB2 H 2.980 15.335 7.739 1.00 . A A . 11 TYR HB2 1 1 7 3612 1 1 11 TYR HB3 H 3.071 13.584 7.481 1.00 . A A . 11 TYR HB3 1 1 7 3613 1 1 11 TYR HD1 H 3.844 16.352 5.081 1.00 . A A . 11 TYR HD1 1 1 7 3614 1 1 11 TYR HD2 H 5.369 13.125 7.472 1.00 . A A . 11 TYR HD2 1 1 7 3615 1 1 11 TYR HE1 H 6.071 16.622 4.025 1.00 . A A . 11 TYR HE1 1 1 7 3616 1 1 11 TYR HE2 H 7.596 13.395 6.416 1.00 . A A . 11 TYR HE2 1 1 7 3617 1 1 11 TYR HH H 8.243 14.812 3.683 1.00 . A A . 11 TYR HH 1 1 7 3618 1 1 11 TYR N N 0.693 14.625 6.721 1.00 . A A . 11 TYR N 1 1 7 3619 1 1 11 TYR O O 1.292 12.494 5.226 1.00 . A A . 11 TYR O 1 1 7 3620 1 1 11 TYR OH O 8.203 15.175 4.571 1.00 . A A . 11 TYR OH 1 1 7 3621 1 1 12 GLU C C 4.385 12.196 2.766 1.00 . A A . 12 GLU C 1 1 7 3622 1 1 12 GLU CA C 2.916 12.573 2.971 1.00 . A A . 12 GLU CA 1 1 7 3623 1 1 12 GLU CB C 2.270 12.998 1.651 1.00 . A A . 12 GLU CB 1 1 7 3624 1 1 12 GLU CD C 0.145 12.999 0.293 1.00 . A A . 12 GLU CD 1 1 7 3625 1 1 12 GLU CG C 0.850 12.441 1.530 1.00 . A A . 12 GLU CG 1 1 7 3626 1 1 12 GLU H H 3.364 14.428 3.803 1.00 . A A . 12 GLU H 1 1 7 3627 1 1 12 GLU HA H 2.369 11.722 3.378 1.00 . A A . 12 GLU HA 1 1 7 3628 1 1 12 GLU HB2 H 2.243 14.086 1.590 1.00 . A A . 12 GLU HB2 1 1 7 3629 1 1 12 GLU HB3 H 2.875 12.646 0.815 1.00 . A A . 12 GLU HB3 1 1 7 3630 1 1 12 GLU HE2 H 0.870 11.740 -0.905 1.00 . A A . 12 GLU HE2 1 1 7 3631 1 1 12 GLU HG2 H 0.886 11.353 1.472 1.00 . A A . 12 GLU HG2 1 1 7 3632 1 1 12 GLU HG3 H 0.279 12.693 2.424 1.00 . A A . 12 GLU HG3 1 1 7 3633 1 1 12 GLU N N 2.799 13.620 3.970 1.00 . A A . 12 GLU N 1 1 7 3634 1 1 12 GLU O O 5.189 12.964 2.243 1.00 . A A . 12 GLU O 1 1 7 3635 1 1 12 GLU OE1 O -0.896 13.662 0.419 1.00 . A A . 12 GLU OE1 1 1 7 3636 1 1 12 GLU OE2 O 0.717 12.726 -0.831 1.00 . A A . 12 GLU OE2 1 1 7 3637 1 1 13 TYR C C 6.163 9.517 1.893 1.00 . A A . 13 TYR C 1 1 7 3638 1 1 13 TYR CA C 6.072 10.471 3.075 1.00 . A A . 13 TYR CA 1 1 7 3639 1 1 13 TYR CB C 6.466 9.767 4.370 1.00 . A A . 13 TYR CB 1 1 7 3640 1 1 13 TYR CD1 C 8.963 10.116 4.369 1.00 . A A . 13 TYR CD1 1 1 7 3641 1 1 13 TYR CD2 C 8.102 7.849 4.340 1.00 . A A . 13 TYR CD2 1 1 7 3642 1 1 13 TYR CE1 C 10.272 9.619 4.357 1.00 . A A . 13 TYR CE1 1 1 7 3643 1 1 13 TYR CE2 C 9.411 7.352 4.328 1.00 . A A . 13 TYR CE2 1 1 7 3644 1 1 13 TYR CG C 7.878 9.231 4.360 1.00 . A A . 13 TYR CG 1 1 7 3645 1 1 13 TYR CZ C 10.496 8.237 4.337 1.00 . A A . 13 TYR CZ 1 1 7 3646 1 1 13 TYR H H 4.020 10.384 3.617 1.00 . A A . 13 TYR H 1 1 7 3647 1 1 13 TYR HA H 6.749 11.308 2.907 1.00 . A A . 13 TYR HA 1 1 7 3648 1 1 13 TYR HB2 H 6.369 10.474 5.195 1.00 . A A . 13 TYR HB2 1 1 7 3649 1 1 13 TYR HB3 H 5.781 8.937 4.539 1.00 . A A . 13 TYR HB3 1 1 7 3650 1 1 13 TYR HD1 H 8.790 11.182 4.384 1.00 . A A . 13 TYR HD1 1 1 7 3651 1 1 13 TYR HD2 H 7.265 7.166 4.332 1.00 . A A . 13 TYR HD2 1 1 7 3652 1 1 13 TYR HE1 H 11.109 10.301 4.364 1.00 . A A . 13 TYR HE1 1 1 7 3653 1 1 13 TYR HE2 H 9.584 6.286 4.312 1.00 . A A . 13 TYR HE2 1 1 7 3654 1 1 13 TYR HH H 11.825 6.834 4.598 1.00 . A A . 13 TYR HH 1 1 7 3655 1 1 13 TYR N N 4.720 10.977 3.195 1.00 . A A . 13 TYR N 1 1 7 3656 1 1 13 TYR O O 5.133 8.993 1.471 1.00 . A A . 13 TYR O 1 1 7 3657 1 1 13 TYR OH O 11.771 7.752 4.327 1.00 . A A . 13 TYR OH 1 1 7 3658 1 1 14 ASP C C 8.752 7.492 0.548 1.00 . A A . 14 ASP C 1 1 7 3659 1 1 14 ASP CA C 7.568 8.417 0.260 1.00 . A A . 14 ASP CA 1 1 7 3660 1 1 14 ASP CB C 7.881 9.203 -1.015 1.00 . A A . 14 ASP CB 1 1 7 3661 1 1 14 ASP CG C 7.526 8.486 -2.320 1.00 . A A . 14 ASP CG 1 1 7 3662 1 1 14 ASP H H 8.203 9.739 1.739 1.00 . A A . 14 ASP H 1 1 7 3663 1 1 14 ASP HA H 6.629 7.874 0.157 1.00 . A A . 14 ASP HA 1 1 7 3664 1 1 14 ASP HB2 H 7.345 10.151 -0.981 1.00 . A A . 14 ASP HB2 1 1 7 3665 1 1 14 ASP HB3 H 8.946 9.439 -1.026 1.00 . A A . 14 ASP HB3 1 1 7 3666 1 1 14 ASP HD2 H 6.469 9.936 -2.894 1.00 . A A . 14 ASP HD2 1 1 7 3667 1 1 14 ASP N N 7.371 9.310 1.389 1.00 . A A . 14 ASP N 1 1 7 3668 1 1 14 ASP O O 9.907 7.802 0.266 1.00 . A A . 14 ASP O 1 1 7 3669 1 1 14 ASP OD1 O 8.217 7.547 -2.741 1.00 . A A . 14 ASP OD1 1 1 7 3670 1 1 14 ASP OD2 O 6.476 8.936 -2.919 1.00 . A A . 14 ASP OD2 1 1 7 3671 1 1 15 PRO C C 10.516 5.279 0.458 1.00 . A A . 15 PRO C 1 1 7 3672 1 1 15 PRO CA C 9.391 5.307 1.483 1.00 . A A . 15 PRO CA 1 1 7 3673 1 1 15 PRO CB C 8.598 4.003 1.459 1.00 . A A . 15 PRO CB 1 1 7 3674 1 1 15 PRO CD C 7.085 5.933 1.470 1.00 . A A . 15 PRO CD 1 1 7 3675 1 1 15 PRO CG C 7.223 4.523 2.036 1.00 . A A . 15 PRO CG 1 1 7 3676 1 1 15 PRO HA H 9.801 5.486 2.477 1.00 . A A . 15 PRO HA 1 1 7 3677 1 1 15 PRO HB2 H 8.527 3.579 0.459 1.00 . A A . 15 PRO HB2 1 1 7 3678 1 1 15 PRO HB3 H 9.055 3.293 2.149 1.00 . A A . 15 PRO HB3 1 1 7 3679 1 1 15 PRO HD2 H 6.429 5.940 0.599 1.00 . A A . 15 PRO HD2 1 1 7 3680 1 1 15 PRO HD3 H 6.702 6.603 2.239 1.00 . A A . 15 PRO HD3 1 1 7 3681 1 1 15 PRO HG2 H 6.498 3.868 1.550 1.00 . A A . 15 PRO HG2 1 1 7 3682 1 1 15 PRO HG3 H 7.102 4.496 3.119 1.00 . A A . 15 PRO HG3 1 1 7 3683 1 1 15 PRO N N 8.433 6.331 1.124 1.00 . A A . 15 PRO N 1 1 7 3684 1 1 15 PRO O O 10.307 4.765 -0.640 1.00 . A A . 15 PRO O 1 1 7 3685 1 1 16 ALA C C 13.828 6.868 0.426 1.00 . A A . 16 ALA C 1 1 7 3686 1 1 16 ALA CA C 12.804 5.851 -0.080 1.00 . A A . 16 ALA CA 1 1 7 3687 1 1 16 ALA CB C 12.321 6.167 -1.497 1.00 . A A . 16 ALA CB 1 1 7 3688 1 1 16 ALA H H 11.829 6.241 1.719 1.00 . A A . 16 ALA H 1 1 7 3689 1 1 16 ALA HA H 13.255 4.860 -0.076 1.00 . A A . 16 ALA HA 1 1 7 3690 1 1 16 ALA HB1 H 12.332 5.256 -2.096 1.00 . A A . 16 ALA HB1 1 1 7 3691 1 1 16 ALA HB2 H 11.307 6.562 -1.456 1.00 . A A . 16 ALA HB2 1 1 7 3692 1 1 16 ALA HB3 H 12.981 6.907 -1.949 1.00 . A A . 16 ALA HB3 1 1 7 3693 1 1 16 ALA N N 11.667 5.824 0.825 1.00 . A A . 16 ALA N 1 1 7 3694 1 1 16 ALA O O 14.027 7.915 -0.189 1.00 . A A . 16 ALA O 1 1 7 3695 1 1 17 PHE C C 16.665 6.591 2.615 1.00 . A A . 17 PHE C 1 1 7 3696 1 1 17 PHE CA C 15.453 7.394 2.140 1.00 . A A . 17 PHE CA 1 1 7 3697 1 1 17 PHE CB C 14.797 8.068 3.347 1.00 . A A . 17 PHE CB 1 1 7 3698 1 1 17 PHE CD1 C 12.759 9.075 2.296 1.00 . A A . 17 PHE CD1 1 1 7 3699 1 1 17 PHE CD2 C 14.284 10.519 3.362 1.00 . A A . 17 PHE CD2 1 1 7 3700 1 1 17 PHE CE1 C 11.940 10.185 1.963 1.00 . A A . 17 PHE CE1 1 1 7 3701 1 1 17 PHE CE2 C 13.466 11.630 3.029 1.00 . A A . 17 PHE CE2 1 1 7 3702 1 1 17 PHE CG C 13.915 9.265 2.988 1.00 . A A . 17 PHE CG 1 1 7 3703 1 1 17 PHE CZ C 12.310 11.440 2.337 1.00 . A A . 17 PHE CZ 1 1 7 3704 1 1 17 PHE H H 14.287 5.672 2.038 1.00 . A A . 17 PHE H 1 1 7 3705 1 1 17 PHE HA H 15.767 8.102 1.372 1.00 . A A . 17 PHE HA 1 1 7 3706 1 1 17 PHE HB2 H 14.195 7.331 3.878 1.00 . A A . 17 PHE HB2 1 1 7 3707 1 1 17 PHE HB3 H 15.577 8.397 4.034 1.00 . A A . 17 PHE HB3 1 1 7 3708 1 1 17 PHE HD1 H 12.462 8.069 1.998 1.00 . A A . 17 PHE HD1 1 1 7 3709 1 1 17 PHE HD2 H 15.211 10.671 3.916 1.00 . A A . 17 PHE HD2 1 1 7 3710 1 1 17 PHE HE1 H 11.013 10.033 1.409 1.00 . A A . 17 PHE HE1 1 1 7 3711 1 1 17 PHE HE2 H 13.763 12.635 3.328 1.00 . A A . 17 PHE HE2 1 1 7 3712 1 1 17 PHE HZ H 11.681 12.292 2.081 1.00 . A A . 17 PHE HZ 1 1 7 3713 1 1 17 PHE N N 14.453 6.524 1.543 1.00 . A A . 17 PHE N 1 1 7 3714 1 1 17 PHE O O 16.769 5.396 2.342 1.00 . A A . 17 PHE O 1 1 7 3715 1 1 18 GLU C C 18.966 7.023 5.300 1.00 . A A . 18 GLU C 1 1 7 3716 1 1 18 GLU CA C 18.754 6.645 3.833 1.00 . A A . 18 GLU CA 1 1 7 3717 1 1 18 GLU CB C 19.975 7.016 2.989 1.00 . A A . 18 GLU CB 1 1 7 3718 1 1 18 GLU CD C 22.439 6.908 3.515 1.00 . A A . 18 GLU CD 1 1 7 3719 1 1 18 GLU CG C 21.159 6.098 3.305 1.00 . A A . 18 GLU CG 1 1 7 3720 1 1 18 GLU H H 17.461 8.252 3.534 1.00 . A A . 18 GLU H 1 1 7 3721 1 1 18 GLU HA H 18.574 5.573 3.749 1.00 . A A . 18 GLU HA 1 1 7 3722 1 1 18 GLU HB2 H 19.726 6.943 1.930 1.00 . A A . 18 GLU HB2 1 1 7 3723 1 1 18 GLU HB3 H 20.253 8.052 3.180 1.00 . A A . 18 GLU HB3 1 1 7 3724 1 1 18 GLU HE2 H 23.350 6.076 2.093 1.00 . A A . 18 GLU HE2 1 1 7 3725 1 1 18 GLU HG2 H 20.942 5.514 4.199 1.00 . A A . 18 GLU HG2 1 1 7 3726 1 1 18 GLU HG3 H 21.302 5.390 2.488 1.00 . A A . 18 GLU HG3 1 1 7 3727 1 1 18 GLU N N 17.553 7.279 3.317 1.00 . A A . 18 GLU N 1 1 7 3728 1 1 18 GLU O O 19.036 8.205 5.637 1.00 . A A . 18 GLU O 1 1 7 3729 1 1 18 GLU OE1 O 22.395 7.994 4.113 1.00 . A A . 18 GLU OE1 1 1 7 3730 1 1 18 GLU OE2 O 23.509 6.372 3.034 1.00 . A A . 18 GLU OE2 1 1 7 3731 1 1 19 ASP C C 17.925 6.540 8.216 1.00 . A A . 19 ASP C 1 1 7 3732 1 1 19 ASP CA C 19.266 6.210 7.558 1.00 . A A . 19 ASP CA 1 1 7 3733 1 1 19 ASP CB C 20.217 7.380 7.812 1.00 . A A . 19 ASP CB 1 1 7 3734 1 1 19 ASP CG C 21.163 7.199 9.000 1.00 . A A . 19 ASP CG 1 1 7 3735 1 1 19 ASP H H 19.005 5.042 5.853 1.00 . A A . 19 ASP H 1 1 7 3736 1 1 19 ASP HA H 19.693 5.278 7.927 1.00 . A A . 19 ASP HA 1 1 7 3737 1 1 19 ASP HB2 H 20.813 7.545 6.914 1.00 . A A . 19 ASP HB2 1 1 7 3738 1 1 19 ASP HB3 H 19.626 8.282 7.972 1.00 . A A . 19 ASP HB3 1 1 7 3739 1 1 19 ASP HD2 H 22.993 6.870 8.700 1.00 . A A . 19 ASP HD2 1 1 7 3740 1 1 19 ASP N N 19.062 5.999 6.135 1.00 . A A . 19 ASP N 1 1 7 3741 1 1 19 ASP O O 17.525 7.702 8.273 1.00 . A A . 19 ASP O 1 1 7 3742 1 1 19 ASP OD1 O 20.983 7.816 10.060 1.00 . A A . 19 ASP OD1 1 1 7 3743 1 1 19 ASP OD2 O 22.133 6.371 8.803 1.00 . A A . 19 ASP OD2 1 1 7 3744 1 1 20 LEU C C 16.071 5.150 10.790 1.00 . A A . 20 LEU C 1 1 7 3745 1 1 20 LEU CA C 15.977 5.660 9.351 1.00 . A A . 20 LEU CA 1 1 7 3746 1 1 20 LEU CB C 14.872 4.990 8.531 1.00 . A A . 20 LEU CB 1 1 7 3747 1 1 20 LEU CD1 C 12.576 5.583 7.674 1.00 . A A . 20 LEU CD1 1 1 7 3748 1 1 20 LEU CD2 C 12.835 4.295 9.844 1.00 . A A . 20 LEU CD2 1 1 7 3749 1 1 20 LEU CG C 13.438 5.353 8.918 1.00 . A A . 20 LEU CG 1 1 7 3750 1 1 20 LEU H H 17.597 4.554 8.648 1.00 . A A . 20 LEU H 1 1 7 3751 1 1 20 LEU HA H 15.758 6.727 9.377 1.00 . A A . 20 LEU HA 1 1 7 3752 1 1 20 LEU HB2 H 15.020 5.245 7.482 1.00 . A A . 20 LEU HB2 1 1 7 3753 1 1 20 LEU HB3 H 14.989 3.910 8.616 1.00 . A A . 20 LEU HB3 1 1 7 3754 1 1 20 LEU HD11 H 13.006 6.387 7.078 1.00 . A A . 20 LEU HD11 1 1 7 3755 1 1 20 LEU HD12 H 12.542 4.669 7.081 1.00 . A A . 20 LEU HD12 1 1 7 3756 1 1 20 LEU HD13 H 11.565 5.857 7.978 1.00 . A A . 20 LEU HD13 1 1 7 3757 1 1 20 LEU HD21 H 12.021 3.784 9.331 1.00 . A A . 20 LEU HD21 1 1 7 3758 1 1 20 LEU HD22 H 13.603 3.572 10.119 1.00 . A A . 20 LEU HD22 1 1 7 3759 1 1 20 LEU HD23 H 12.451 4.776 10.744 1.00 . A A . 20 LEU HD23 1 1 7 3760 1 1 20 LEU HG H 13.459 6.291 9.472 1.00 . A A . 20 LEU HG 1 1 7 3761 1 1 20 LEU N N 17.265 5.495 8.698 1.00 . A A . 20 LEU N 1 1 7 3762 1 1 20 LEU O O 15.701 4.021 11.108 1.00 . A A . 20 LEU O 1 1 7 3763 1 1 21 PRO C C 15.485 5.142 13.643 1.00 . A A . 21 PRO C 1 1 7 3764 1 1 21 PRO CA C 16.760 5.748 13.075 1.00 . A A . 21 PRO CA 1 1 7 3765 1 1 21 PRO CB C 17.046 7.110 13.703 1.00 . A A . 21 PRO CB 1 1 7 3766 1 1 21 PRO CD C 17.028 7.353 11.325 1.00 . A A . 21 PRO CD 1 1 7 3767 1 1 21 PRO CG C 17.712 7.873 12.587 1.00 . A A . 21 PRO CG 1 1 7 3768 1 1 21 PRO HA H 17.597 5.070 13.241 1.00 . A A . 21 PRO HA 1 1 7 3769 1 1 21 PRO HB2 H 16.140 7.597 14.064 1.00 . A A . 21 PRO HB2 1 1 7 3770 1 1 21 PRO HB3 H 17.767 6.989 14.511 1.00 . A A . 21 PRO HB3 1 1 7 3771 1 1 21 PRO HD2 H 16.193 7.994 11.043 1.00 . A A . 21 PRO HD2 1 1 7 3772 1 1 21 PRO HD3 H 17.751 7.291 10.511 1.00 . A A . 21 PRO HD3 1 1 7 3773 1 1 21 PRO HG2 H 17.605 8.957 12.633 1.00 . A A . 21 PRO HG2 1 1 7 3774 1 1 21 PRO HG3 H 18.763 7.586 12.637 1.00 . A A . 21 PRO HG3 1 1 7 3775 1 1 21 PRO N N 16.582 6.018 11.665 1.00 . A A . 21 PRO N 1 1 7 3776 1 1 21 PRO O O 14.462 5.165 12.962 1.00 . A A . 21 PRO O 1 1 7 3777 1 1 22 ASP C C 13.689 5.064 16.340 1.00 . A A . 22 ASP C 1 1 7 3778 1 1 22 ASP CA C 14.407 4.014 15.491 1.00 . A A . 22 ASP CA 1 1 7 3779 1 1 22 ASP CB C 14.820 2.863 16.411 1.00 . A A . 22 ASP CB 1 1 7 3780 1 1 22 ASP CG C 16.235 2.328 16.183 1.00 . A A . 22 ASP CG 1 1 7 3781 1 1 22 ASP H H 16.402 4.604 15.405 1.00 . A A . 22 ASP H 1 1 7 3782 1 1 22 ASP HA H 13.789 3.649 14.670 1.00 . A A . 22 ASP HA 1 1 7 3783 1 1 22 ASP HB2 H 14.734 3.196 17.446 1.00 . A A . 22 ASP HB2 1 1 7 3784 1 1 22 ASP HB3 H 14.113 2.042 16.282 1.00 . A A . 22 ASP HB3 1 1 7 3785 1 1 22 ASP HD2 H 17.222 1.304 17.416 1.00 . A A . 22 ASP HD2 1 1 7 3786 1 1 22 ASP N N 15.566 4.619 14.858 1.00 . A A . 22 ASP N 1 1 7 3787 1 1 22 ASP O O 13.186 4.756 17.420 1.00 . A A . 22 ASP O 1 1 7 3788 1 1 22 ASP OD1 O 16.620 2.001 15.052 1.00 . A A . 22 ASP OD1 1 1 7 3789 1 1 22 ASP OD2 O 16.967 2.254 17.244 1.00 . A A . 22 ASP OD2 1 1 7 3790 1 1 23 ASP C C 12.763 8.525 15.536 1.00 . A A . 23 ASP C 1 1 7 3791 1 1 23 ASP CA C 13.015 7.380 16.519 1.00 . A A . 23 ASP CA 1 1 7 3792 1 1 23 ASP CB C 13.899 7.913 17.649 1.00 . A A . 23 ASP CB 1 1 7 3793 1 1 23 ASP CG C 15.403 7.869 17.369 1.00 . A A . 23 ASP CG 1 1 7 3794 1 1 23 ASP H H 14.075 6.525 14.943 1.00 . A A . 23 ASP H 1 1 7 3795 1 1 23 ASP HA H 12.091 6.960 16.918 1.00 . A A . 23 ASP HA 1 1 7 3796 1 1 23 ASP HB2 H 13.614 8.944 17.857 1.00 . A A . 23 ASP HB2 1 1 7 3797 1 1 23 ASP HB3 H 13.695 7.337 18.552 1.00 . A A . 23 ASP HB3 1 1 7 3798 1 1 23 ASP HD2 H 16.690 8.225 16.041 1.00 . A A . 23 ASP HD2 1 1 7 3799 1 1 23 ASP N N 13.664 6.283 15.821 1.00 . A A . 23 ASP N 1 1 7 3800 1 1 23 ASP O O 13.267 9.631 15.722 1.00 . A A . 23 ASP O 1 1 7 3801 1 1 23 ASP OD1 O 16.171 7.230 18.105 1.00 . A A . 23 ASP OD1 1 1 7 3802 1 1 23 ASP OD2 O 15.785 8.535 16.333 1.00 . A A . 23 ASP OD2 1 1 7 3803 1 1 24 TRP C C 10.400 9.956 13.953 1.00 . A A . 24 TRP C 1 1 7 3804 1 1 24 TRP CA C 11.655 9.210 13.498 1.00 . A A . 24 TRP CA 1 1 7 3805 1 1 24 TRP CB C 11.497 8.556 12.124 1.00 . A A . 24 TRP CB 1 1 7 3806 1 1 24 TRP CD1 C 12.711 10.332 10.698 1.00 . A A . 24 TRP CD1 1 1 7 3807 1 1 24 TRP CD2 C 10.738 9.749 9.875 1.00 . A A . 24 TRP CD2 1 1 7 3808 1 1 24 TRP CE2 C 11.277 10.695 9.026 1.00 . A A . 24 TRP CE2 1 1 7 3809 1 1 24 TRP CE3 C 9.480 9.174 9.627 1.00 . A A . 24 TRP CE3 1 1 7 3810 1 1 24 TRP CG C 11.673 9.523 10.951 1.00 . A A . 24 TRP CG 1 1 7 3811 1 1 24 TRP CH2 C 9.371 10.590 7.605 1.00 . A A . 24 TRP CH2 1 1 7 3812 1 1 24 TRP CZ2 C 10.626 11.149 7.873 1.00 . A A . 24 TRP CZ2 1 1 7 3813 1 1 24 TRP CZ3 C 8.842 9.638 8.470 1.00 . A A . 24 TRP CZ3 1 1 7 3814 1 1 24 TRP H H 11.574 7.318 14.366 1.00 . A A . 24 TRP H 1 1 7 3815 1 1 24 TRP HA H 12.494 9.901 13.426 1.00 . A A . 24 TRP HA 1 1 7 3816 1 1 24 TRP HB2 H 12.223 7.750 12.030 1.00 . A A . 24 TRP HB2 1 1 7 3817 1 1 24 TRP HB3 H 10.508 8.102 12.061 1.00 . A A . 24 TRP HB3 1 1 7 3818 1 1 24 TRP HD1 H 13.599 10.406 11.326 1.00 . A A . 24 TRP HD1 1 1 7 3819 1 1 24 TRP HE1 H 13.203 11.789 9.115 1.00 . A A . 24 TRP HE1 1 1 7 3820 1 1 24 TRP HE3 H 9.034 8.425 10.281 1.00 . A A . 24 TRP HE3 1 1 7 3821 1 1 24 TRP HH2 H 8.810 10.899 6.723 1.00 . A A . 24 TRP HH2 1 1 7 3822 1 1 24 TRP HZ2 H 11.072 11.898 7.218 1.00 . A A . 24 TRP HZ2 1 1 7 3823 1 1 24 TRP HZ3 H 7.863 9.224 8.230 1.00 . A A . 24 TRP HZ3 1 1 7 3824 1 1 24 TRP N N 11.981 8.220 14.511 1.00 . A A . 24 TRP N 1 1 7 3825 1 1 24 TRP NE1 N 12.514 11.061 9.543 1.00 . A A . 24 TRP NE1 1 1 7 3826 1 1 24 TRP O O 9.472 9.349 14.487 1.00 . A A . 24 TRP O 1 1 7 3827 1 1 25 ALA C C 8.877 12.968 12.917 1.00 . A A . 25 ALA C 1 1 7 3828 1 1 25 ALA CA C 9.285 12.098 14.107 1.00 . A A . 25 ALA CA 1 1 7 3829 1 1 25 ALA CB C 9.658 12.928 15.337 1.00 . A A . 25 ALA CB 1 1 7 3830 1 1 25 ALA H H 11.170 11.747 13.292 1.00 . A A . 25 ALA H 1 1 7 3831 1 1 25 ALA HA H 8.456 11.439 14.366 1.00 . A A . 25 ALA HA 1 1 7 3832 1 1 25 ALA HB1 H 8.871 12.841 16.086 1.00 . A A . 25 ALA HB1 1 1 7 3833 1 1 25 ALA HB2 H 10.597 12.562 15.751 1.00 . A A . 25 ALA HB2 1 1 7 3834 1 1 25 ALA HB3 H 9.772 13.973 15.048 1.00 . A A . 25 ALA HB3 1 1 7 3835 1 1 25 ALA N N 10.411 11.261 13.726 1.00 . A A . 25 ALA N 1 1 7 3836 1 1 25 ALA O O 9.731 13.511 12.218 1.00 . A A . 25 ALA O 1 1 7 3837 1 1 26 CYS C C 7.730 15.233 11.647 1.00 . A A . 26 CYS C 1 1 7 3838 1 1 26 CYS CA C 7.039 13.869 11.629 1.00 . A A . 26 CYS CA 1 1 7 3839 1 1 26 CYS CB C 5.517 13.999 11.712 1.00 . A A . 26 CYS CB 1 1 7 3840 1 1 26 CYS H H 6.882 12.628 13.295 1.00 . A A . 26 CYS H 1 1 7 3841 1 1 26 CYS HA H 7.268 13.330 10.710 1.00 . A A . 26 CYS HA 1 1 7 3842 1 1 26 CYS HB2 H 5.086 13.004 11.831 1.00 . A A . 26 CYS HB2 1 1 7 3843 1 1 26 CYS HB3 H 5.262 14.564 12.610 1.00 . A A . 26 CYS HB3 1 1 7 3844 1 1 26 CYS N N 7.570 13.073 12.722 1.00 . A A . 26 CYS N 1 1 7 3845 1 1 26 CYS O O 7.871 15.879 12.682 1.00 . A A . 26 CYS O 1 1 7 3846 1 1 26 CYS SG S 4.735 14.809 10.270 1.00 . A A . 26 CYS SG 1 1 7 3847 1 1 27 PRO C C 7.844 18.065 10.364 1.00 . A A . 27 PRO C 1 1 7 3848 1 1 27 PRO CA C 8.841 16.922 10.244 1.00 . A A . 27 PRO CA 1 1 7 3849 1 1 27 PRO CB C 9.400 16.830 8.826 1.00 . A A . 27 PRO CB 1 1 7 3850 1 1 27 PRO CD C 8.013 14.927 9.222 1.00 . A A . 27 PRO CD 1 1 7 3851 1 1 27 PRO CG C 8.274 15.953 8.121 1.00 . A A . 27 PRO CG 1 1 7 3852 1 1 27 PRO HA H 9.650 17.059 10.962 1.00 . A A . 27 PRO HA 1 1 7 3853 1 1 27 PRO HB2 H 9.506 17.808 8.358 1.00 . A A . 27 PRO HB2 1 1 7 3854 1 1 27 PRO HB3 H 10.357 16.308 8.850 1.00 . A A . 27 PRO HB3 1 1 7 3855 1 1 27 PRO HD2 H 7.015 14.501 9.126 1.00 . A A . 27 PRO HD2 1 1 7 3856 1 1 27 PRO HD3 H 8.767 14.141 9.180 1.00 . A A . 27 PRO HD3 1 1 7 3857 1 1 27 PRO HG2 H 7.324 16.367 7.784 1.00 . A A . 27 PRO HG2 1 1 7 3858 1 1 27 PRO HG3 H 8.831 15.530 7.283 1.00 . A A . 27 PRO HG3 1 1 7 3859 1 1 27 PRO N N 8.163 15.662 10.459 1.00 . A A . 27 PRO N 1 1 7 3860 1 1 27 PRO O O 8.245 19.220 10.226 1.00 . A A . 27 PRO O 1 1 7 3861 1 1 28 VAL C C 5.029 18.752 12.182 1.00 . A A . 28 VAL C 1 1 7 3862 1 1 28 VAL CA C 5.555 18.748 10.745 1.00 . A A . 28 VAL CA 1 1 7 3863 1 1 28 VAL CB C 4.456 18.516 9.706 1.00 . A A . 28 VAL CB 1 1 7 3864 1 1 28 VAL CG1 C 3.389 19.609 9.784 1.00 . A A . 28 VAL CG1 1 1 7 3865 1 1 28 VAL CG2 C 5.045 18.423 8.297 1.00 . A A . 28 VAL CG2 1 1 7 3866 1 1 28 VAL H H 6.268 16.791 10.724 1.00 . A A . 28 VAL H 1 1 7 3867 1 1 28 VAL HA H 6.017 19.714 10.539 1.00 . A A . 28 VAL HA 1 1 7 3868 1 1 28 VAL HB H 3.977 17.563 9.932 1.00 . A A . 28 VAL HB 1 1 7 3869 1 1 28 VAL HG11 H 3.703 20.374 10.494 1.00 . A A . 28 VAL HG11 1 1 7 3870 1 1 28 VAL HG12 H 3.258 20.060 8.800 1.00 . A A . 28 VAL HG12 1 1 7 3871 1 1 28 VAL HG13 H 2.445 19.174 10.113 1.00 . A A . 28 VAL HG13 1 1 7 3872 1 1 28 VAL HG21 H 5.338 17.394 8.093 1.00 . A A . 28 VAL HG21 1 1 7 3873 1 1 28 VAL HG22 H 4.297 18.740 7.570 1.00 . A A . 28 VAL HG22 1 1 7 3874 1 1 28 VAL HG23 H 5.919 19.071 8.225 1.00 . A A . 28 VAL HG23 1 1 7 3875 1 1 28 VAL N N 6.586 17.733 10.613 1.00 . A A . 28 VAL N 1 1 7 3876 1 1 28 VAL O O 5.595 19.410 13.053 1.00 . A A . 28 VAL O 1 1 7 3877 1 1 29 CYS C C 4.451 17.681 14.728 1.00 . A A . 29 CYS C 1 1 7 3878 1 1 29 CYS CA C 3.342 17.916 13.700 1.00 . A A . 29 CYS CA 1 1 7 3879 1 1 29 CYS CB C 2.273 16.823 13.755 1.00 . A A . 29 CYS CB 1 1 7 3880 1 1 29 CYS H H 3.497 17.475 11.670 1.00 . A A . 29 CYS H 1 1 7 3881 1 1 29 CYS HA H 2.843 18.868 13.881 1.00 . A A . 29 CYS HA 1 1 7 3882 1 1 29 CYS HB2 H 1.919 16.730 14.781 1.00 . A A . 29 CYS HB2 1 1 7 3883 1 1 29 CYS HB3 H 1.422 17.137 13.151 1.00 . A A . 29 CYS HB3 1 1 7 3884 1 1 29 CYS N N 3.952 18.007 12.385 1.00 . A A . 29 CYS N 1 1 7 3885 1 1 29 CYS O O 4.472 18.316 15.781 1.00 . A A . 29 CYS O 1 1 7 3886 1 1 29 CYS SG S 2.828 15.177 13.177 1.00 . A A . 29 CYS SG 1 1 7 3887 1 1 30 GLY C C 6.199 15.127 16.009 1.00 . A A . 30 GLY C 1 1 7 3888 1 1 30 GLY CA C 6.456 16.439 15.266 1.00 . A A . 30 GLY CA 1 1 7 3889 1 1 30 GLY H H 5.323 16.254 13.527 1.00 . A A . 30 GLY H 1 1 7 3890 1 1 30 GLY HA2 H 7.374 16.358 14.683 1.00 . A A . 30 GLY HA2 1 1 7 3891 1 1 30 GLY HA3 H 6.606 17.245 15.984 1.00 . A A . 30 GLY HA3 1 1 7 3892 1 1 30 GLY N N 5.347 16.766 14.386 1.00 . A A . 30 GLY N 1 1 7 3893 1 1 30 GLY O O 7.073 14.626 16.713 1.00 . A A . 30 GLY O 1 1 7 3894 1 1 31 ALA C C 5.562 12.250 16.031 1.00 . A A . 31 ALA C 1 1 7 3895 1 1 31 ALA CA C 4.609 13.363 16.472 1.00 . A A . 31 ALA CA 1 1 7 3896 1 1 31 ALA CB C 3.149 13.046 16.140 1.00 . A A . 31 ALA CB 1 1 7 3897 1 1 31 ALA H H 4.287 15.021 15.252 1.00 . A A . 31 ALA H 1 1 7 3898 1 1 31 ALA HA H 4.702 13.505 17.548 1.00 . A A . 31 ALA HA 1 1 7 3899 1 1 31 ALA HB1 H 2.729 13.853 15.539 1.00 . A A . 31 ALA HB1 1 1 7 3900 1 1 31 ALA HB2 H 3.099 12.112 15.581 1.00 . A A . 31 ALA HB2 1 1 7 3901 1 1 31 ALA HB3 H 2.580 12.948 17.064 1.00 . A A . 31 ALA HB3 1 1 7 3902 1 1 31 ALA N N 4.993 14.607 15.827 1.00 . A A . 31 ALA N 1 1 7 3903 1 1 31 ALA O O 6.281 12.399 15.045 1.00 . A A . 31 ALA O 1 1 7 3904 1 1 32 SER C C 5.827 9.249 15.290 1.00 . A A . 32 SER C 1 1 7 3905 1 1 32 SER CA C 6.389 10.023 16.484 1.00 . A A . 32 SER CA 1 1 7 3906 1 1 32 SER CB C 6.525 9.101 17.697 1.00 . A A . 32 SER CB 1 1 7 3907 1 1 32 SER H H 4.948 11.048 17.585 1.00 . A A . 32 SER H 1 1 7 3908 1 1 32 SER HA H 7.363 10.449 16.240 1.00 . A A . 32 SER HA 1 1 7 3909 1 1 32 SER HB2 H 7.125 8.232 17.427 1.00 . A A . 32 SER HB2 1 1 7 3910 1 1 32 SER HB3 H 7.060 9.624 18.491 1.00 . A A . 32 SER HB3 1 1 7 3911 1 1 32 SER HG H 4.981 9.234 18.963 1.00 . A A . 32 SER HG 1 1 7 3912 1 1 32 SER N N 5.537 11.160 16.784 1.00 . A A . 32 SER N 1 1 7 3913 1 1 32 SER O O 4.738 9.551 14.806 1.00 . A A . 32 SER O 1 1 7 3914 1 1 32 SER OG O 5.258 8.670 18.185 1.00 . A A . 32 SER OG 1 1 7 3915 1 1 33 LYS C C 5.264 6.330 14.214 1.00 . A A . 33 LYS C 1 1 7 3916 1 1 33 LYS CA C 6.189 7.444 13.721 1.00 . A A . 33 LYS CA 1 1 7 3917 1 1 33 LYS CB C 7.414 6.934 12.959 1.00 . A A . 33 LYS CB 1 1 7 3918 1 1 33 LYS CD C 9.525 6.102 14.060 1.00 . A A . 33 LYS CD 1 1 7 3919 1 1 33 LYS CE C 9.933 5.426 15.372 1.00 . A A . 33 LYS CE 1 1 7 3920 1 1 33 LYS CG C 8.075 5.770 13.701 1.00 . A A . 33 LYS CG 1 1 7 3921 1 1 33 LYS H H 7.481 8.024 15.248 1.00 . A A . 33 LYS H 1 1 7 3922 1 1 33 LYS HA H 5.628 8.083 13.038 1.00 . A A . 33 LYS HA 1 1 7 3923 1 1 33 LYS HB2 H 7.119 6.613 11.961 1.00 . A A . 33 LYS HB2 1 1 7 3924 1 1 33 LYS HB3 H 8.132 7.744 12.833 1.00 . A A . 33 LYS HB3 1 1 7 3925 1 1 33 LYS HD2 H 10.186 5.775 13.258 1.00 . A A . 33 LYS HD2 1 1 7 3926 1 1 33 LYS HD3 H 9.643 7.181 14.151 1.00 . A A . 33 LYS HD3 1 1 7 3927 1 1 33 LYS HE2 H 10.539 6.109 15.966 1.00 . A A . 33 LYS HE2 1 1 7 3928 1 1 33 LYS HE3 H 9.044 5.194 15.959 1.00 . A A . 33 LYS HE3 1 1 7 3929 1 1 33 LYS HG2 H 7.514 5.546 14.607 1.00 . A A . 33 LYS HG2 1 1 7 3930 1 1 33 LYS HG3 H 8.046 4.875 13.079 1.00 . A A . 33 LYS HG3 1 1 7 3931 1 1 33 LYS HZ1 H 10.551 3.852 14.153 1.00 . A A . 33 LYS HZ1 1 1 7 3932 1 1 33 LYS HZ2 H 11.692 4.320 15.217 1.00 . A A . 33 LYS HZ2 1 1 7 3933 1 1 33 LYS N N 6.596 8.264 14.849 1.00 . A A . 33 LYS N 1 1 7 3934 1 1 33 LYS NZ N 10.693 4.185 15.100 1.00 . A A . 33 LYS NZ 1 1 7 3935 1 1 33 LYS O O 5.471 5.160 13.897 1.00 . A A . 33 LYS O 1 1 7 3936 1 1 34 ASP C C 1.934 6.029 14.882 1.00 . A A . 34 ASP C 1 1 7 3937 1 1 34 ASP CA C 3.302 5.783 15.520 1.00 . A A . 34 ASP CA 1 1 7 3938 1 1 34 ASP CB C 3.156 5.950 17.034 1.00 . A A . 34 ASP CB 1 1 7 3939 1 1 34 ASP CG C 2.222 4.941 17.707 1.00 . A A . 34 ASP CG 1 1 7 3940 1 1 34 ASP H H 4.098 7.687 15.233 1.00 . A A . 34 ASP H 1 1 7 3941 1 1 34 ASP HA H 3.706 4.801 15.277 1.00 . A A . 34 ASP HA 1 1 7 3942 1 1 34 ASP HB2 H 4.142 5.871 17.491 1.00 . A A . 34 ASP HB2 1 1 7 3943 1 1 34 ASP HB3 H 2.788 6.955 17.240 1.00 . A A . 34 ASP HB3 1 1 7 3944 1 1 34 ASP HD2 H 0.392 4.951 17.263 1.00 . A A . 34 ASP HD2 1 1 7 3945 1 1 34 ASP N N 4.261 6.733 14.981 1.00 . A A . 34 ASP N 1 1 7 3946 1 1 34 ASP O O 1.316 5.104 14.356 1.00 . A A . 34 ASP O 1 1 7 3947 1 1 34 ASP OD1 O 2.622 3.808 18.014 1.00 . A A . 34 ASP OD1 1 1 7 3948 1 1 34 ASP OD2 O 1.023 5.364 17.920 1.00 . A A . 34 ASP OD2 1 1 7 3949 1 1 35 ALA C C 0.208 7.341 12.888 1.00 . A A . 35 ALA C 1 1 7 3950 1 1 35 ALA CA C 0.215 7.657 14.386 1.00 . A A . 35 ALA CA 1 1 7 3951 1 1 35 ALA CB C -0.053 9.135 14.671 1.00 . A A . 35 ALA CB 1 1 7 3952 1 1 35 ALA H H 2.008 8.024 15.381 1.00 . A A . 35 ALA H 1 1 7 3953 1 1 35 ALA HA H -0.552 7.059 14.878 1.00 . A A . 35 ALA HA 1 1 7 3954 1 1 35 ALA HB1 H 0.590 9.471 15.485 1.00 . A A . 35 ALA HB1 1 1 7 3955 1 1 35 ALA HB2 H 0.156 9.721 13.776 1.00 . A A . 35 ALA HB2 1 1 7 3956 1 1 35 ALA HB3 H -1.097 9.267 14.956 1.00 . A A . 35 ALA HB3 1 1 7 3957 1 1 35 ALA N N 1.500 7.279 14.950 1.00 . A A . 35 ALA N 1 1 7 3958 1 1 35 ALA O O -0.853 7.148 12.296 1.00 . A A . 35 ALA O 1 1 7 3959 1 1 36 PHE C C 1.028 5.609 10.573 1.00 . A A . 36 PHE C 1 1 7 3960 1 1 36 PHE CA C 1.550 7.009 10.904 1.00 . A A . 36 PHE CA 1 1 7 3961 1 1 36 PHE CB C 3.044 7.072 10.585 1.00 . A A . 36 PHE CB 1 1 7 3962 1 1 36 PHE CD1 C 3.936 9.209 11.537 1.00 . A A . 36 PHE CD1 1 1 7 3963 1 1 36 PHE CD2 C 3.726 9.042 9.197 1.00 . A A . 36 PHE CD2 1 1 7 3964 1 1 36 PHE CE1 C 4.443 10.529 11.396 1.00 . A A . 36 PHE CE1 1 1 7 3965 1 1 36 PHE CE2 C 4.232 10.361 9.057 1.00 . A A . 36 PHE CE2 1 1 7 3966 1 1 36 PHE CG C 3.589 8.494 10.433 1.00 . A A . 36 PHE CG 1 1 7 3967 1 1 36 PHE CZ C 4.579 11.076 10.159 1.00 . A A . 36 PHE CZ 1 1 7 3968 1 1 36 PHE H H 2.263 7.456 12.809 1.00 . A A . 36 PHE H 1 1 7 3969 1 1 36 PHE HA H 0.963 7.750 10.360 1.00 . A A . 36 PHE HA 1 1 7 3970 1 1 36 PHE HB2 H 3.596 6.565 11.377 1.00 . A A . 36 PHE HB2 1 1 7 3971 1 1 36 PHE HB3 H 3.233 6.521 9.662 1.00 . A A . 36 PHE HB3 1 1 7 3972 1 1 36 PHE HD1 H 3.827 8.770 12.528 1.00 . A A . 36 PHE HD1 1 1 7 3973 1 1 36 PHE HD2 H 3.448 8.468 8.312 1.00 . A A . 36 PHE HD2 1 1 7 3974 1 1 36 PHE HE1 H 4.721 11.103 12.281 1.00 . A A . 36 PHE HE1 1 1 7 3975 1 1 36 PHE HE2 H 4.342 10.799 8.065 1.00 . A A . 36 PHE HE2 1 1 7 3976 1 1 36 PHE HZ H 4.967 12.089 10.051 1.00 . A A . 36 PHE HZ 1 1 7 3977 1 1 36 PHE N N 1.404 7.298 12.321 1.00 . A A . 36 PHE N 1 1 7 3978 1 1 36 PHE O O 1.335 4.646 11.275 1.00 . A A . 36 PHE O 1 1 7 3979 1 1 37 GLU C C 0.130 3.950 7.646 1.00 . A A . 37 GLU C 1 1 7 3980 1 1 37 GLU CA C -0.319 4.273 9.072 1.00 . A A . 37 GLU CA 1 1 7 3981 1 1 37 GLU CB C -1.846 4.293 9.176 1.00 . A A . 37 GLU CB 1 1 7 3982 1 1 37 GLU CD C -1.790 1.786 9.452 1.00 . A A . 37 GLU CD 1 1 7 3983 1 1 37 GLU CG C -2.443 2.960 8.719 1.00 . A A . 37 GLU CG 1 1 7 3984 1 1 37 GLU H H 0.003 6.327 8.939 1.00 . A A . 37 GLU H 1 1 7 3985 1 1 37 GLU HA H 0.077 3.529 9.763 1.00 . A A . 37 GLU HA 1 1 7 3986 1 1 37 GLU HB2 H -2.141 4.494 10.206 1.00 . A A . 37 GLU HB2 1 1 7 3987 1 1 37 GLU HB3 H -2.245 5.102 8.566 1.00 . A A . 37 GLU HB3 1 1 7 3988 1 1 37 GLU HE2 H -2.052 -0.078 9.445 1.00 . A A . 37 GLU HE2 1 1 7 3989 1 1 37 GLU HG2 H -3.517 2.957 8.903 1.00 . A A . 37 GLU HG2 1 1 7 3990 1 1 37 GLU HG3 H -2.304 2.844 7.645 1.00 . A A . 37 GLU HG3 1 1 7 3991 1 1 37 GLU N N 0.248 5.539 9.505 1.00 . A A . 37 GLU N 1 1 7 3992 1 1 37 GLU O O 0.330 4.853 6.835 1.00 . A A . 37 GLU O 1 1 7 3993 1 1 37 GLU OE1 O -1.289 1.958 10.574 1.00 . A A . 37 GLU OE1 1 1 7 3994 1 1 37 GLU OE2 O -1.816 0.664 8.818 1.00 . A A . 37 GLU OE2 1 1 7 3995 1 1 38 LYS C C -0.534 2.013 5.182 1.00 . A A . 38 LYS C 1 1 7 3996 1 1 38 LYS CA C 0.697 2.206 6.070 1.00 . A A . 38 LYS CA 1 1 7 3997 1 1 38 LYS CB C 1.571 0.955 6.189 1.00 . A A . 38 LYS CB 1 1 7 3998 1 1 38 LYS CD C 1.951 0.027 3.875 1.00 . A A . 38 LYS CD 1 1 7 3999 1 1 38 LYS CE C 2.564 -1.374 3.835 1.00 . A A . 38 LYS CE 1 1 7 4000 1 1 38 LYS CG C 2.547 0.854 5.016 1.00 . A A . 38 LYS CG 1 1 7 4001 1 1 38 LYS H H 0.111 1.931 8.050 1.00 . A A . 38 LYS H 1 1 7 4002 1 1 38 LYS HA H 1.317 2.991 5.636 1.00 . A A . 38 LYS HA 1 1 7 4003 1 1 38 LYS HB2 H 2.125 0.982 7.128 1.00 . A A . 38 LYS HB2 1 1 7 4004 1 1 38 LYS HB3 H 0.938 0.067 6.219 1.00 . A A . 38 LYS HB3 1 1 7 4005 1 1 38 LYS HD2 H 0.870 -0.048 4.002 1.00 . A A . 38 LYS HD2 1 1 7 4006 1 1 38 LYS HD3 H 2.125 0.532 2.926 1.00 . A A . 38 LYS HD3 1 1 7 4007 1 1 38 LYS HE2 H 3.016 -1.551 2.859 1.00 . A A . 38 LYS HE2 1 1 7 4008 1 1 38 LYS HE3 H 3.361 -1.451 4.574 1.00 . A A . 38 LYS HE3 1 1 7 4009 1 1 38 LYS HG2 H 2.793 1.853 4.656 1.00 . A A . 38 LYS HG2 1 1 7 4010 1 1 38 LYS HG3 H 3.479 0.398 5.352 1.00 . A A . 38 LYS HG3 1 1 7 4011 1 1 38 LYS HZ1 H 1.450 -3.065 3.342 1.00 . A A . 38 LYS HZ1 1 1 7 4012 1 1 38 LYS HZ2 H 1.735 -2.935 4.939 1.00 . A A . 38 LYS HZ2 1 1 7 4013 1 1 38 LYS N N 0.275 2.659 7.384 1.00 . A A . 38 LYS N 1 1 7 4014 1 1 38 LYS NZ N 1.531 -2.399 4.103 1.00 . A A . 38 LYS NZ 1 1 7 4015 1 1 38 LYS O O -1.201 0.982 5.255 1.00 . A A . 38 LYS O 1 1 7 4016 1 1 39 GLN C C -1.567 3.583 2.108 1.00 . A A . 39 GLN C 1 1 7 4017 1 1 39 GLN CA C -1.937 2.976 3.463 1.00 . A A . 39 GLN CA 1 1 7 4018 1 1 39 GLN CB C -3.146 3.689 4.072 1.00 . A A . 39 GLN CB 1 1 7 4019 1 1 39 GLN CD C -4.816 1.845 3.651 1.00 . A A . 39 GLN CD 1 1 7 4020 1 1 39 GLN CG C -4.106 2.686 4.716 1.00 . A A . 39 GLN CG 1 1 7 4021 1 1 39 GLN H H -0.250 3.856 4.311 1.00 . A A . 39 GLN H 1 1 7 4022 1 1 39 GLN HA H -2.169 1.918 3.343 1.00 . A A . 39 GLN HA 1 1 7 4023 1 1 39 GLN HB2 H -2.810 4.407 4.819 1.00 . A A . 39 GLN HB2 1 1 7 4024 1 1 39 GLN HB3 H -3.668 4.253 3.298 1.00 . A A . 39 GLN HB3 1 1 7 4025 1 1 39 GLN HE21 H -6.517 2.869 4.044 1.00 . A A . 39 GLN HE21 1 1 7 4026 1 1 39 GLN HE22 H -6.650 1.653 2.818 1.00 . A A . 39 GLN HE22 1 1 7 4027 1 1 39 GLN HG2 H -3.556 2.033 5.393 1.00 . A A . 39 GLN HG2 1 1 7 4028 1 1 39 GLN HG3 H -4.845 3.218 5.315 1.00 . A A . 39 GLN HG3 1 1 7 4029 1 1 39 GLN N N -0.797 3.021 4.364 1.00 . A A . 39 GLN N 1 1 7 4030 1 1 39 GLN NE2 N -6.101 2.147 3.491 1.00 . A A . 39 GLN NE2 1 1 7 4031 1 1 39 GLN O O -1.992 3.089 1.066 1.00 . A A . 39 GLN O 1 1 7 4032 1 1 39 GLN OE1 O -4.234 0.980 3.017 1.00 . A A . 39 GLN OE1 1 1 8 4033 1 1 1 MET C C 5.430 0.559 -1.440 1.00 . A A . 1 MET C 1 1 8 4034 1 1 1 MET CA C 6.131 0.439 -2.795 1.00 . A A . 1 MET CA 1 1 8 4035 1 1 1 MET CB C 5.791 -0.913 -3.427 1.00 . A A . 1 MET CB 1 1 8 4036 1 1 1 MET CE C 3.310 -2.319 -4.959 1.00 . A A . 1 MET CE 1 1 8 4037 1 1 1 MET CG C 5.563 -0.770 -4.934 1.00 . A A . 1 MET CG 1 1 8 4038 1 1 1 MET H1 H 7.933 1.482 -2.758 1.00 . A A . 1 MET H1 1 1 8 4039 1 1 1 MET HA H 5.834 1.265 -3.440 1.00 . A A . 1 MET HA 1 1 8 4040 1 1 1 MET HB2 H 6.601 -1.618 -3.243 1.00 . A A . 1 MET HB2 1 1 8 4041 1 1 1 MET HB3 H 4.897 -1.323 -2.959 1.00 . A A . 1 MET HB3 1 1 8 4042 1 1 1 MET HE1 H 3.210 -3.119 -4.226 1.00 . A A . 1 MET HE1 1 1 8 4043 1 1 1 MET HE2 H 3.102 -1.361 -4.484 1.00 . A A . 1 MET HE2 1 1 8 4044 1 1 1 MET HE3 H 2.602 -2.482 -5.772 1.00 . A A . 1 MET HE3 1 1 8 4045 1 1 1 MET HG2 H 4.841 0.022 -5.128 1.00 . A A . 1 MET HG2 1 1 8 4046 1 1 1 MET HG3 H 6.493 -0.482 -5.425 1.00 . A A . 1 MET HG3 1 1 8 4047 1 1 1 MET N N 7.571 0.556 -2.648 1.00 . A A . 1 MET N 1 1 8 4048 1 1 1 MET O O 5.100 -0.448 -0.816 1.00 . A A . 1 MET O 1 1 8 4049 1 1 1 MET SD S 4.972 -2.313 -5.611 1.00 . A A . 1 MET SD 1 1 8 4050 1 1 2 ASP C C 4.488 3.577 0.467 1.00 . A A . 2 ASP C 1 1 8 4051 1 1 2 ASP CA C 4.566 2.066 0.243 1.00 . A A . 2 ASP CA 1 1 8 4052 1 1 2 ASP CB C 5.350 1.456 1.407 1.00 . A A . 2 ASP CB 1 1 8 4053 1 1 2 ASP CG C 6.849 1.762 1.407 1.00 . A A . 2 ASP CG 1 1 8 4054 1 1 2 ASP H H 5.493 2.615 -1.540 1.00 . A A . 2 ASP H 1 1 8 4055 1 1 2 ASP HA H 3.582 1.605 0.158 1.00 . A A . 2 ASP HA 1 1 8 4056 1 1 2 ASP HB2 H 4.921 1.815 2.342 1.00 . A A . 2 ASP HB2 1 1 8 4057 1 1 2 ASP HB3 H 5.215 0.374 1.389 1.00 . A A . 2 ASP HB3 1 1 8 4058 1 1 2 ASP HD2 H 6.612 3.230 2.562 1.00 . A A . 2 ASP HD2 1 1 8 4059 1 1 2 ASP N N 5.222 1.800 -1.025 1.00 . A A . 2 ASP N 1 1 8 4060 1 1 2 ASP O O 5.182 4.343 -0.201 1.00 . A A . 2 ASP O 1 1 8 4061 1 1 2 ASP OD1 O 7.590 1.330 0.511 1.00 . A A . 2 ASP OD1 1 1 8 4062 1 1 2 ASP OD2 O 7.257 2.486 2.394 1.00 . A A . 2 ASP OD2 1 1 8 4063 1 1 3 ILE C C 3.157 5.513 3.218 1.00 . A A . 3 ILE C 1 1 8 4064 1 1 3 ILE CA C 3.460 5.368 1.725 1.00 . A A . 3 ILE CA 1 1 8 4065 1 1 3 ILE CB C 2.400 5.994 0.819 1.00 . A A . 3 ILE CB 1 1 8 4066 1 1 3 ILE CD1 C 1.795 6.586 -1.558 1.00 . A A . 3 ILE CD1 1 1 8 4067 1 1 3 ILE CG1 C 2.906 6.108 -0.620 1.00 . A A . 3 ILE CG1 1 1 8 4068 1 1 3 ILE CG2 C 1.931 7.342 1.370 1.00 . A A . 3 ILE CG2 1 1 8 4069 1 1 3 ILE H H 3.076 3.332 1.945 1.00 . A A . 3 ILE H 1 1 8 4070 1 1 3 ILE HA H 4.403 5.872 1.514 1.00 . A A . 3 ILE HA 1 1 8 4071 1 1 3 ILE HB H 1.531 5.334 0.803 1.00 . A A . 3 ILE HB 1 1 8 4072 1 1 3 ILE HD11 H 1.824 7.673 -1.631 1.00 . A A . 3 ILE HD11 1 1 8 4073 1 1 3 ILE HD12 H 1.941 6.150 -2.546 1.00 . A A . 3 ILE HD12 1 1 8 4074 1 1 3 ILE HD13 H 0.828 6.274 -1.162 1.00 . A A . 3 ILE HD13 1 1 8 4075 1 1 3 ILE HG12 H 3.744 6.804 -0.660 1.00 . A A . 3 ILE HG12 1 1 8 4076 1 1 3 ILE HG13 H 3.280 5.141 -0.956 1.00 . A A . 3 ILE HG13 1 1 8 4077 1 1 3 ILE HG21 H 2.701 7.754 2.023 1.00 . A A . 3 ILE HG21 1 1 8 4078 1 1 3 ILE HG22 H 1.750 8.029 0.544 1.00 . A A . 3 ILE HG22 1 1 8 4079 1 1 3 ILE HG23 H 1.011 7.202 1.936 1.00 . A A . 3 ILE HG23 1 1 8 4080 1 1 3 ILE N N 3.638 3.961 1.407 1.00 . A A . 3 ILE N 1 1 8 4081 1 1 3 ILE O O 2.476 4.693 3.830 1.00 . A A . 3 ILE O 1 1 8 4082 1 1 4 TYR C C 2.938 8.281 5.382 1.00 . A A . 4 TYR C 1 1 8 4083 1 1 4 TYR CA C 3.492 6.874 5.208 1.00 . A A . 4 TYR CA 1 1 8 4084 1 1 4 TYR CB C 4.821 6.719 5.943 1.00 . A A . 4 TYR CB 1 1 8 4085 1 1 4 TYR CD1 C 4.789 4.586 7.285 1.00 . A A . 4 TYR CD1 1 1 8 4086 1 1 4 TYR CD2 C 6.050 4.643 5.214 1.00 . A A . 4 TYR CD2 1 1 8 4087 1 1 4 TYR CE1 C 5.168 3.253 7.479 1.00 . A A . 4 TYR CE1 1 1 8 4088 1 1 4 TYR CE2 C 6.430 3.310 5.410 1.00 . A A . 4 TYR CE2 1 1 8 4089 1 1 4 TYR CG C 5.230 5.281 6.153 1.00 . A A . 4 TYR CG 1 1 8 4090 1 1 4 TYR CZ C 5.989 2.615 6.542 1.00 . A A . 4 TYR CZ 1 1 8 4091 1 1 4 TYR H H 4.238 7.237 3.252 1.00 . A A . 4 TYR H 1 1 8 4092 1 1 4 TYR HA H 2.777 6.159 5.616 1.00 . A A . 4 TYR HA 1 1 8 4093 1 1 4 TYR HB2 H 5.598 7.222 5.367 1.00 . A A . 4 TYR HB2 1 1 8 4094 1 1 4 TYR HB3 H 4.738 7.203 6.916 1.00 . A A . 4 TYR HB3 1 1 8 4095 1 1 4 TYR HD1 H 4.156 5.079 8.009 1.00 . A A . 4 TYR HD1 1 1 8 4096 1 1 4 TYR HD2 H 6.391 5.179 4.341 1.00 . A A . 4 TYR HD2 1 1 8 4097 1 1 4 TYR HE1 H 4.828 2.716 8.353 1.00 . A A . 4 TYR HE1 1 1 8 4098 1 1 4 TYR HE2 H 7.062 2.817 4.686 1.00 . A A . 4 TYR HE2 1 1 8 4099 1 1 4 TYR HH H 5.818 0.864 7.385 1.00 . A A . 4 TYR HH 1 1 8 4100 1 1 4 TYR N N 3.685 6.593 3.799 1.00 . A A . 4 TYR N 1 1 8 4101 1 1 4 TYR O O 3.721 9.203 5.603 1.00 . A A . 4 TYR O 1 1 8 4102 1 1 4 TYR OH O 6.358 1.315 6.731 1.00 . A A . 4 TYR OH 1 1 8 4103 1 1 5 VAL C C 0.514 9.883 6.877 1.00 . A A . 5 VAL C 1 1 8 4104 1 1 5 VAL CA C 0.995 9.719 5.434 1.00 . A A . 5 VAL CA 1 1 8 4105 1 1 5 VAL CB C -0.130 9.877 4.408 1.00 . A A . 5 VAL CB 1 1 8 4106 1 1 5 VAL CG1 C -0.999 11.094 4.732 1.00 . A A . 5 VAL CG1 1 1 8 4107 1 1 5 VAL CG2 C 0.433 9.969 2.988 1.00 . A A . 5 VAL CG2 1 1 8 4108 1 1 5 VAL H H 0.995 7.662 5.104 1.00 . A A . 5 VAL H 1 1 8 4109 1 1 5 VAL HA H 1.751 10.476 5.226 1.00 . A A . 5 VAL HA 1 1 8 4110 1 1 5 VAL HB H -0.760 8.991 4.462 1.00 . A A . 5 VAL HB 1 1 8 4111 1 1 5 VAL HG11 H -0.408 12.003 4.625 1.00 . A A . 5 VAL HG11 1 1 8 4112 1 1 5 VAL HG12 H -1.847 11.128 4.047 1.00 . A A . 5 VAL HG12 1 1 8 4113 1 1 5 VAL HG13 H -1.364 11.017 5.756 1.00 . A A . 5 VAL HG13 1 1 8 4114 1 1 5 VAL HG21 H 1.113 10.818 2.920 1.00 . A A . 5 VAL HG21 1 1 8 4115 1 1 5 VAL HG22 H 0.973 9.052 2.752 1.00 . A A . 5 VAL HG22 1 1 8 4116 1 1 5 VAL HG23 H -0.385 10.101 2.280 1.00 . A A . 5 VAL HG23 1 1 8 4117 1 1 5 VAL N N 1.625 8.417 5.283 1.00 . A A . 5 VAL N 1 1 8 4118 1 1 5 VAL O O -0.313 9.108 7.353 1.00 . A A . 5 VAL O 1 1 8 4119 1 1 6 CYS C C -0.830 11.313 8.991 1.00 . A A . 6 CYS C 1 1 8 4120 1 1 6 CYS CA C 0.692 11.176 8.913 1.00 . A A . 6 CYS CA 1 1 8 4121 1 1 6 CYS CB C 1.405 12.419 9.448 1.00 . A A . 6 CYS CB 1 1 8 4122 1 1 6 CYS H H 1.728 11.526 7.140 1.00 . A A . 6 CYS H 1 1 8 4123 1 1 6 CYS HA H 1.034 10.326 9.504 1.00 . A A . 6 CYS HA 1 1 8 4124 1 1 6 CYS HB2 H 2.440 12.404 9.104 1.00 . A A . 6 CYS HB2 1 1 8 4125 1 1 6 CYS HB3 H 0.939 13.304 9.013 1.00 . A A . 6 CYS HB3 1 1 8 4126 1 1 6 CYS N N 1.055 10.900 7.534 1.00 . A A . 6 CYS N 1 1 8 4127 1 1 6 CYS O O -1.468 11.741 8.031 1.00 . A A . 6 CYS O 1 1 8 4128 1 1 6 CYS SG S 1.396 12.587 11.270 1.00 . A A . 6 CYS SG 1 1 8 4129 1 1 7 THR C C -3.133 12.135 11.354 1.00 . A A . 7 THR C 1 1 8 4130 1 1 7 THR CA C -2.802 11.020 10.361 1.00 . A A . 7 THR CA 1 1 8 4131 1 1 7 THR CB C -3.287 9.641 10.812 1.00 . A A . 7 THR CB 1 1 8 4132 1 1 7 THR CG2 C -3.019 8.555 9.768 1.00 . A A . 7 THR CG2 1 1 8 4133 1 1 7 THR H H -0.841 10.597 10.921 1.00 . A A . 7 THR H 1 1 8 4134 1 1 7 THR HA H -3.278 11.282 9.416 1.00 . A A . 7 THR HA 1 1 8 4135 1 1 7 THR HB H -4.342 9.669 11.082 1.00 . A A . 7 THR HB 1 1 8 4136 1 1 7 THR HG1 H -2.575 9.925 12.660 1.00 . A A . 7 THR HG1 1 1 8 4137 1 1 7 THR HG21 H -2.947 9.011 8.781 1.00 . A A . 7 THR HG21 1 1 8 4138 1 1 7 THR HG22 H -2.083 8.048 10.002 1.00 . A A . 7 THR HG22 1 1 8 4139 1 1 7 THR HG23 H -3.835 7.833 9.776 1.00 . A A . 7 THR HG23 1 1 8 4140 1 1 7 THR N N -1.367 10.944 10.144 1.00 . A A . 7 THR N 1 1 8 4141 1 1 7 THR O O -4.223 12.161 11.924 1.00 . A A . 7 THR O 1 1 8 4142 1 1 7 THR OG1 O -2.420 9.304 11.892 1.00 . A A . 7 THR OG1 1 1 8 4143 1 1 8 VAL C C -2.370 15.453 11.651 1.00 . A A . 8 VAL C 1 1 8 4144 1 1 8 VAL CA C -2.348 14.146 12.447 1.00 . A A . 8 VAL CA 1 1 8 4145 1 1 8 VAL CB C -1.260 14.117 13.521 1.00 . A A . 8 VAL CB 1 1 8 4146 1 1 8 VAL CG1 C -1.062 15.504 14.138 1.00 . A A . 8 VAL CG1 1 1 8 4147 1 1 8 VAL CG2 C -1.578 13.078 14.597 1.00 . A A . 8 VAL CG2 1 1 8 4148 1 1 8 VAL H H -1.289 13.003 11.064 1.00 . A A . 8 VAL H 1 1 8 4149 1 1 8 VAL HA H -3.312 14.018 12.939 1.00 . A A . 8 VAL HA 1 1 8 4150 1 1 8 VAL HB H -0.324 13.827 13.042 1.00 . A A . 8 VAL HB 1 1 8 4151 1 1 8 VAL HG11 H -1.979 16.083 14.031 1.00 . A A . 8 VAL HG11 1 1 8 4152 1 1 8 VAL HG12 H -0.820 15.399 15.196 1.00 . A A . 8 VAL HG12 1 1 8 4153 1 1 8 VAL HG13 H -0.248 16.016 13.627 1.00 . A A . 8 VAL HG13 1 1 8 4154 1 1 8 VAL HG21 H -1.209 12.103 14.281 1.00 . A A . 8 VAL HG21 1 1 8 4155 1 1 8 VAL HG22 H -1.096 13.363 15.532 1.00 . A A . 8 VAL HG22 1 1 8 4156 1 1 8 VAL HG23 H -2.657 13.027 14.746 1.00 . A A . 8 VAL HG23 1 1 8 4157 1 1 8 VAL N N -2.172 13.030 11.531 1.00 . A A . 8 VAL N 1 1 8 4158 1 1 8 VAL O O -3.281 16.264 11.809 1.00 . A A . 8 VAL O 1 1 8 4159 1 1 9 CYS C C -1.532 16.426 8.544 1.00 . A A . 9 CYS C 1 1 8 4160 1 1 9 CYS CA C -1.247 16.812 9.997 1.00 . A A . 9 CYS CA 1 1 8 4161 1 1 9 CYS CB C 0.120 17.481 10.151 1.00 . A A . 9 CYS CB 1 1 8 4162 1 1 9 CYS H H -0.617 14.952 10.694 1.00 . A A . 9 CYS H 1 1 8 4163 1 1 9 CYS HA H -1.995 17.513 10.365 1.00 . A A . 9 CYS HA 1 1 8 4164 1 1 9 CYS HB2 H 0.258 18.189 9.333 1.00 . A A . 9 CYS HB2 1 1 8 4165 1 1 9 CYS HB3 H 0.125 18.059 11.076 1.00 . A A . 9 CYS HB3 1 1 8 4166 1 1 9 CYS N N -1.355 15.617 10.816 1.00 . A A . 9 CYS N 1 1 8 4167 1 1 9 CYS O O -1.862 17.281 7.724 1.00 . A A . 9 CYS O 1 1 8 4168 1 1 9 CYS SG S 1.541 16.328 10.173 1.00 . A A . 9 CYS SG 1 1 8 4169 1 1 10 GLY C C -0.362 14.696 6.082 1.00 . A A . 10 GLY C 1 1 8 4170 1 1 10 GLY CA C -1.634 14.628 6.930 1.00 . A A . 10 GLY CA 1 1 8 4171 1 1 10 GLY H H -1.126 14.448 8.942 1.00 . A A . 10 GLY H 1 1 8 4172 1 1 10 GLY HA2 H -1.982 13.596 6.986 1.00 . A A . 10 GLY HA2 1 1 8 4173 1 1 10 GLY HA3 H -2.425 15.205 6.453 1.00 . A A . 10 GLY HA3 1 1 8 4174 1 1 10 GLY N N -1.395 15.138 8.270 1.00 . A A . 10 GLY N 1 1 8 4175 1 1 10 GLY O O -0.394 14.670 4.853 1.00 . A A . 10 GLY O 1 1 8 4176 1 1 11 TYR C C 2.209 13.717 5.131 1.00 . A A . 11 TYR C 1 1 8 4177 1 1 11 TYR CA C 2.064 14.864 6.120 1.00 . A A . 11 TYR CA 1 1 8 4178 1 1 11 TYR CB C 3.171 14.815 7.170 1.00 . A A . 11 TYR CB 1 1 8 4179 1 1 11 TYR CD1 C 4.755 16.030 5.632 1.00 . A A . 11 TYR CD1 1 1 8 4180 1 1 11 TYR CD2 C 5.628 14.265 7.048 1.00 . A A . 11 TYR CD2 1 1 8 4181 1 1 11 TYR CE1 C 6.034 16.241 5.105 1.00 . A A . 11 TYR CE1 1 1 8 4182 1 1 11 TYR CE2 C 6.907 14.476 6.520 1.00 . A A . 11 TYR CE2 1 1 8 4183 1 1 11 TYR CG C 4.552 15.042 6.603 1.00 . A A . 11 TYR CG 1 1 8 4184 1 1 11 TYR CZ C 7.111 15.464 5.550 1.00 . A A . 11 TYR CZ 1 1 8 4185 1 1 11 TYR H H 0.746 14.806 7.785 1.00 . A A . 11 TYR H 1 1 8 4186 1 1 11 TYR HA H 2.132 15.808 5.579 1.00 . A A . 11 TYR HA 1 1 8 4187 1 1 11 TYR HB2 H 2.973 15.580 7.921 1.00 . A A . 11 TYR HB2 1 1 8 4188 1 1 11 TYR HB3 H 3.150 13.838 7.653 1.00 . A A . 11 TYR HB3 1 1 8 4189 1 1 11 TYR HD1 H 3.924 16.629 5.288 1.00 . A A . 11 TYR HD1 1 1 8 4190 1 1 11 TYR HD2 H 5.471 13.504 7.797 1.00 . A A . 11 TYR HD2 1 1 8 4191 1 1 11 TYR HE1 H 6.191 17.002 4.355 1.00 . A A . 11 TYR HE1 1 1 8 4192 1 1 11 TYR HE2 H 7.738 13.877 6.864 1.00 . A A . 11 TYR HE2 1 1 8 4193 1 1 11 TYR HH H 9.058 15.499 5.671 1.00 . A A . 11 TYR HH 1 1 8 4194 1 1 11 TYR N N 0.775 14.788 6.776 1.00 . A A . 11 TYR N 1 1 8 4195 1 1 11 TYR O O 1.564 12.685 5.316 1.00 . A A . 11 TYR O 1 1 8 4196 1 1 11 TYR OH O 8.358 15.669 5.036 1.00 . A A . 11 TYR OH 1 1 8 4197 1 1 12 GLU C C 4.712 12.436 3.107 1.00 . A A . 12 GLU C 1 1 8 4198 1 1 12 GLU CA C 3.248 12.879 3.114 1.00 . A A . 12 GLU CA 1 1 8 4199 1 1 12 GLU CB C 2.815 13.363 1.728 1.00 . A A . 12 GLU CB 1 1 8 4200 1 1 12 GLU CD C 1.596 11.435 0.651 1.00 . A A . 12 GLU CD 1 1 8 4201 1 1 12 GLU CG C 1.448 12.788 1.349 1.00 . A A . 12 GLU CG 1 1 8 4202 1 1 12 GLU H H 3.558 14.752 3.970 1.00 . A A . 12 GLU H 1 1 8 4203 1 1 12 GLU HA H 2.612 12.047 3.416 1.00 . A A . 12 GLU HA 1 1 8 4204 1 1 12 GLU HB2 H 2.771 14.451 1.716 1.00 . A A . 12 GLU HB2 1 1 8 4205 1 1 12 GLU HB3 H 3.556 13.065 0.986 1.00 . A A . 12 GLU HB3 1 1 8 4206 1 1 12 GLU HE2 H 0.442 10.152 -0.102 1.00 . A A . 12 GLU HE2 1 1 8 4207 1 1 12 GLU HG2 H 0.836 12.674 2.244 1.00 . A A . 12 GLU HG2 1 1 8 4208 1 1 12 GLU HG3 H 0.926 13.484 0.693 1.00 . A A . 12 GLU HG3 1 1 8 4209 1 1 12 GLU N N 3.037 13.910 4.114 1.00 . A A . 12 GLU N 1 1 8 4210 1 1 12 GLU O O 5.638 13.244 3.086 1.00 . A A . 12 GLU O 1 1 8 4211 1 1 12 GLU OE1 O 2.585 10.722 0.883 1.00 . A A . 12 GLU OE1 1 1 8 4212 1 1 12 GLU OE2 O 0.639 11.130 -0.158 1.00 . A A . 12 GLU OE2 1 1 8 4213 1 1 13 TYR C C 6.422 9.686 1.875 1.00 . A A . 13 TYR C 1 1 8 4214 1 1 13 TYR CA C 6.232 10.536 3.122 1.00 . A A . 13 TYR CA 1 1 8 4215 1 1 13 TYR CB C 6.420 9.697 4.383 1.00 . A A . 13 TYR CB 1 1 8 4216 1 1 13 TYR CD1 C 8.910 9.599 4.765 1.00 . A A . 13 TYR CD1 1 1 8 4217 1 1 13 TYR CD2 C 7.754 7.578 4.088 1.00 . A A . 13 TYR CD2 1 1 8 4218 1 1 13 TYR CE1 C 10.121 8.897 4.792 1.00 . A A . 13 TYR CE1 1 1 8 4219 1 1 13 TYR CE2 C 8.964 6.876 4.115 1.00 . A A . 13 TYR CE2 1 1 8 4220 1 1 13 TYR CG C 7.726 8.939 4.413 1.00 . A A . 13 TYR CG 1 1 8 4221 1 1 13 TYR CZ C 10.148 7.534 4.467 1.00 . A A . 13 TYR CZ 1 1 8 4222 1 1 13 TYR H H 4.107 10.493 3.141 1.00 . A A . 13 TYR H 1 1 8 4223 1 1 13 TYR HA H 6.968 11.340 3.119 1.00 . A A . 13 TYR HA 1 1 8 4224 1 1 13 TYR HB2 H 6.381 10.358 5.250 1.00 . A A . 13 TYR HB2 1 1 8 4225 1 1 13 TYR HB3 H 5.601 8.982 4.452 1.00 . A A . 13 TYR HB3 1 1 8 4226 1 1 13 TYR HD1 H 8.890 10.649 5.016 1.00 . A A . 13 TYR HD1 1 1 8 4227 1 1 13 TYR HD2 H 6.840 7.070 3.817 1.00 . A A . 13 TYR HD2 1 1 8 4228 1 1 13 TYR HE1 H 11.034 9.405 5.063 1.00 . A A . 13 TYR HE1 1 1 8 4229 1 1 13 TYR HE2 H 8.984 5.825 3.864 1.00 . A A . 13 TYR HE2 1 1 8 4230 1 1 13 TYR HH H 12.032 7.332 4.933 1.00 . A A . 13 TYR HH 1 1 8 4231 1 1 13 TYR N N 4.903 11.115 3.125 1.00 . A A . 13 TYR N 1 1 8 4232 1 1 13 TYR O O 5.436 9.391 1.200 1.00 . A A . 13 TYR O 1 1 8 4233 1 1 13 TYR OH O 11.327 6.851 4.493 1.00 . A A . 13 TYR OH 1 1 8 4234 1 1 14 ASP C C 9.026 7.467 0.783 1.00 . A A . 14 ASP C 1 1 8 4235 1 1 14 ASP CA C 7.953 8.499 0.427 1.00 . A A . 14 ASP CA 1 1 8 4236 1 1 14 ASP CB C 8.486 9.357 -0.722 1.00 . A A . 14 ASP CB 1 1 8 4237 1 1 14 ASP CG C 8.228 8.793 -2.122 1.00 . A A . 14 ASP CG 1 1 8 4238 1 1 14 ASP H H 8.459 9.556 2.149 1.00 . A A . 14 ASP H 1 1 8 4239 1 1 14 ASP HA H 7.004 8.036 0.156 1.00 . A A . 14 ASP HA 1 1 8 4240 1 1 14 ASP HB2 H 8.034 10.346 -0.658 1.00 . A A . 14 ASP HB2 1 1 8 4241 1 1 14 ASP HB3 H 9.560 9.486 -0.592 1.00 . A A . 14 ASP HB3 1 1 8 4242 1 1 14 ASP HD2 H 6.796 8.129 -3.149 1.00 . A A . 14 ASP HD2 1 1 8 4243 1 1 14 ASP N N 7.662 9.312 1.595 1.00 . A A . 14 ASP N 1 1 8 4244 1 1 14 ASP O O 9.989 7.746 1.495 1.00 . A A . 14 ASP O 1 1 8 4245 1 1 14 ASP OD1 O 9.147 8.291 -2.787 1.00 . A A . 14 ASP OD1 1 1 8 4246 1 1 14 ASP OD2 O 7.009 8.886 -2.532 1.00 . A A . 14 ASP OD2 1 1 8 4247 1 1 15 PRO C C 11.006 5.341 -0.315 1.00 . A A . 15 PRO C 1 1 8 4248 1 1 15 PRO CA C 9.721 5.128 0.473 1.00 . A A . 15 PRO CA 1 1 8 4249 1 1 15 PRO CB C 8.952 3.919 -0.053 1.00 . A A . 15 PRO CB 1 1 8 4250 1 1 15 PRO CD C 7.712 5.889 -0.573 1.00 . A A . 15 PRO CD 1 1 8 4251 1 1 15 PRO CG C 8.093 4.540 -1.178 1.00 . A A . 15 PRO CG 1 1 8 4252 1 1 15 PRO HA H 9.953 5.001 1.530 1.00 . A A . 15 PRO HA 1 1 8 4253 1 1 15 PRO HB2 H 9.610 3.157 -0.470 1.00 . A A . 15 PRO HB2 1 1 8 4254 1 1 15 PRO HB3 H 8.343 3.504 0.750 1.00 . A A . 15 PRO HB3 1 1 8 4255 1 1 15 PRO HD2 H 7.540 6.630 -1.354 1.00 . A A . 15 PRO HD2 1 1 8 4256 1 1 15 PRO HD3 H 6.823 5.779 0.048 1.00 . A A . 15 PRO HD3 1 1 8 4257 1 1 15 PRO HG2 H 8.232 4.654 -2.252 1.00 . A A . 15 PRO HG2 1 1 8 4258 1 1 15 PRO HG3 H 7.354 3.767 -0.964 1.00 . A A . 15 PRO HG3 1 1 8 4259 1 1 15 PRO N N 8.834 6.251 0.266 1.00 . A A . 15 PRO N 1 1 8 4260 1 1 15 PRO O O 11.043 4.998 -1.496 1.00 . A A . 15 PRO O 1 1 8 4261 1 1 16 ALA C C 14.156 7.034 0.568 1.00 . A A . 16 ALA C 1 1 8 4262 1 1 16 ALA CA C 13.288 6.143 -0.324 1.00 . A A . 16 ALA CA 1 1 8 4263 1 1 16 ALA CB C 13.036 6.763 -1.699 1.00 . A A . 16 ALA CB 1 1 8 4264 1 1 16 ALA H H 11.980 6.170 1.297 1.00 . A A . 16 ALA H 1 1 8 4265 1 1 16 ALA HA H 13.786 5.183 -0.457 1.00 . A A . 16 ALA HA 1 1 8 4266 1 1 16 ALA HB1 H 11.972 6.972 -1.814 1.00 . A A . 16 ALA HB1 1 1 8 4267 1 1 16 ALA HB2 H 13.600 7.692 -1.788 1.00 . A A . 16 ALA HB2 1 1 8 4268 1 1 16 ALA HB3 H 13.355 6.067 -2.475 1.00 . A A . 16 ALA HB3 1 1 8 4269 1 1 16 ALA N N 12.019 5.894 0.337 1.00 . A A . 16 ALA N 1 1 8 4270 1 1 16 ALA O O 14.387 8.200 0.248 1.00 . A A . 16 ALA O 1 1 8 4271 1 1 17 PHE C C 16.596 6.302 3.112 1.00 . A A . 17 PHE C 1 1 8 4272 1 1 17 PHE CA C 15.449 7.180 2.605 1.00 . A A . 17 PHE CA 1 1 8 4273 1 1 17 PHE CB C 14.560 7.570 3.787 1.00 . A A . 17 PHE CB 1 1 8 4274 1 1 17 PHE CD1 C 13.093 9.261 2.667 1.00 . A A . 17 PHE CD1 1 1 8 4275 1 1 17 PHE CD2 C 14.284 9.927 4.586 1.00 . A A . 17 PHE CD2 1 1 8 4276 1 1 17 PHE CE1 C 12.533 10.562 2.563 1.00 . A A . 17 PHE CE1 1 1 8 4277 1 1 17 PHE CE2 C 13.724 11.228 4.483 1.00 . A A . 17 PHE CE2 1 1 8 4278 1 1 17 PHE CG C 13.957 8.971 3.676 1.00 . A A . 17 PHE CG 1 1 8 4279 1 1 17 PHE CZ C 12.860 11.518 3.474 1.00 . A A . 17 PHE CZ 1 1 8 4280 1 1 17 PHE H H 14.420 5.504 1.918 1.00 . A A . 17 PHE H 1 1 8 4281 1 1 17 PHE HA H 15.860 8.039 2.075 1.00 . A A . 17 PHE HA 1 1 8 4282 1 1 17 PHE HB2 H 13.752 6.844 3.877 1.00 . A A . 17 PHE HB2 1 1 8 4283 1 1 17 PHE HB3 H 15.146 7.509 4.706 1.00 . A A . 17 PHE HB3 1 1 8 4284 1 1 17 PHE HD1 H 12.831 8.496 1.937 1.00 . A A . 17 PHE HD1 1 1 8 4285 1 1 17 PHE HD2 H 14.976 9.695 5.396 1.00 . A A . 17 PHE HD2 1 1 8 4286 1 1 17 PHE HE1 H 11.841 10.795 1.754 1.00 . A A . 17 PHE HE1 1 1 8 4287 1 1 17 PHE HE2 H 13.987 11.994 5.213 1.00 . A A . 17 PHE HE2 1 1 8 4288 1 1 17 PHE HZ H 12.430 12.517 3.394 1.00 . A A . 17 PHE HZ 1 1 8 4289 1 1 17 PHE N N 14.612 6.453 1.667 1.00 . A A . 17 PHE N 1 1 8 4290 1 1 17 PHE O O 16.581 5.086 2.923 1.00 . A A . 17 PHE O 1 1 8 4291 1 1 18 GLU C C 18.318 5.464 5.539 1.00 . A A . 18 GLU C 1 1 8 4292 1 1 18 GLU CA C 18.711 6.245 4.283 1.00 . A A . 18 GLU CA 1 1 8 4293 1 1 18 GLU CB C 19.860 7.211 4.577 1.00 . A A . 18 GLU CB 1 1 8 4294 1 1 18 GLU CD C 20.490 9.141 6.073 1.00 . A A . 18 GLU CD 1 1 8 4295 1 1 18 GLU CG C 19.355 8.458 5.307 1.00 . A A . 18 GLU CG 1 1 8 4296 1 1 18 GLU H H 17.563 7.940 3.898 1.00 . A A . 18 GLU H 1 1 8 4297 1 1 18 GLU HA H 19.017 5.553 3.499 1.00 . A A . 18 GLU HA 1 1 8 4298 1 1 18 GLU HB2 H 20.615 6.711 5.183 1.00 . A A . 18 GLU HB2 1 1 8 4299 1 1 18 GLU HB3 H 20.342 7.503 3.643 1.00 . A A . 18 GLU HB3 1 1 8 4300 1 1 18 GLU HE2 H 19.533 10.761 5.993 1.00 . A A . 18 GLU HE2 1 1 8 4301 1 1 18 GLU HG2 H 18.924 9.154 4.589 1.00 . A A . 18 GLU HG2 1 1 8 4302 1 1 18 GLU HG3 H 18.560 8.181 5.999 1.00 . A A . 18 GLU HG3 1 1 8 4303 1 1 18 GLU N N 17.559 6.951 3.747 1.00 . A A . 18 GLU N 1 1 8 4304 1 1 18 GLU O O 18.728 5.812 6.645 1.00 . A A . 18 GLU O 1 1 8 4305 1 1 18 GLU OE1 O 21.335 8.458 6.670 1.00 . A A . 18 GLU OE1 1 1 8 4306 1 1 18 GLU OE2 O 20.476 10.430 6.032 1.00 . A A . 18 GLU OE2 1 1 8 4307 1 1 19 ASP C C 16.243 4.437 7.394 1.00 . A A . 19 ASP C 1 1 8 4308 1 1 19 ASP CA C 17.072 3.590 6.427 1.00 . A A . 19 ASP CA 1 1 8 4309 1 1 19 ASP CB C 18.256 3.009 7.203 1.00 . A A . 19 ASP CB 1 1 8 4310 1 1 19 ASP CG C 18.579 1.547 6.889 1.00 . A A . 19 ASP CG 1 1 8 4311 1 1 19 ASP H H 17.196 4.147 4.423 1.00 . A A . 19 ASP H 1 1 8 4312 1 1 19 ASP HA H 16.488 2.796 5.963 1.00 . A A . 19 ASP HA 1 1 8 4313 1 1 19 ASP HB2 H 19.139 3.613 6.993 1.00 . A A . 19 ASP HB2 1 1 8 4314 1 1 19 ASP HB3 H 18.052 3.101 8.269 1.00 . A A . 19 ASP HB3 1 1 8 4315 1 1 19 ASP HD2 H 19.293 1.943 5.192 1.00 . A A . 19 ASP HD2 1 1 8 4316 1 1 19 ASP N N 17.526 4.423 5.326 1.00 . A A . 19 ASP N 1 1 8 4317 1 1 19 ASP O O 16.227 5.663 7.294 1.00 . A A . 19 ASP O 1 1 8 4318 1 1 19 ASP OD1 O 17.995 0.624 7.477 1.00 . A A . 19 ASP OD1 1 1 8 4319 1 1 19 ASP OD2 O 19.485 1.369 5.988 1.00 . A A . 19 ASP OD2 1 1 8 4320 1 1 20 LEU C C 15.381 4.274 10.678 1.00 . A A . 20 LEU C 1 1 8 4321 1 1 20 LEU CA C 14.747 4.426 9.294 1.00 . A A . 20 LEU CA 1 1 8 4322 1 1 20 LEU CB C 13.305 3.917 9.219 1.00 . A A . 20 LEU CB 1 1 8 4323 1 1 20 LEU CD1 C 12.661 5.994 7.943 1.00 . A A . 20 LEU CD1 1 1 8 4324 1 1 20 LEU CD2 C 10.880 4.342 8.672 1.00 . A A . 20 LEU CD2 1 1 8 4325 1 1 20 LEU CG C 12.228 4.984 9.006 1.00 . A A . 20 LEU CG 1 1 8 4326 1 1 20 LEU H H 15.593 2.754 8.384 1.00 . A A . 20 LEU H 1 1 8 4327 1 1 20 LEU HA H 14.729 5.484 9.036 1.00 . A A . 20 LEU HA 1 1 8 4328 1 1 20 LEU HB2 H 13.238 3.193 8.407 1.00 . A A . 20 LEU HB2 1 1 8 4329 1 1 20 LEU HB3 H 13.081 3.383 10.143 1.00 . A A . 20 LEU HB3 1 1 8 4330 1 1 20 LEU HD11 H 11.778 6.432 7.476 1.00 . A A . 20 LEU HD11 1 1 8 4331 1 1 20 LEU HD12 H 13.253 6.782 8.409 1.00 . A A . 20 LEU HD12 1 1 8 4332 1 1 20 LEU HD13 H 13.261 5.491 7.185 1.00 . A A . 20 LEU HD13 1 1 8 4333 1 1 20 LEU HD21 H 10.904 3.957 7.653 1.00 . A A . 20 LEU HD21 1 1 8 4334 1 1 20 LEU HD22 H 10.686 3.523 9.365 1.00 . A A . 20 LEU HD22 1 1 8 4335 1 1 20 LEU HD23 H 10.091 5.088 8.760 1.00 . A A . 20 LEU HD23 1 1 8 4336 1 1 20 LEU HG H 12.101 5.532 9.940 1.00 . A A . 20 LEU HG 1 1 8 4337 1 1 20 LEU N N 15.576 3.751 8.310 1.00 . A A . 20 LEU N 1 1 8 4338 1 1 20 LEU O O 15.919 3.230 11.039 1.00 . A A . 20 LEU O 1 1 8 4339 1 1 21 PRO C C 14.842 4.828 13.776 1.00 . A A . 21 PRO C 1 1 8 4340 1 1 21 PRO CA C 15.837 5.436 12.798 1.00 . A A . 21 PRO CA 1 1 8 4341 1 1 21 PRO CB C 16.018 6.930 13.060 1.00 . A A . 21 PRO CB 1 1 8 4342 1 1 21 PRO CD C 14.681 6.602 11.061 1.00 . A A . 21 PRO CD 1 1 8 4343 1 1 21 PRO CG C 14.788 7.502 12.291 1.00 . A A . 21 PRO CG 1 1 8 4344 1 1 21 PRO HA H 16.792 4.919 12.873 1.00 . A A . 21 PRO HA 1 1 8 4345 1 1 21 PRO HB2 H 15.988 7.170 14.123 1.00 . A A . 21 PRO HB2 1 1 8 4346 1 1 21 PRO HB3 H 16.957 7.261 12.617 1.00 . A A . 21 PRO HB3 1 1 8 4347 1 1 21 PRO HD2 H 13.639 6.455 10.776 1.00 . A A . 21 PRO HD2 1 1 8 4348 1 1 21 PRO HD3 H 15.243 7.037 10.236 1.00 . A A . 21 PRO HD3 1 1 8 4349 1 1 21 PRO HG2 H 13.823 7.532 12.798 1.00 . A A . 21 PRO HG2 1 1 8 4350 1 1 21 PRO HG3 H 15.125 8.508 12.040 1.00 . A A . 21 PRO HG3 1 1 8 4351 1 1 21 PRO N N 15.306 5.358 11.454 1.00 . A A . 21 PRO N 1 1 8 4352 1 1 21 PRO O O 13.745 4.461 13.358 1.00 . A A . 21 PRO O 1 1 8 4353 1 1 22 ASP C C 13.717 5.293 16.856 1.00 . A A . 22 ASP C 1 1 8 4354 1 1 22 ASP CA C 14.361 4.162 16.051 1.00 . A A . 22 ASP CA 1 1 8 4355 1 1 22 ASP CB C 15.147 3.280 17.023 1.00 . A A . 22 ASP CB 1 1 8 4356 1 1 22 ASP CG C 16.526 3.816 17.414 1.00 . A A . 22 ASP CG 1 1 8 4357 1 1 22 ASP H H 16.128 5.031 15.372 1.00 . A A . 22 ASP H 1 1 8 4358 1 1 22 ASP HA H 13.629 3.573 15.500 1.00 . A A . 22 ASP HA 1 1 8 4359 1 1 22 ASP HB2 H 14.555 3.147 17.930 1.00 . A A . 22 ASP HB2 1 1 8 4360 1 1 22 ASP HB3 H 15.270 2.294 16.576 1.00 . A A . 22 ASP HB3 1 1 8 4361 1 1 22 ASP HD2 H 18.227 3.010 17.464 1.00 . A A . 22 ASP HD2 1 1 8 4362 1 1 22 ASP N N 15.234 4.731 15.038 1.00 . A A . 22 ASP N 1 1 8 4363 1 1 22 ASP O O 13.738 5.276 18.085 1.00 . A A . 22 ASP O 1 1 8 4364 1 1 22 ASP OD1 O 16.645 4.717 18.259 1.00 . A A . 22 ASP OD1 1 1 8 4365 1 1 22 ASP OD2 O 17.518 3.263 16.805 1.00 . A A . 22 ASP OD2 1 1 8 4366 1 1 23 ASP C C 12.361 8.516 15.736 1.00 . A A . 23 ASP C 1 1 8 4367 1 1 23 ASP CA C 12.509 7.387 16.758 1.00 . A A . 23 ASP CA 1 1 8 4368 1 1 23 ASP CB C 13.340 7.917 17.929 1.00 . A A . 23 ASP CB 1 1 8 4369 1 1 23 ASP CG C 12.907 7.415 19.308 1.00 . A A . 23 ASP CG 1 1 8 4370 1 1 23 ASP H H 13.145 6.257 15.128 1.00 . A A . 23 ASP H 1 1 8 4371 1 1 23 ASP HA H 11.547 7.010 17.106 1.00 . A A . 23 ASP HA 1 1 8 4372 1 1 23 ASP HB2 H 14.382 7.642 17.769 1.00 . A A . 23 ASP HB2 1 1 8 4373 1 1 23 ASP HB3 H 13.294 9.006 17.924 1.00 . A A . 23 ASP HB3 1 1 8 4374 1 1 23 ASP HD2 H 12.795 8.699 20.681 1.00 . A A . 23 ASP HD2 1 1 8 4375 1 1 23 ASP N N 13.159 6.250 16.128 1.00 . A A . 23 ASP N 1 1 8 4376 1 1 23 ASP O O 13.090 9.504 15.786 1.00 . A A . 23 ASP O 1 1 8 4377 1 1 23 ASP OD1 O 12.101 6.480 19.423 1.00 . A A . 23 ASP OD1 1 1 8 4378 1 1 23 ASP OD2 O 13.441 8.034 20.305 1.00 . A A . 23 ASP OD2 1 1 8 4379 1 1 24 TRP C C 9.887 10.083 14.176 1.00 . A A . 24 TRP C 1 1 8 4380 1 1 24 TRP CA C 11.157 9.319 13.797 1.00 . A A . 24 TRP CA 1 1 8 4381 1 1 24 TRP CB C 11.070 8.662 12.418 1.00 . A A . 24 TRP CB 1 1 8 4382 1 1 24 TRP CD1 C 12.422 10.373 11.038 1.00 . A A . 24 TRP CD1 1 1 8 4383 1 1 24 TRP CD2 C 10.449 9.897 10.150 1.00 . A A . 24 TRP CD2 1 1 8 4384 1 1 24 TRP CE2 C 11.063 10.814 9.322 1.00 . A A . 24 TRP CE2 1 1 8 4385 1 1 24 TRP CE3 C 9.170 9.389 9.860 1.00 . A A . 24 TRP CE3 1 1 8 4386 1 1 24 TRP CG C 11.336 9.619 11.255 1.00 . A A . 24 TRP CG 1 1 8 4387 1 1 24 TRP CH2 C 9.200 10.813 7.842 1.00 . A A . 24 TRP CH2 1 1 8 4388 1 1 24 TRP CZ2 C 10.474 11.304 8.151 1.00 . A A . 24 TRP CZ2 1 1 8 4389 1 1 24 TRP CZ3 C 8.595 9.889 8.686 1.00 . A A . 24 TRP CZ3 1 1 8 4390 1 1 24 TRP H H 10.823 7.522 14.796 1.00 . A A . 24 TRP H 1 1 8 4391 1 1 24 TRP HA H 12.008 9.998 13.772 1.00 . A A . 24 TRP HA 1 1 8 4392 1 1 24 TRP HB2 H 11.788 7.842 12.371 1.00 . A A . 24 TRP HB2 1 1 8 4393 1 1 24 TRP HB3 H 10.079 8.224 12.297 1.00 . A A . 24 TRP HB3 1 1 8 4394 1 1 24 TRP HD1 H 13.292 10.399 11.694 1.00 . A A . 24 TRP HD1 1 1 8 4395 1 1 24 TRP HE1 H 13.040 11.804 9.475 1.00 . A A . 24 TRP HE1 1 1 8 4396 1 1 24 TRP HE3 H 8.664 8.664 10.498 1.00 . A A . 24 TRP HE3 1 1 8 4397 1 1 24 TRP HH2 H 8.685 11.153 6.943 1.00 . A A . 24 TRP HH2 1 1 8 4398 1 1 24 TRP HZ2 H 10.981 12.029 7.513 1.00 . A A . 24 TRP HZ2 1 1 8 4399 1 1 24 TRP HZ3 H 7.603 9.527 8.414 1.00 . A A . 24 TRP HZ3 1 1 8 4400 1 1 24 TRP N N 11.411 8.329 14.830 1.00 . A A . 24 TRP N 1 1 8 4401 1 1 24 TRP NE1 N 12.301 11.113 9.879 1.00 . A A . 24 TRP NE1 1 1 8 4402 1 1 24 TRP O O 8.881 9.478 14.542 1.00 . A A . 24 TRP O 1 1 8 4403 1 1 25 ALA C C 8.533 13.157 13.210 1.00 . A A . 25 ALA C 1 1 8 4404 1 1 25 ALA CA C 8.847 12.255 14.404 1.00 . A A . 25 ALA CA 1 1 8 4405 1 1 25 ALA CB C 9.161 13.052 15.672 1.00 . A A . 25 ALA CB 1 1 8 4406 1 1 25 ALA H H 10.800 11.885 13.779 1.00 . A A . 25 ALA H 1 1 8 4407 1 1 25 ALA HA H 7.990 11.610 14.599 1.00 . A A . 25 ALA HA 1 1 8 4408 1 1 25 ALA HB1 H 8.302 13.670 15.935 1.00 . A A . 25 ALA HB1 1 1 8 4409 1 1 25 ALA HB2 H 9.377 12.364 16.490 1.00 . A A . 25 ALA HB2 1 1 8 4410 1 1 25 ALA HB3 H 10.027 13.690 15.495 1.00 . A A . 25 ALA HB3 1 1 8 4411 1 1 25 ALA N N 9.976 11.401 14.076 1.00 . A A . 25 ALA N 1 1 8 4412 1 1 25 ALA O O 9.441 13.665 12.554 1.00 . A A . 25 ALA O 1 1 8 4413 1 1 26 CYS C C 7.463 15.534 11.992 1.00 . A A . 26 CYS C 1 1 8 4414 1 1 26 CYS CA C 6.796 14.164 11.861 1.00 . A A . 26 CYS CA 1 1 8 4415 1 1 26 CYS CB C 5.270 14.273 11.815 1.00 . A A . 26 CYS CB 1 1 8 4416 1 1 26 CYS H H 6.509 12.914 13.502 1.00 . A A . 26 CYS H 1 1 8 4417 1 1 26 CYS HA H 7.113 13.665 10.944 1.00 . A A . 26 CYS HA 1 1 8 4418 1 1 26 CYS HB2 H 4.842 13.350 12.204 1.00 . A A . 26 CYS HB2 1 1 8 4419 1 1 26 CYS HB3 H 4.958 15.075 12.484 1.00 . A A . 26 CYS HB3 1 1 8 4420 1 1 26 CYS N N 7.242 13.330 12.964 1.00 . A A . 26 CYS N 1 1 8 4421 1 1 26 CYS O O 7.489 16.147 13.058 1.00 . A A . 26 CYS O 1 1 8 4422 1 1 26 CYS SG S 4.572 14.590 10.153 1.00 . A A . 26 CYS SG 1 1 8 4423 1 1 27 PRO C C 7.670 18.408 10.835 1.00 . A A . 27 PRO C 1 1 8 4424 1 1 27 PRO CA C 8.688 17.280 10.766 1.00 . A A . 27 PRO CA 1 1 8 4425 1 1 27 PRO CB C 9.377 17.246 9.403 1.00 . A A . 27 PRO CB 1 1 8 4426 1 1 27 PRO CD C 7.997 15.312 9.601 1.00 . A A . 27 PRO CD 1 1 8 4427 1 1 27 PRO CG C 8.389 16.368 8.569 1.00 . A A . 27 PRO CG 1 1 8 4428 1 1 27 PRO HA H 9.425 17.397 11.561 1.00 . A A . 27 PRO HA 1 1 8 4429 1 1 27 PRO HB2 H 9.489 18.240 8.971 1.00 . A A . 27 PRO HB2 1 1 8 4430 1 1 27 PRO HB3 H 10.346 16.758 9.504 1.00 . A A . 27 PRO HB3 1 1 8 4431 1 1 27 PRO HD2 H 7.012 14.900 9.379 1.00 . A A . 27 PRO HD2 1 1 8 4432 1 1 27 PRO HD3 H 8.744 14.519 9.620 1.00 . A A . 27 PRO HD3 1 1 8 4433 1 1 27 PRO HG2 H 7.487 16.790 8.127 1.00 . A A . 27 PRO HG2 1 1 8 4434 1 1 27 PRO HG3 H 9.047 15.969 7.798 1.00 . A A . 27 PRO HG3 1 1 8 4435 1 1 27 PRO N N 8.009 16.006 10.869 1.00 . A A . 27 PRO N 1 1 8 4436 1 1 27 PRO O O 8.070 19.572 10.799 1.00 . A A . 27 PRO O 1 1 8 4437 1 1 28 VAL C C 4.759 19.074 12.413 1.00 . A A . 28 VAL C 1 1 8 4438 1 1 28 VAL CA C 5.346 19.056 11.000 1.00 . A A . 28 VAL CA 1 1 8 4439 1 1 28 VAL CB C 4.295 18.788 9.921 1.00 . A A . 28 VAL CB 1 1 8 4440 1 1 28 VAL CG1 C 3.179 19.833 9.970 1.00 . A A . 28 VAL CG1 1 1 8 4441 1 1 28 VAL CG2 C 4.937 18.735 8.533 1.00 . A A . 28 VAL CG2 1 1 8 4442 1 1 28 VAL H H 6.081 17.107 10.958 1.00 . A A . 28 VAL H 1 1 8 4443 1 1 28 VAL HA H 5.800 20.026 10.795 1.00 . A A . 28 VAL HA 1 1 8 4444 1 1 28 VAL HB H 3.850 17.813 10.121 1.00 . A A . 28 VAL HB 1 1 8 4445 1 1 28 VAL HG11 H 3.463 20.637 10.650 1.00 . A A . 28 VAL HG11 1 1 8 4446 1 1 28 VAL HG12 H 3.020 20.243 8.972 1.00 . A A . 28 VAL HG12 1 1 8 4447 1 1 28 VAL HG13 H 2.260 19.367 10.323 1.00 . A A . 28 VAL HG13 1 1 8 4448 1 1 28 VAL HG21 H 4.494 17.921 7.958 1.00 . A A . 28 VAL HG21 1 1 8 4449 1 1 28 VAL HG22 H 4.764 19.680 8.016 1.00 . A A . 28 VAL HG22 1 1 8 4450 1 1 28 VAL HG23 H 6.008 18.567 8.633 1.00 . A A . 28 VAL HG23 1 1 8 4451 1 1 28 VAL N N 6.397 18.055 10.930 1.00 . A A . 28 VAL N 1 1 8 4452 1 1 28 VAL O O 5.249 19.794 13.283 1.00 . A A . 28 VAL O 1 1 8 4453 1 1 29 CYS C C 4.130 17.958 14.960 1.00 . A A . 29 CYS C 1 1 8 4454 1 1 29 CYS CA C 3.061 18.191 13.892 1.00 . A A . 29 CYS CA 1 1 8 4455 1 1 29 CYS CB C 1.988 17.100 13.910 1.00 . A A . 29 CYS CB 1 1 8 4456 1 1 29 CYS H H 3.327 17.692 11.886 1.00 . A A . 29 CYS H 1 1 8 4457 1 1 29 CYS HA H 2.558 19.144 14.049 1.00 . A A . 29 CYS HA 1 1 8 4458 1 1 29 CYS HB2 H 1.577 17.031 14.917 1.00 . A A . 29 CYS HB2 1 1 8 4459 1 1 29 CYS HB3 H 1.172 17.400 13.252 1.00 . A A . 29 CYS HB3 1 1 8 4460 1 1 29 CYS N N 3.719 18.274 12.599 1.00 . A A . 29 CYS N 1 1 8 4461 1 1 29 CYS O O 4.169 18.662 15.968 1.00 . A A . 29 CYS O 1 1 8 4462 1 1 29 CYS SG S 2.571 15.441 13.401 1.00 . A A . 29 CYS SG 1 1 8 4463 1 1 30 GLY C C 5.747 15.311 16.349 1.00 . A A . 30 GLY C 1 1 8 4464 1 1 30 GLY CA C 6.038 16.631 15.633 1.00 . A A . 30 GLY CA 1 1 8 4465 1 1 30 GLY H H 4.932 16.398 13.883 1.00 . A A . 30 GLY H 1 1 8 4466 1 1 30 GLY HA2 H 6.983 16.557 15.095 1.00 . A A . 30 GLY HA2 1 1 8 4467 1 1 30 GLY HA3 H 6.150 17.430 16.366 1.00 . A A . 30 GLY HA3 1 1 8 4468 1 1 30 GLY N N 4.971 16.966 14.705 1.00 . A A . 30 GLY N 1 1 8 4469 1 1 30 GLY O O 6.622 14.754 17.012 1.00 . A A . 30 GLY O 1 1 8 4470 1 1 31 ALA C C 5.034 12.475 16.367 1.00 . A A . 31 ALA C 1 1 8 4471 1 1 31 ALA CA C 4.100 13.602 16.814 1.00 . A A . 31 ALA CA 1 1 8 4472 1 1 31 ALA CB C 2.637 13.321 16.465 1.00 . A A . 31 ALA CB 1 1 8 4473 1 1 31 ALA H H 3.811 15.306 15.650 1.00 . A A . 31 ALA H 1 1 8 4474 1 1 31 ALA HA H 4.185 13.726 17.893 1.00 . A A . 31 ALA HA 1 1 8 4475 1 1 31 ALA HB1 H 2.548 13.142 15.393 1.00 . A A . 31 ALA HB1 1 1 8 4476 1 1 31 ALA HB2 H 2.296 12.440 17.010 1.00 . A A . 31 ALA HB2 1 1 8 4477 1 1 31 ALA HB3 H 2.026 14.179 16.742 1.00 . A A . 31 ALA HB3 1 1 8 4478 1 1 31 ALA N N 4.516 14.846 16.191 1.00 . A A . 31 ALA N 1 1 8 4479 1 1 31 ALA O O 5.761 12.620 15.386 1.00 . A A . 31 ALA O 1 1 8 4480 1 1 32 SER C C 5.280 9.513 15.556 1.00 . A A . 32 SER C 1 1 8 4481 1 1 32 SER CA C 5.814 10.228 16.799 1.00 . A A . 32 SER CA 1 1 8 4482 1 1 32 SER CB C 5.876 9.259 17.982 1.00 . A A . 32 SER CB 1 1 8 4483 1 1 32 SER H H 4.388 11.268 17.904 1.00 . A A . 32 SER H 1 1 8 4484 1 1 32 SER HA H 6.808 10.632 16.609 1.00 . A A . 32 SER HA 1 1 8 4485 1 1 32 SER HB2 H 6.567 8.449 17.752 1.00 . A A . 32 SER HB2 1 1 8 4486 1 1 32 SER HB3 H 6.273 9.779 18.855 1.00 . A A . 32 SER HB3 1 1 8 4487 1 1 32 SER HG H 3.884 9.397 18.119 1.00 . A A . 32 SER HG 1 1 8 4488 1 1 32 SER N N 4.982 11.378 17.108 1.00 . A A . 32 SER N 1 1 8 4489 1 1 32 SER O O 4.204 9.844 15.061 1.00 . A A . 32 SER O 1 1 8 4490 1 1 32 SER OG O 4.596 8.718 18.297 1.00 . A A . 32 SER OG 1 1 8 4491 1 1 33 LYS C C 4.765 6.626 14.336 1.00 . A A . 33 LYS C 1 1 8 4492 1 1 33 LYS CA C 5.674 7.783 13.913 1.00 . A A . 33 LYS CA 1 1 8 4493 1 1 33 LYS CB C 6.915 7.339 13.137 1.00 . A A . 33 LYS CB 1 1 8 4494 1 1 33 LYS CD C 7.734 4.969 13.413 1.00 . A A . 33 LYS CD 1 1 8 4495 1 1 33 LYS CE C 9.053 4.239 13.668 1.00 . A A . 33 LYS CE 1 1 8 4496 1 1 33 LYS CG C 7.777 6.392 13.975 1.00 . A A . 33 LYS CG 1 1 8 4497 1 1 33 LYS H H 6.931 8.284 15.498 1.00 . A A . 33 LYS H 1 1 8 4498 1 1 33 LYS HA H 5.107 8.447 13.262 1.00 . A A . 33 LYS HA 1 1 8 4499 1 1 33 LYS HB2 H 6.613 6.841 12.214 1.00 . A A . 33 LYS HB2 1 1 8 4500 1 1 33 LYS HB3 H 7.501 8.211 12.850 1.00 . A A . 33 LYS HB3 1 1 8 4501 1 1 33 LYS HD2 H 6.914 4.417 13.875 1.00 . A A . 33 LYS HD2 1 1 8 4502 1 1 33 LYS HD3 H 7.533 5.002 12.343 1.00 . A A . 33 LYS HD3 1 1 8 4503 1 1 33 LYS HE2 H 9.459 4.535 14.636 1.00 . A A . 33 LYS HE2 1 1 8 4504 1 1 33 LYS HE3 H 8.879 3.164 13.710 1.00 . A A . 33 LYS HE3 1 1 8 4505 1 1 33 LYS HG2 H 8.806 6.750 13.990 1.00 . A A . 33 LYS HG2 1 1 8 4506 1 1 33 LYS HG3 H 7.424 6.391 15.006 1.00 . A A . 33 LYS HG3 1 1 8 4507 1 1 33 LYS HZ1 H 10.758 5.177 12.919 1.00 . A A . 33 LYS HZ1 1 1 8 4508 1 1 33 LYS HZ2 H 10.494 3.713 12.257 1.00 . A A . 33 LYS HZ2 1 1 8 4509 1 1 33 LYS N N 6.056 8.547 15.089 1.00 . A A . 33 LYS N 1 1 8 4510 1 1 33 LYS NZ N 10.031 4.547 12.600 1.00 . A A . 33 LYS NZ 1 1 8 4511 1 1 33 LYS O O 4.979 5.485 13.929 1.00 . A A . 33 LYS O 1 1 8 4512 1 1 34 ASP C C 1.495 6.139 14.902 1.00 . A A . 34 ASP C 1 1 8 4513 1 1 34 ASP CA C 2.831 5.964 15.627 1.00 . A A . 34 ASP CA 1 1 8 4514 1 1 34 ASP CB C 2.579 6.124 17.127 1.00 . A A . 34 ASP CB 1 1 8 4515 1 1 34 ASP CG C 1.572 7.213 17.502 1.00 . A A . 34 ASP CG 1 1 8 4516 1 1 34 ASP H H 3.605 7.892 15.471 1.00 . A A . 34 ASP H 1 1 8 4517 1 1 34 ASP HA H 3.299 5.003 15.415 1.00 . A A . 34 ASP HA 1 1 8 4518 1 1 34 ASP HB2 H 2.226 5.172 17.525 1.00 . A A . 34 ASP HB2 1 1 8 4519 1 1 34 ASP HB3 H 3.527 6.343 17.618 1.00 . A A . 34 ASP HB3 1 1 8 4520 1 1 34 ASP HD2 H 2.331 8.834 16.916 1.00 . A A . 34 ASP HD2 1 1 8 4521 1 1 34 ASP N N 3.772 6.961 15.145 1.00 . A A . 34 ASP N 1 1 8 4522 1 1 34 ASP O O 0.917 5.167 14.417 1.00 . A A . 34 ASP O 1 1 8 4523 1 1 34 ASP OD1 O 0.356 6.973 17.540 1.00 . A A . 34 ASP OD1 1 1 8 4524 1 1 34 ASP OD2 O 2.088 8.366 17.765 1.00 . A A . 34 ASP OD2 1 1 8 4525 1 1 35 ALA C C -0.076 7.442 12.692 1.00 . A A . 35 ALA C 1 1 8 4526 1 1 35 ALA CA C -0.213 7.698 14.194 1.00 . A A . 35 ALA CA 1 1 8 4527 1 1 35 ALA CB C -0.605 9.143 14.506 1.00 . A A . 35 ALA CB 1 1 8 4528 1 1 35 ALA H H 1.519 8.168 15.249 1.00 . A A . 35 ALA H 1 1 8 4529 1 1 35 ALA HA H -0.976 7.032 14.600 1.00 . A A . 35 ALA HA 1 1 8 4530 1 1 35 ALA HB1 H 0.069 9.548 15.261 1.00 . A A . 35 ALA HB1 1 1 8 4531 1 1 35 ALA HB2 H -0.536 9.742 13.599 1.00 . A A . 35 ALA HB2 1 1 8 4532 1 1 35 ALA HB3 H -1.628 9.169 14.881 1.00 . A A . 35 ALA HB3 1 1 8 4533 1 1 35 ALA N N 1.044 7.383 14.852 1.00 . A A . 35 ALA N 1 1 8 4534 1 1 35 ALA O O -1.076 7.345 11.981 1.00 . A A . 35 ALA O 1 1 8 4535 1 1 36 PHE C C 0.919 5.731 10.411 1.00 . A A . 36 PHE C 1 1 8 4536 1 1 36 PHE CA C 1.450 7.097 10.848 1.00 . A A . 36 PHE CA 1 1 8 4537 1 1 36 PHE CB C 2.972 7.117 10.686 1.00 . A A . 36 PHE CB 1 1 8 4538 1 1 36 PHE CD1 C 3.668 9.359 11.558 1.00 . A A . 36 PHE CD1 1 1 8 4539 1 1 36 PHE CD2 C 3.975 8.917 9.264 1.00 . A A . 36 PHE CD2 1 1 8 4540 1 1 36 PHE CE1 C 4.214 10.658 11.382 1.00 . A A . 36 PHE CE1 1 1 8 4541 1 1 36 PHE CE2 C 4.521 10.217 9.088 1.00 . A A . 36 PHE CE2 1 1 8 4542 1 1 36 PHE CG C 3.561 8.516 10.496 1.00 . A A . 36 PHE CG 1 1 8 4543 1 1 36 PHE CZ C 4.629 11.059 10.150 1.00 . A A . 36 PHE CZ 1 1 8 4544 1 1 36 PHE H H 1.977 7.421 12.837 1.00 . A A . 36 PHE H 1 1 8 4545 1 1 36 PHE HA H 0.949 7.880 10.278 1.00 . A A . 36 PHE HA 1 1 8 4546 1 1 36 PHE HB2 H 3.425 6.659 11.565 1.00 . A A . 36 PHE HB2 1 1 8 4547 1 1 36 PHE HB3 H 3.243 6.500 9.829 1.00 . A A . 36 PHE HB3 1 1 8 4548 1 1 36 PHE HD1 H 3.335 9.037 12.544 1.00 . A A . 36 PHE HD1 1 1 8 4549 1 1 36 PHE HD2 H 3.889 8.242 8.413 1.00 . A A . 36 PHE HD2 1 1 8 4550 1 1 36 PHE HE1 H 4.300 11.333 12.232 1.00 . A A . 36 PHE HE1 1 1 8 4551 1 1 36 PHE HE2 H 4.854 10.538 8.101 1.00 . A A . 36 PHE HE2 1 1 8 4552 1 1 36 PHE HZ H 5.048 12.056 10.014 1.00 . A A . 36 PHE HZ 1 1 8 4553 1 1 36 PHE N N 1.169 7.340 12.253 1.00 . A A . 36 PHE N 1 1 8 4554 1 1 36 PHE O O 1.140 4.729 11.089 1.00 . A A . 36 PHE O 1 1 8 4555 1 1 37 GLU C C 0.415 4.087 7.477 1.00 . A A . 37 GLU C 1 1 8 4556 1 1 37 GLU CA C -0.334 4.507 8.743 1.00 . A A . 37 GLU CA 1 1 8 4557 1 1 37 GLU CB C -1.831 4.666 8.468 1.00 . A A . 37 GLU CB 1 1 8 4558 1 1 37 GLU CD C -2.894 2.563 7.567 1.00 . A A . 37 GLU CD 1 1 8 4559 1 1 37 GLU CG C -2.592 3.386 8.822 1.00 . A A . 37 GLU CG 1 1 8 4560 1 1 37 GLU H H 0.055 6.553 8.734 1.00 . A A . 37 GLU H 1 1 8 4561 1 1 37 GLU HA H -0.192 3.758 9.523 1.00 . A A . 37 GLU HA 1 1 8 4562 1 1 37 GLU HB2 H -2.224 5.500 9.049 1.00 . A A . 37 GLU HB2 1 1 8 4563 1 1 37 GLU HB3 H -1.987 4.908 7.417 1.00 . A A . 37 GLU HB3 1 1 8 4564 1 1 37 GLU HE2 H -1.672 1.215 8.051 1.00 . A A . 37 GLU HE2 1 1 8 4565 1 1 37 GLU HG2 H -2.004 2.790 9.519 1.00 . A A . 37 GLU HG2 1 1 8 4566 1 1 37 GLU HG3 H -3.523 3.642 9.327 1.00 . A A . 37 GLU HG3 1 1 8 4567 1 1 37 GLU N N 0.230 5.734 9.279 1.00 . A A . 37 GLU N 1 1 8 4568 1 1 37 GLU O O 0.919 4.934 6.740 1.00 . A A . 37 GLU O 1 1 8 4569 1 1 37 GLU OE1 O -3.402 3.109 6.576 1.00 . A A . 37 GLU OE1 1 1 8 4570 1 1 37 GLU OE2 O -2.581 1.314 7.646 1.00 . A A . 37 GLU OE2 1 1 8 4571 1 1 38 LYS C C 0.135 2.060 4.962 1.00 . A A . 38 LYS C 1 1 8 4572 1 1 38 LYS CA C 1.145 2.239 6.098 1.00 . A A . 38 LYS CA 1 1 8 4573 1 1 38 LYS CB C 1.893 0.955 6.464 1.00 . A A . 38 LYS CB 1 1 8 4574 1 1 38 LYS CD C 3.618 -0.728 5.722 1.00 . A A . 38 LYS CD 1 1 8 4575 1 1 38 LYS CE C 2.930 -1.941 5.093 1.00 . A A . 38 LYS CE 1 1 8 4576 1 1 38 LYS CG C 2.883 0.566 5.364 1.00 . A A . 38 LYS CG 1 1 8 4577 1 1 38 LYS H H 0.053 2.099 7.867 1.00 . A A . 38 LYS H 1 1 8 4578 1 1 38 LYS HA H 1.891 2.969 5.786 1.00 . A A . 38 LYS HA 1 1 8 4579 1 1 38 LYS HB2 H 2.425 1.095 7.405 1.00 . A A . 38 LYS HB2 1 1 8 4580 1 1 38 LYS HB3 H 1.179 0.146 6.619 1.00 . A A . 38 LYS HB3 1 1 8 4581 1 1 38 LYS HD2 H 4.650 -0.671 5.376 1.00 . A A . 38 LYS HD2 1 1 8 4582 1 1 38 LYS HD3 H 3.651 -0.844 6.804 1.00 . A A . 38 LYS HD3 1 1 8 4583 1 1 38 LYS HE2 H 2.755 -1.760 4.033 1.00 . A A . 38 LYS HE2 1 1 8 4584 1 1 38 LYS HE3 H 3.581 -2.812 5.164 1.00 . A A . 38 LYS HE3 1 1 8 4585 1 1 38 LYS HG2 H 2.352 0.437 4.421 1.00 . A A . 38 LYS HG2 1 1 8 4586 1 1 38 LYS HG3 H 3.603 1.369 5.218 1.00 . A A . 38 LYS HG3 1 1 8 4587 1 1 38 LYS HZ1 H 0.849 -1.956 5.204 1.00 . A A . 38 LYS HZ1 1 1 8 4588 1 1 38 LYS HZ2 H 1.537 -3.202 5.994 1.00 . A A . 38 LYS HZ2 1 1 8 4589 1 1 38 LYS N N 0.465 2.781 7.262 1.00 . A A . 38 LYS N 1 1 8 4590 1 1 38 LYS NZ N 1.646 -2.218 5.774 1.00 . A A . 38 LYS NZ 1 1 8 4591 1 1 38 LYS O O -0.435 0.983 4.797 1.00 . A A . 38 LYS O 1 1 8 4592 1 1 39 GLN C C -0.579 4.143 2.041 1.00 . A A . 39 GLN C 1 1 8 4593 1 1 39 GLN CA C -0.984 3.108 3.092 1.00 . A A . 39 GLN CA 1 1 8 4594 1 1 39 GLN CB C -2.419 3.342 3.568 1.00 . A A . 39 GLN CB 1 1 8 4595 1 1 39 GLN CD C -3.946 5.324 3.884 1.00 . A A . 39 GLN CD 1 1 8 4596 1 1 39 GLN CG C -2.569 4.732 4.191 1.00 . A A . 39 GLN CG 1 1 8 4597 1 1 39 GLN H H 0.415 4.005 4.348 1.00 . A A . 39 GLN H 1 1 8 4598 1 1 39 GLN HA H -0.907 2.105 2.672 1.00 . A A . 39 GLN HA 1 1 8 4599 1 1 39 GLN HB2 H -3.106 3.241 2.729 1.00 . A A . 39 GLN HB2 1 1 8 4600 1 1 39 GLN HB3 H -2.692 2.581 4.298 1.00 . A A . 39 GLN HB3 1 1 8 4601 1 1 39 GLN HE21 H -3.085 6.457 2.443 1.00 . A A . 39 GLN HE21 1 1 8 4602 1 1 39 GLN HE22 H -4.794 6.669 2.631 1.00 . A A . 39 GLN HE22 1 1 8 4603 1 1 39 GLN HG2 H -2.429 4.667 5.271 1.00 . A A . 39 GLN HG2 1 1 8 4604 1 1 39 GLN HG3 H -1.791 5.392 3.809 1.00 . A A . 39 GLN HG3 1 1 8 4605 1 1 39 GLN N N -0.053 3.132 4.207 1.00 . A A . 39 GLN N 1 1 8 4606 1 1 39 GLN NE2 N -3.941 6.224 2.905 1.00 . A A . 39 GLN NE2 1 1 8 4607 1 1 39 GLN O O -0.866 3.976 0.856 1.00 . A A . 39 GLN O 1 1 8 4608 1 1 39 GLN OE1 O -4.947 4.986 4.496 1.00 . A A . 39 GLN OE1 1 1 9 4609 1 1 1 MET C C 3.528 1.884 -1.814 1.00 . A A . 1 MET C 1 1 9 4610 1 1 1 MET CA C 2.422 1.497 -2.799 1.00 . A A . 1 MET CA 1 1 9 4611 1 1 1 MET CB C 1.186 2.363 -2.544 1.00 . A A . 1 MET CB 1 1 9 4612 1 1 1 MET CE C -0.282 5.348 -4.947 1.00 . A A . 1 MET CE 1 1 9 4613 1 1 1 MET CG C 0.741 3.074 -3.822 1.00 . A A . 1 MET CG 1 1 9 4614 1 1 1 MET H1 H 2.356 -0.331 -1.803 1.00 . A A . 1 MET H1 1 1 9 4615 1 1 1 MET HA H 2.781 1.610 -3.822 1.00 . A A . 1 MET HA 1 1 9 4616 1 1 1 MET HB2 H 0.374 1.740 -2.169 1.00 . A A . 1 MET HB2 1 1 9 4617 1 1 1 MET HB3 H 1.406 3.100 -1.771 1.00 . A A . 1 MET HB3 1 1 9 4618 1 1 1 MET HE1 H -1.149 5.106 -5.559 1.00 . A A . 1 MET HE1 1 1 9 4619 1 1 1 MET HE2 H -0.279 6.415 -4.725 1.00 . A A . 1 MET HE2 1 1 9 4620 1 1 1 MET HE3 H 0.629 5.087 -5.486 1.00 . A A . 1 MET HE3 1 1 9 4621 1 1 1 MET HG2 H 1.611 3.449 -4.362 1.00 . A A . 1 MET HG2 1 1 9 4622 1 1 1 MET HG3 H 0.236 2.370 -4.484 1.00 . A A . 1 MET HG3 1 1 9 4623 1 1 1 MET N N 2.070 0.095 -2.661 1.00 . A A . 1 MET N 1 1 9 4624 1 1 1 MET O O 4.477 2.575 -2.181 1.00 . A A . 1 MET O 1 1 9 4625 1 1 1 MET SD S -0.354 4.425 -3.420 1.00 . A A . 1 MET SD 1 1 9 4626 1 1 2 ASP C C 4.478 3.226 0.615 1.00 . A A . 2 ASP C 1 1 9 4627 1 1 2 ASP CA C 4.341 1.710 0.457 1.00 . A A . 2 ASP CA 1 1 9 4628 1 1 2 ASP CB C 5.716 1.145 0.097 1.00 . A A . 2 ASP CB 1 1 9 4629 1 1 2 ASP CG C 5.696 -0.236 -0.560 1.00 . A A . 2 ASP CG 1 1 9 4630 1 1 2 ASP H H 2.593 0.859 -0.293 1.00 . A A . 2 ASP H 1 1 9 4631 1 1 2 ASP HA H 3.950 1.230 1.355 1.00 . A A . 2 ASP HA 1 1 9 4632 1 1 2 ASP HB2 H 6.214 1.844 -0.576 1.00 . A A . 2 ASP HB2 1 1 9 4633 1 1 2 ASP HB3 H 6.319 1.090 1.004 1.00 . A A . 2 ASP HB3 1 1 9 4634 1 1 2 ASP HD2 H 5.794 -2.074 -0.164 1.00 . A A . 2 ASP HD2 1 1 9 4635 1 1 2 ASP N N 3.368 1.421 -0.583 1.00 . A A . 2 ASP N 1 1 9 4636 1 1 2 ASP O O 5.411 3.826 0.084 1.00 . A A . 2 ASP O 1 1 9 4637 1 1 2 ASP OD1 O 5.286 -0.385 -1.722 1.00 . A A . 2 ASP OD1 1 1 9 4638 1 1 2 ASP OD2 O 6.132 -1.199 0.180 1.00 . A A . 2 ASP OD2 1 1 9 4639 1 1 3 ILE C C 3.212 5.508 3.050 1.00 . A A . 3 ILE C 1 1 9 4640 1 1 3 ILE CA C 3.539 5.234 1.580 1.00 . A A . 3 ILE CA 1 1 9 4641 1 1 3 ILE CB C 2.601 5.940 0.599 1.00 . A A . 3 ILE CB 1 1 9 4642 1 1 3 ILE CD1 C 1.942 5.738 -1.827 1.00 . A A . 3 ILE CD1 1 1 9 4643 1 1 3 ILE CG1 C 3.107 5.805 -0.838 1.00 . A A . 3 ILE CG1 1 1 9 4644 1 1 3 ILE CG2 C 2.389 7.402 0.998 1.00 . A A . 3 ILE CG2 1 1 9 4645 1 1 3 ILE H H 2.779 3.305 1.775 1.00 . A A . 3 ILE H 1 1 9 4646 1 1 3 ILE HA H 4.547 5.595 1.377 1.00 . A A . 3 ILE HA 1 1 9 4647 1 1 3 ILE HB H 1.628 5.450 0.644 1.00 . A A . 3 ILE HB 1 1 9 4648 1 1 3 ILE HD11 H 2.057 4.863 -2.466 1.00 . A A . 3 ILE HD11 1 1 9 4649 1 1 3 ILE HD12 H 1.003 5.667 -1.277 1.00 . A A . 3 ILE HD12 1 1 9 4650 1 1 3 ILE HD13 H 1.935 6.639 -2.442 1.00 . A A . 3 ILE HD13 1 1 9 4651 1 1 3 ILE HG12 H 3.748 6.653 -1.083 1.00 . A A . 3 ILE HG12 1 1 9 4652 1 1 3 ILE HG13 H 3.718 4.907 -0.929 1.00 . A A . 3 ILE HG13 1 1 9 4653 1 1 3 ILE HG21 H 2.943 7.612 1.913 1.00 . A A . 3 ILE HG21 1 1 9 4654 1 1 3 ILE HG22 H 2.746 8.052 0.199 1.00 . A A . 3 ILE HG22 1 1 9 4655 1 1 3 ILE HG23 H 1.327 7.582 1.166 1.00 . A A . 3 ILE HG23 1 1 9 4656 1 1 3 ILE N N 3.535 3.800 1.346 1.00 . A A . 3 ILE N 1 1 9 4657 1 1 3 ILE O O 2.330 4.894 3.647 1.00 . A A . 3 ILE O 1 1 9 4658 1 1 4 TYR C C 3.096 8.197 5.092 1.00 . A A . 4 TYR C 1 1 9 4659 1 1 4 TYR CA C 3.767 6.834 5.012 1.00 . A A . 4 TYR CA 1 1 9 4660 1 1 4 TYR CB C 5.120 6.854 5.717 1.00 . A A . 4 TYR CB 1 1 9 4661 1 1 4 TYR CD1 C 5.269 4.793 7.160 1.00 . A A . 4 TYR CD1 1 1 9 4662 1 1 4 TYR CD2 C 6.580 4.887 5.123 1.00 . A A . 4 TYR CD2 1 1 9 4663 1 1 4 TYR CE1 C 5.778 3.517 7.430 1.00 . A A . 4 TYR CE1 1 1 9 4664 1 1 4 TYR CE2 C 7.089 3.611 5.392 1.00 . A A . 4 TYR CE2 1 1 9 4665 1 1 4 TYR CG C 5.670 5.478 6.007 1.00 . A A . 4 TYR CG 1 1 9 4666 1 1 4 TYR CZ C 6.688 2.925 6.545 1.00 . A A . 4 TYR CZ 1 1 9 4667 1 1 4 TYR H H 4.664 6.933 3.089 1.00 . A A . 4 TYR H 1 1 9 4668 1 1 4 TYR HA H 3.128 6.096 5.496 1.00 . A A . 4 TYR HA 1 1 9 4669 1 1 4 TYR HB2 H 5.833 7.387 5.087 1.00 . A A . 4 TYR HB2 1 1 9 4670 1 1 4 TYR HB3 H 5.015 7.392 6.659 1.00 . A A . 4 TYR HB3 1 1 9 4671 1 1 4 TYR HD1 H 4.568 5.249 7.843 1.00 . A A . 4 TYR HD1 1 1 9 4672 1 1 4 TYR HD2 H 6.889 5.415 4.233 1.00 . A A . 4 TYR HD2 1 1 9 4673 1 1 4 TYR HE1 H 5.468 2.989 8.320 1.00 . A A . 4 TYR HE1 1 1 9 4674 1 1 4 TYR HE2 H 7.790 3.154 4.710 1.00 . A A . 4 TYR HE2 1 1 9 4675 1 1 4 TYR HH H 7.506 1.234 6.022 1.00 . A A . 4 TYR HH 1 1 9 4676 1 1 4 TYR N N 3.953 6.458 3.625 1.00 . A A . 4 TYR N 1 1 9 4677 1 1 4 TYR O O 3.793 9.208 5.012 1.00 . A A . 4 TYR O 1 1 9 4678 1 1 4 TYR OH O 7.183 1.682 6.807 1.00 . A A . 4 TYR OH 1 1 9 4679 1 1 5 VAL C C 0.627 9.693 6.787 1.00 . A A . 5 VAL C 1 1 9 4680 1 1 5 VAL CA C 1.043 9.453 5.334 1.00 . A A . 5 VAL CA 1 1 9 4681 1 1 5 VAL CB C -0.144 9.428 4.369 1.00 . A A . 5 VAL CB 1 1 9 4682 1 1 5 VAL CG1 C -0.834 10.792 4.316 1.00 . A A . 5 VAL CG1 1 1 9 4683 1 1 5 VAL CG2 C 0.294 8.980 2.973 1.00 . A A . 5 VAL CG2 1 1 9 4684 1 1 5 VAL H H 1.221 7.377 5.311 1.00 . A A . 5 VAL H 1 1 9 4685 1 1 5 VAL HA H 1.714 10.253 5.025 1.00 . A A . 5 VAL HA 1 1 9 4686 1 1 5 VAL HB H -0.865 8.702 4.743 1.00 . A A . 5 VAL HB 1 1 9 4687 1 1 5 VAL HG11 H -0.346 11.474 5.011 1.00 . A A . 5 VAL HG11 1 1 9 4688 1 1 5 VAL HG12 H -0.767 11.194 3.304 1.00 . A A . 5 VAL HG12 1 1 9 4689 1 1 5 VAL HG13 H -1.883 10.681 4.592 1.00 . A A . 5 VAL HG13 1 1 9 4690 1 1 5 VAL HG21 H -0.586 8.750 2.372 1.00 . A A . 5 VAL HG21 1 1 9 4691 1 1 5 VAL HG22 H 0.860 9.780 2.495 1.00 . A A . 5 VAL HG22 1 1 9 4692 1 1 5 VAL HG23 H 0.920 8.091 3.057 1.00 . A A . 5 VAL HG23 1 1 9 4693 1 1 5 VAL N N 1.781 8.204 5.247 1.00 . A A . 5 VAL N 1 1 9 4694 1 1 5 VAL O O -0.154 8.925 7.348 1.00 . A A . 5 VAL O 1 1 9 4695 1 1 6 CYS C C -0.658 11.213 8.876 1.00 . A A . 6 CYS C 1 1 9 4696 1 1 6 CYS CA C 0.861 11.112 8.731 1.00 . A A . 6 CYS CA 1 1 9 4697 1 1 6 CYS CB C 1.563 12.405 9.154 1.00 . A A . 6 CYS CB 1 1 9 4698 1 1 6 CYS H H 1.801 11.380 6.892 1.00 . A A . 6 CYS H 1 1 9 4699 1 1 6 CYS HA H 1.257 10.310 9.353 1.00 . A A . 6 CYS HA 1 1 9 4700 1 1 6 CYS HB2 H 2.598 12.367 8.817 1.00 . A A . 6 CYS HB2 1 1 9 4701 1 1 6 CYS HB3 H 1.089 13.242 8.641 1.00 . A A . 6 CYS HB3 1 1 9 4702 1 1 6 CYS N N 1.167 10.761 7.355 1.00 . A A . 6 CYS N 1 1 9 4703 1 1 6 CYS O O -1.358 11.517 7.910 1.00 . A A . 6 CYS O 1 1 9 4704 1 1 6 CYS SG S 1.545 12.733 10.955 1.00 . A A . 6 CYS SG 1 1 9 4705 1 1 7 THR C C -2.863 12.197 11.284 1.00 . A A . 7 THR C 1 1 9 4706 1 1 7 THR CA C -2.548 11.010 10.371 1.00 . A A . 7 THR CA 1 1 9 4707 1 1 7 THR CB C -2.969 9.662 10.958 1.00 . A A . 7 THR CB 1 1 9 4708 1 1 7 THR CG2 C -2.876 8.524 9.940 1.00 . A A . 7 THR CG2 1 1 9 4709 1 1 7 THR H H -0.548 10.706 10.867 1.00 . A A . 7 THR H 1 1 9 4710 1 1 7 THR HA H -3.078 11.180 9.433 1.00 . A A . 7 THR HA 1 1 9 4711 1 1 7 THR HB H -3.970 9.719 11.388 1.00 . A A . 7 THR HB 1 1 9 4712 1 1 7 THR HG1 H -2.041 9.957 12.707 1.00 . A A . 7 THR HG1 1 1 9 4713 1 1 7 THR HG21 H -2.742 8.940 8.941 1.00 . A A . 7 THR HG21 1 1 9 4714 1 1 7 THR HG22 H -2.025 7.887 10.185 1.00 . A A . 7 THR HG22 1 1 9 4715 1 1 7 THR HG23 H -3.792 7.934 9.969 1.00 . A A . 7 THR HG23 1 1 9 4716 1 1 7 THR N N -1.125 10.953 10.088 1.00 . A A . 7 THR N 1 1 9 4717 1 1 7 THR O O -3.963 12.292 11.827 1.00 . A A . 7 THR O 1 1 9 4718 1 1 7 THR OG1 O -1.949 9.364 11.907 1.00 . A A . 7 THR OG1 1 1 9 4719 1 1 8 VAL C C -2.159 15.487 11.379 1.00 . A A . 8 VAL C 1 1 9 4720 1 1 8 VAL CA C -2.034 14.246 12.265 1.00 . A A . 8 VAL CA 1 1 9 4721 1 1 8 VAL CB C -0.877 14.337 13.262 1.00 . A A . 8 VAL CB 1 1 9 4722 1 1 8 VAL CG1 C -0.804 15.729 13.893 1.00 . A A . 8 VAL CG1 1 1 9 4723 1 1 8 VAL CG2 C -0.992 13.253 14.336 1.00 . A A . 8 VAL CG2 1 1 9 4724 1 1 8 VAL H H -0.985 12.985 10.982 1.00 . A A . 8 VAL H 1 1 9 4725 1 1 8 VAL HA H -2.958 14.125 12.832 1.00 . A A . 8 VAL HA 1 1 9 4726 1 1 8 VAL HB H 0.051 14.168 12.715 1.00 . A A . 8 VAL HB 1 1 9 4727 1 1 8 VAL HG11 H -0.237 15.677 14.822 1.00 . A A . 8 VAL HG11 1 1 9 4728 1 1 8 VAL HG12 H -0.310 16.415 13.205 1.00 . A A . 8 VAL HG12 1 1 9 4729 1 1 8 VAL HG13 H -1.813 16.087 14.102 1.00 . A A . 8 VAL HG13 1 1 9 4730 1 1 8 VAL HG21 H -0.398 12.388 14.043 1.00 . A A . 8 VAL HG21 1 1 9 4731 1 1 8 VAL HG22 H -0.623 13.643 15.285 1.00 . A A . 8 VAL HG22 1 1 9 4732 1 1 8 VAL HG23 H -2.035 12.958 14.445 1.00 . A A . 8 VAL HG23 1 1 9 4733 1 1 8 VAL N N -1.877 13.070 11.427 1.00 . A A . 8 VAL N 1 1 9 4734 1 1 8 VAL O O -3.112 16.254 11.509 1.00 . A A . 8 VAL O 1 1 9 4735 1 1 9 CYS C C -1.477 16.271 8.182 1.00 . A A . 9 CYS C 1 1 9 4736 1 1 9 CYS CA C -1.170 16.780 9.591 1.00 . A A . 9 CYS CA 1 1 9 4737 1 1 9 CYS CB C 0.160 17.537 9.648 1.00 . A A . 9 CYS CB 1 1 9 4738 1 1 9 CYS H H -0.410 15.018 10.400 1.00 . A A . 9 CYS H 1 1 9 4739 1 1 9 CYS HA H -1.947 17.463 9.934 1.00 . A A . 9 CYS HA 1 1 9 4740 1 1 9 CYS HB2 H 0.258 18.137 8.743 1.00 . A A . 9 CYS HB2 1 1 9 4741 1 1 9 CYS HB3 H 0.131 18.229 10.489 1.00 . A A . 9 CYS HB3 1 1 9 4742 1 1 9 CYS N N -1.182 15.646 10.499 1.00 . A A . 9 CYS N 1 1 9 4743 1 1 9 CYS O O -1.885 17.042 7.314 1.00 . A A . 9 CYS O 1 1 9 4744 1 1 9 CYS SG S 1.639 16.474 9.811 1.00 . A A . 9 CYS SG 1 1 9 4745 1 1 10 GLY C C -0.239 14.292 5.872 1.00 . A A . 10 GLY C 1 1 9 4746 1 1 10 GLY CA C -1.519 14.354 6.707 1.00 . A A . 10 GLY CA 1 1 9 4747 1 1 10 GLY H H -0.938 14.355 8.708 1.00 . A A . 10 GLY H 1 1 9 4748 1 1 10 GLY HA2 H -1.911 13.348 6.854 1.00 . A A . 10 GLY HA2 1 1 9 4749 1 1 10 GLY HA3 H -2.282 14.918 6.170 1.00 . A A . 10 GLY HA3 1 1 9 4750 1 1 10 GLY N N -1.270 14.976 7.996 1.00 . A A . 10 GLY N 1 1 9 4751 1 1 10 GLY O O -0.243 13.929 4.698 1.00 . A A . 10 GLY O 1 1 9 4752 1 1 11 TYR C C 2.290 13.438 4.962 1.00 . A A . 11 TYR C 1 1 9 4753 1 1 11 TYR CA C 2.165 14.660 5.861 1.00 . A A . 11 TYR CA 1 1 9 4754 1 1 11 TYR CB C 3.266 14.669 6.917 1.00 . A A . 11 TYR CB 1 1 9 4755 1 1 11 TYR CD1 C 4.873 15.940 5.448 1.00 . A A . 11 TYR CD1 1 1 9 4756 1 1 11 TYR CD2 C 5.702 14.050 6.720 1.00 . A A . 11 TYR CD2 1 1 9 4757 1 1 11 TYR CE1 C 6.152 16.147 4.919 1.00 . A A . 11 TYR CE1 1 1 9 4758 1 1 11 TYR CE2 C 6.982 14.257 6.192 1.00 . A A . 11 TYR CE2 1 1 9 4759 1 1 11 TYR CG C 4.647 14.892 6.348 1.00 . A A . 11 TYR CG 1 1 9 4760 1 1 11 TYR CZ C 7.207 15.305 5.291 1.00 . A A . 11 TYR CZ 1 1 9 4761 1 1 11 TYR H H 0.820 14.953 7.478 1.00 . A A . 11 TYR H 1 1 9 4762 1 1 11 TYR HA H 2.255 15.559 5.250 1.00 . A A . 11 TYR HA 1 1 9 4763 1 1 11 TYR HB2 H 3.053 15.461 7.635 1.00 . A A . 11 TYR HB2 1 1 9 4764 1 1 11 TYR HB3 H 3.256 13.712 7.439 1.00 . A A . 11 TYR HB3 1 1 9 4765 1 1 11 TYR HD1 H 4.058 16.590 5.161 1.00 . A A . 11 TYR HD1 1 1 9 4766 1 1 11 TYR HD2 H 5.528 13.242 7.415 1.00 . A A . 11 TYR HD2 1 1 9 4767 1 1 11 TYR HE1 H 6.326 16.955 4.225 1.00 . A A . 11 TYR HE1 1 1 9 4768 1 1 11 TYR HE2 H 7.796 13.607 6.479 1.00 . A A . 11 TYR HE2 1 1 9 4769 1 1 11 TYR HH H 9.031 15.994 5.368 1.00 . A A . 11 TYR HH 1 1 9 4770 1 1 11 TYR N N 0.872 14.662 6.512 1.00 . A A . 11 TYR N 1 1 9 4771 1 1 11 TYR O O 1.617 12.441 5.220 1.00 . A A . 11 TYR O 1 1 9 4772 1 1 11 TYR OH O 8.454 15.506 4.777 1.00 . A A . 11 TYR OH 1 1 9 4773 1 1 12 GLU C C 4.813 12.096 2.895 1.00 . A A . 12 GLU C 1 1 9 4774 1 1 12 GLU CA C 3.324 12.424 3.026 1.00 . A A . 12 GLU CA 1 1 9 4775 1 1 12 GLU CB C 2.708 12.729 1.658 1.00 . A A . 12 GLU CB 1 1 9 4776 1 1 12 GLU CD C 0.302 13.239 1.104 1.00 . A A . 12 GLU CD 1 1 9 4777 1 1 12 GLU CG C 1.290 12.164 1.558 1.00 . A A . 12 GLU CG 1 1 9 4778 1 1 12 GLU H H 3.674 14.348 3.741 1.00 . A A . 12 GLU H 1 1 9 4779 1 1 12 GLU HA H 2.798 11.581 3.474 1.00 . A A . 12 GLU HA 1 1 9 4780 1 1 12 GLU HB2 H 2.686 13.807 1.498 1.00 . A A . 12 GLU HB2 1 1 9 4781 1 1 12 GLU HB3 H 3.331 12.303 0.872 1.00 . A A . 12 GLU HB3 1 1 9 4782 1 1 12 GLU HE2 H -0.290 13.855 2.783 1.00 . A A . 12 GLU HE2 1 1 9 4783 1 1 12 GLU HG2 H 1.276 11.332 0.853 1.00 . A A . 12 GLU HG2 1 1 9 4784 1 1 12 GLU HG3 H 0.983 11.768 2.526 1.00 . A A . 12 GLU HG3 1 1 9 4785 1 1 12 GLU N N 3.132 13.534 3.943 1.00 . A A . 12 GLU N 1 1 9 4786 1 1 12 GLU O O 5.641 12.940 2.562 1.00 . A A . 12 GLU O 1 1 9 4787 1 1 12 GLU OE1 O -0.259 13.142 0.002 1.00 . A A . 12 GLU OE1 1 1 9 4788 1 1 12 GLU OE2 O 0.123 14.205 1.942 1.00 . A A . 12 GLU OE2 1 1 9 4789 1 1 13 TYR C C 6.585 9.145 2.182 1.00 . A A . 13 TYR C 1 1 9 4790 1 1 13 TYR CA C 6.507 10.360 3.094 1.00 . A A . 13 TYR CA 1 1 9 4791 1 1 13 TYR CB C 7.003 10.018 4.496 1.00 . A A . 13 TYR CB 1 1 9 4792 1 1 13 TYR CD1 C 8.538 8.021 4.403 1.00 . A A . 13 TYR CD1 1 1 9 4793 1 1 13 TYR CD2 C 9.511 10.229 4.641 1.00 . A A . 13 TYR CD2 1 1 9 4794 1 1 13 TYR CE1 C 9.817 7.455 4.419 1.00 . A A . 13 TYR CE1 1 1 9 4795 1 1 13 TYR CE2 C 10.791 9.662 4.657 1.00 . A A . 13 TYR CE2 1 1 9 4796 1 1 13 TYR CG C 8.384 9.408 4.513 1.00 . A A . 13 TYR CG 1 1 9 4797 1 1 13 TYR CZ C 10.944 8.275 4.546 1.00 . A A . 13 TYR CZ 1 1 9 4798 1 1 13 TYR H H 4.419 10.174 3.439 1.00 . A A . 13 TYR H 1 1 9 4799 1 1 13 TYR HA H 7.131 11.153 2.681 1.00 . A A . 13 TYR HA 1 1 9 4800 1 1 13 TYR HB2 H 7.019 10.931 5.093 1.00 . A A . 13 TYR HB2 1 1 9 4801 1 1 13 TYR HB3 H 6.306 9.315 4.951 1.00 . A A . 13 TYR HB3 1 1 9 4802 1 1 13 TYR HD1 H 7.668 7.388 4.305 1.00 . A A . 13 TYR HD1 1 1 9 4803 1 1 13 TYR HD2 H 9.393 11.299 4.727 1.00 . A A . 13 TYR HD2 1 1 9 4804 1 1 13 TYR HE1 H 9.936 6.385 4.333 1.00 . A A . 13 TYR HE1 1 1 9 4805 1 1 13 TYR HE2 H 11.661 10.296 4.755 1.00 . A A . 13 TYR HE2 1 1 9 4806 1 1 13 TYR HH H 12.877 8.349 4.811 1.00 . A A . 13 TYR HH 1 1 9 4807 1 1 13 TYR N N 5.137 10.831 3.170 1.00 . A A . 13 TYR N 1 1 9 4808 1 1 13 TYR O O 5.554 8.526 1.925 1.00 . A A . 13 TYR O 1 1 9 4809 1 1 13 TYR OH O 12.192 7.723 4.562 1.00 . A A . 13 TYR OH 1 1 9 4810 1 1 14 ASP C C 9.092 6.802 1.390 1.00 . A A . 14 ASP C 1 1 9 4811 1 1 14 ASP CA C 7.971 7.685 0.840 1.00 . A A . 14 ASP CA 1 1 9 4812 1 1 14 ASP CB C 8.366 8.131 -0.569 1.00 . A A . 14 ASP CB 1 1 9 4813 1 1 14 ASP CG C 7.939 7.183 -1.690 1.00 . A A . 14 ASP CG 1 1 9 4814 1 1 14 ASP H H 8.619 9.336 1.932 1.00 . A A . 14 ASP H 1 1 9 4815 1 1 14 ASP HA H 7.007 7.174 0.827 1.00 . A A . 14 ASP HA 1 1 9 4816 1 1 14 ASP HB2 H 7.933 9.112 -0.758 1.00 . A A . 14 ASP HB2 1 1 9 4817 1 1 14 ASP HB3 H 9.449 8.248 -0.605 1.00 . A A . 14 ASP HB3 1 1 9 4818 1 1 14 ASP HD2 H 6.312 8.072 -2.024 1.00 . A A . 14 ASP HD2 1 1 9 4819 1 1 14 ASP N N 7.785 8.828 1.719 1.00 . A A . 14 ASP N 1 1 9 4820 1 1 14 ASP O O 10.109 7.275 1.894 1.00 . A A . 14 ASP O 1 1 9 4821 1 1 14 ASP OD1 O 8.776 6.515 -2.316 1.00 . A A . 14 ASP OD1 1 1 9 4822 1 1 14 ASP OD2 O 6.669 7.144 -1.918 1.00 . A A . 14 ASP OD2 1 1 9 4823 1 1 15 PRO C C 10.934 4.321 0.714 1.00 . A A . 15 PRO C 1 1 9 4824 1 1 15 PRO CA C 9.810 4.472 1.729 1.00 . A A . 15 PRO CA 1 1 9 4825 1 1 15 PRO CB C 8.979 3.195 1.818 1.00 . A A . 15 PRO CB 1 1 9 4826 1 1 15 PRO CD C 7.700 4.896 0.691 1.00 . A A . 15 PRO CD 1 1 9 4827 1 1 15 PRO CG C 7.966 3.393 0.700 1.00 . A A . 15 PRO CG 1 1 9 4828 1 1 15 PRO HA H 10.225 4.726 2.705 1.00 . A A . 15 PRO HA 1 1 9 4829 1 1 15 PRO HB2 H 9.571 2.301 1.621 1.00 . A A . 15 PRO HB2 1 1 9 4830 1 1 15 PRO HB3 H 8.513 3.138 2.803 1.00 . A A . 15 PRO HB3 1 1 9 4831 1 1 15 PRO HD2 H 7.534 5.255 -0.325 1.00 . A A . 15 PRO HD2 1 1 9 4832 1 1 15 PRO HD3 H 6.838 5.123 1.319 1.00 . A A . 15 PRO HD3 1 1 9 4833 1 1 15 PRO HG2 H 7.973 3.023 -0.325 1.00 . A A . 15 PRO HG2 1 1 9 4834 1 1 15 PRO HG3 H 7.237 2.847 1.301 1.00 . A A . 15 PRO HG3 1 1 9 4835 1 1 15 PRO N N 8.882 5.488 1.278 1.00 . A A . 15 PRO N 1 1 9 4836 1 1 15 PRO O O 10.730 3.664 -0.306 1.00 . A A . 15 PRO O 1 1 9 4837 1 1 16 ALA C C 14.248 5.902 0.490 1.00 . A A . 16 ALA C 1 1 9 4838 1 1 16 ALA CA C 13.215 4.841 0.099 1.00 . A A . 16 ALA CA 1 1 9 4839 1 1 16 ALA CB C 12.733 5.001 -1.343 1.00 . A A . 16 ALA CB 1 1 9 4840 1 1 16 ALA H H 12.238 5.456 1.834 1.00 . A A . 16 ALA H 1 1 9 4841 1 1 16 ALA HA H 13.660 3.853 0.213 1.00 . A A . 16 ALA HA 1 1 9 4842 1 1 16 ALA HB1 H 13.495 5.519 -1.927 1.00 . A A . 16 ALA HB1 1 1 9 4843 1 1 16 ALA HB2 H 12.549 4.018 -1.776 1.00 . A A . 16 ALA HB2 1 1 9 4844 1 1 16 ALA HB3 H 11.810 5.581 -1.356 1.00 . A A . 16 ALA HB3 1 1 9 4845 1 1 16 ALA N N 12.079 4.922 1.003 1.00 . A A . 16 ALA N 1 1 9 4846 1 1 16 ALA O O 14.466 6.862 -0.248 1.00 . A A . 16 ALA O 1 1 9 4847 1 1 17 PHE C C 16.922 5.883 2.966 1.00 . A A . 17 PHE C 1 1 9 4848 1 1 17 PHE CA C 15.860 6.616 2.144 1.00 . A A . 17 PHE CA 1 1 9 4849 1 1 17 PHE CB C 15.137 7.618 3.047 1.00 . A A . 17 PHE CB 1 1 9 4850 1 1 17 PHE CD1 C 13.282 8.515 1.623 1.00 . A A . 17 PHE CD1 1 1 9 4851 1 1 17 PHE CD2 C 14.993 9.997 2.276 1.00 . A A . 17 PHE CD2 1 1 9 4852 1 1 17 PHE CE1 C 12.640 9.568 0.918 1.00 . A A . 17 PHE CE1 1 1 9 4853 1 1 17 PHE CE2 C 14.352 11.049 1.571 1.00 . A A . 17 PHE CE2 1 1 9 4854 1 1 17 PHE CG C 14.446 8.752 2.287 1.00 . A A . 17 PHE CG 1 1 9 4855 1 1 17 PHE CZ C 13.188 10.812 0.907 1.00 . A A . 17 PHE CZ 1 1 9 4856 1 1 17 PHE H H 14.673 4.907 2.241 1.00 . A A . 17 PHE H 1 1 9 4857 1 1 17 PHE HA H 16.330 7.079 1.278 1.00 . A A . 17 PHE HA 1 1 9 4858 1 1 17 PHE HB2 H 14.394 7.087 3.641 1.00 . A A . 17 PHE HB2 1 1 9 4859 1 1 17 PHE HB3 H 15.856 8.049 3.744 1.00 . A A . 17 PHE HB3 1 1 9 4860 1 1 17 PHE HD1 H 12.842 7.518 1.633 1.00 . A A . 17 PHE HD1 1 1 9 4861 1 1 17 PHE HD2 H 15.925 10.187 2.807 1.00 . A A . 17 PHE HD2 1 1 9 4862 1 1 17 PHE HE1 H 11.708 9.378 0.387 1.00 . A A . 17 PHE HE1 1 1 9 4863 1 1 17 PHE HE2 H 14.790 12.047 1.562 1.00 . A A . 17 PHE HE2 1 1 9 4864 1 1 17 PHE HZ H 12.695 11.620 0.366 1.00 . A A . 17 PHE HZ 1 1 9 4865 1 1 17 PHE N N 14.855 5.691 1.648 1.00 . A A . 17 PHE N 1 1 9 4866 1 1 17 PHE O O 16.937 4.653 3.014 1.00 . A A . 17 PHE O 1 1 9 4867 1 1 18 GLU C C 18.863 6.770 5.790 1.00 . A A . 18 GLU C 1 1 9 4868 1 1 18 GLU CA C 18.849 6.108 4.411 1.00 . A A . 18 GLU CA 1 1 9 4869 1 1 18 GLU CB C 20.206 6.254 3.719 1.00 . A A . 18 GLU CB 1 1 9 4870 1 1 18 GLU CD C 22.124 5.903 5.319 1.00 . A A . 18 GLU CD 1 1 9 4871 1 1 18 GLU CG C 21.216 5.249 4.275 1.00 . A A . 18 GLU CG 1 1 9 4872 1 1 18 GLU H H 17.767 7.667 3.549 1.00 . A A . 18 GLU H 1 1 9 4873 1 1 18 GLU HA H 18.611 5.050 4.510 1.00 . A A . 18 GLU HA 1 1 9 4874 1 1 18 GLU HB2 H 20.090 6.103 2.646 1.00 . A A . 18 GLU HB2 1 1 9 4875 1 1 18 GLU HB3 H 20.582 7.268 3.859 1.00 . A A . 18 GLU HB3 1 1 9 4876 1 1 18 GLU HE2 H 22.918 7.424 4.544 1.00 . A A . 18 GLU HE2 1 1 9 4877 1 1 18 GLU HG2 H 20.686 4.407 4.724 1.00 . A A . 18 GLU HG2 1 1 9 4878 1 1 18 GLU HG3 H 21.820 4.847 3.462 1.00 . A A . 18 GLU HG3 1 1 9 4879 1 1 18 GLU N N 17.786 6.668 3.593 1.00 . A A . 18 GLU N 1 1 9 4880 1 1 18 GLU O O 19.863 7.364 6.188 1.00 . A A . 18 GLU O 1 1 9 4881 1 1 18 GLU OE1 O 21.836 5.831 6.523 1.00 . A A . 18 GLU OE1 1 1 9 4882 1 1 18 GLU OE2 O 23.162 6.500 4.841 1.00 . A A . 18 GLU OE2 1 1 9 4883 1 1 19 ASP C C 16.209 6.932 8.352 1.00 . A A . 19 ASP C 1 1 9 4884 1 1 19 ASP CA C 17.609 7.223 7.808 1.00 . A A . 19 ASP CA 1 1 9 4885 1 1 19 ASP CB C 17.793 8.742 7.767 1.00 . A A . 19 ASP CB 1 1 9 4886 1 1 19 ASP CG C 18.215 9.378 9.093 1.00 . A A . 19 ASP CG 1 1 9 4887 1 1 19 ASP H H 16.929 6.161 6.150 1.00 . A A . 19 ASP H 1 1 9 4888 1 1 19 ASP HA H 18.393 6.756 8.403 1.00 . A A . 19 ASP HA 1 1 9 4889 1 1 19 ASP HB2 H 18.542 8.982 7.013 1.00 . A A . 19 ASP HB2 1 1 9 4890 1 1 19 ASP HB3 H 16.858 9.198 7.444 1.00 . A A . 19 ASP HB3 1 1 9 4891 1 1 19 ASP HD2 H 17.564 10.300 10.601 1.00 . A A . 19 ASP HD2 1 1 9 4892 1 1 19 ASP N N 17.739 6.645 6.481 1.00 . A A . 19 ASP N 1 1 9 4893 1 1 19 ASP O O 15.265 7.668 8.072 1.00 . A A . 19 ASP O 1 1 9 4894 1 1 19 ASP OD1 O 19.338 9.165 9.575 1.00 . A A . 19 ASP OD1 1 1 9 4895 1 1 19 ASP OD2 O 17.325 10.132 9.644 1.00 . A A . 19 ASP OD2 1 1 9 4896 1 1 20 LEU C C 15.095 4.900 11.109 1.00 . A A . 20 LEU C 1 1 9 4897 1 1 20 LEU CA C 14.851 5.458 9.706 1.00 . A A . 20 LEU CA 1 1 9 4898 1 1 20 LEU CB C 14.113 4.490 8.778 1.00 . A A . 20 LEU CB 1 1 9 4899 1 1 20 LEU CD1 C 11.976 5.364 7.766 1.00 . A A . 20 LEU CD1 1 1 9 4900 1 1 20 LEU CD2 C 12.024 3.080 8.867 1.00 . A A . 20 LEU CD2 1 1 9 4901 1 1 20 LEU CG C 12.586 4.503 8.873 1.00 . A A . 20 LEU CG 1 1 9 4902 1 1 20 LEU H H 16.893 5.263 9.342 1.00 . A A . 20 LEU H 1 1 9 4903 1 1 20 LEU HA H 14.235 6.354 9.791 1.00 . A A . 20 LEU HA 1 1 9 4904 1 1 20 LEU HB2 H 14.396 4.717 7.750 1.00 . A A . 20 LEU HB2 1 1 9 4905 1 1 20 LEU HB3 H 14.462 3.479 8.989 1.00 . A A . 20 LEU HB3 1 1 9 4906 1 1 20 LEU HD11 H 11.065 4.892 7.398 1.00 . A A . 20 LEU HD11 1 1 9 4907 1 1 20 LEU HD12 H 11.737 6.352 8.163 1.00 . A A . 20 LEU HD12 1 1 9 4908 1 1 20 LEU HD13 H 12.689 5.465 6.948 1.00 . A A . 20 LEU HD13 1 1 9 4909 1 1 20 LEU HD21 H 11.809 2.779 7.842 1.00 . A A . 20 LEU HD21 1 1 9 4910 1 1 20 LEU HD22 H 12.757 2.398 9.300 1.00 . A A . 20 LEU HD22 1 1 9 4911 1 1 20 LEU HD23 H 11.107 3.050 9.456 1.00 . A A . 20 LEU HD23 1 1 9 4912 1 1 20 LEU HG H 12.306 4.956 9.825 1.00 . A A . 20 LEU HG 1 1 9 4913 1 1 20 LEU N N 16.119 5.856 9.119 1.00 . A A . 20 LEU N 1 1 9 4914 1 1 20 LEU O O 15.112 3.693 11.337 1.00 . A A . 20 LEU O 1 1 9 4915 1 1 21 PRO C C 14.218 5.166 14.136 1.00 . A A . 21 PRO C 1 1 9 4916 1 1 21 PRO CA C 15.532 5.518 13.450 1.00 . A A . 21 PRO CA 1 1 9 4917 1 1 21 PRO CB C 16.126 6.799 14.031 1.00 . A A . 21 PRO CB 1 1 9 4918 1 1 21 PRO CD C 15.273 7.248 11.823 1.00 . A A . 21 PRO CD 1 1 9 4919 1 1 21 PRO CG C 15.462 7.874 13.203 1.00 . A A . 21 PRO CG 1 1 9 4920 1 1 21 PRO HA H 16.235 4.691 13.554 1.00 . A A . 21 PRO HA 1 1 9 4921 1 1 21 PRO HB2 H 15.920 6.906 15.095 1.00 . A A . 21 PRO HB2 1 1 9 4922 1 1 21 PRO HB3 H 17.199 6.813 13.842 1.00 . A A . 21 PRO HB3 1 1 9 4923 1 1 21 PRO HD2 H 14.333 7.573 11.375 1.00 . A A . 21 PRO HD2 1 1 9 4924 1 1 21 PRO HD3 H 16.111 7.512 11.179 1.00 . A A . 21 PRO HD3 1 1 9 4925 1 1 21 PRO HG2 H 14.487 8.036 13.662 1.00 . A A . 21 PRO HG2 1 1 9 4926 1 1 21 PRO HG3 H 16.028 8.806 13.161 1.00 . A A . 21 PRO HG3 1 1 9 4927 1 1 21 PRO N N 15.286 5.821 12.057 1.00 . A A . 21 PRO N 1 1 9 4928 1 1 21 PRO O O 13.163 5.381 13.542 1.00 . A A . 21 PRO O 1 1 9 4929 1 1 22 ASP C C 12.686 5.434 16.984 1.00 . A A . 22 ASP C 1 1 9 4930 1 1 22 ASP CA C 13.109 4.268 16.089 1.00 . A A . 22 ASP CA 1 1 9 4931 1 1 22 ASP CB C 13.372 3.056 16.984 1.00 . A A . 22 ASP CB 1 1 9 4932 1 1 22 ASP CG C 14.644 2.272 16.654 1.00 . A A . 22 ASP CG 1 1 9 4933 1 1 22 ASP H H 15.166 4.469 15.824 1.00 . A A . 22 ASP H 1 1 9 4934 1 1 22 ASP HA H 12.364 4.034 15.329 1.00 . A A . 22 ASP HA 1 1 9 4935 1 1 22 ASP HB2 H 13.428 3.392 18.019 1.00 . A A . 22 ASP HB2 1 1 9 4936 1 1 22 ASP HB3 H 12.519 2.381 16.914 1.00 . A A . 22 ASP HB3 1 1 9 4937 1 1 22 ASP HD2 H 16.335 2.138 17.473 1.00 . A A . 22 ASP HD2 1 1 9 4938 1 1 22 ASP N N 14.303 4.641 15.349 1.00 . A A . 22 ASP N 1 1 9 4939 1 1 22 ASP O O 12.227 5.225 18.106 1.00 . A A . 22 ASP O 1 1 9 4940 1 1 22 ASP OD1 O 14.591 1.191 16.050 1.00 . A A . 22 ASP OD1 1 1 9 4941 1 1 22 ASP OD2 O 15.742 2.823 17.050 1.00 . A A . 22 ASP OD2 1 1 9 4942 1 1 23 ASP C C 12.340 9.004 16.216 1.00 . A A . 23 ASP C 1 1 9 4943 1 1 23 ASP CA C 12.496 7.837 17.193 1.00 . A A . 23 ASP CA 1 1 9 4944 1 1 23 ASP CB C 13.582 8.207 18.204 1.00 . A A . 23 ASP CB 1 1 9 4945 1 1 23 ASP CG C 13.078 8.911 19.466 1.00 . A A . 23 ASP CG 1 1 9 4946 1 1 23 ASP H H 13.229 6.799 15.542 1.00 . A A . 23 ASP H 1 1 9 4947 1 1 23 ASP HA H 11.563 7.591 17.701 1.00 . A A . 23 ASP HA 1 1 9 4948 1 1 23 ASP HB2 H 14.109 7.299 18.498 1.00 . A A . 23 ASP HB2 1 1 9 4949 1 1 23 ASP HB3 H 14.310 8.853 17.712 1.00 . A A . 23 ASP HB3 1 1 9 4950 1 1 23 ASP HD2 H 13.115 10.600 20.297 1.00 . A A . 23 ASP HD2 1 1 9 4951 1 1 23 ASP N N 12.855 6.637 16.456 1.00 . A A . 23 ASP N 1 1 9 4952 1 1 23 ASP O O 12.884 10.084 16.442 1.00 . A A . 23 ASP O 1 1 9 4953 1 1 23 ASP OD1 O 12.128 8.452 20.116 1.00 . A A . 23 ASP OD1 1 1 9 4954 1 1 23 ASP OD2 O 13.713 9.990 19.779 1.00 . A A . 23 ASP OD2 1 1 9 4955 1 1 24 TRP C C 10.028 10.441 14.447 1.00 . A A . 24 TRP C 1 1 9 4956 1 1 24 TRP CA C 11.363 9.763 14.137 1.00 . A A . 24 TRP CA 1 1 9 4957 1 1 24 TRP CB C 11.415 9.159 12.733 1.00 . A A . 24 TRP CB 1 1 9 4958 1 1 24 TRP CD1 C 12.508 11.157 11.518 1.00 . A A . 24 TRP CD1 1 1 9 4959 1 1 24 TRP CD2 C 10.761 10.327 10.438 1.00 . A A . 24 TRP CD2 1 1 9 4960 1 1 24 TRP CE2 C 11.248 11.378 9.689 1.00 . A A . 24 TRP CE2 1 1 9 4961 1 1 24 TRP CE3 C 9.644 9.582 10.019 1.00 . A A . 24 TRP CE3 1 1 9 4962 1 1 24 TRP CG C 11.583 10.192 11.617 1.00 . A A . 24 TRP CG 1 1 9 4963 1 1 24 TRP CH2 C 9.564 11.056 8.038 1.00 . A A . 24 TRP CH2 1 1 9 4964 1 1 24 TRP CZ2 C 10.679 11.782 8.475 1.00 . A A . 24 TRP CZ2 1 1 9 4965 1 1 24 TRP CZ3 C 9.088 9.999 8.804 1.00 . A A . 24 TRP CZ3 1 1 9 4966 1 1 24 TRP H H 11.158 7.866 14.973 1.00 . A A . 24 TRP H 1 1 9 4967 1 1 24 TRP HA H 12.174 10.488 14.201 1.00 . A A . 24 TRP HA 1 1 9 4968 1 1 24 TRP HB2 H 12.241 8.450 12.684 1.00 . A A . 24 TRP HB2 1 1 9 4969 1 1 24 TRP HB3 H 10.499 8.595 12.557 1.00 . A A . 24 TRP HB3 1 1 9 4970 1 1 24 TRP HD1 H 13.292 11.333 12.255 1.00 . A A . 24 TRP HD1 1 1 9 4971 1 1 24 TRP HE1 H 12.959 12.740 10.047 1.00 . A A . 24 TRP HE1 1 1 9 4972 1 1 24 TRP HE3 H 9.242 8.748 10.593 1.00 . A A . 24 TRP HE3 1 1 9 4973 1 1 24 TRP HH2 H 9.074 11.318 7.100 1.00 . A A . 24 TRP HH2 1 1 9 4974 1 1 24 TRP HZ2 H 11.082 12.617 7.902 1.00 . A A . 24 TRP HZ2 1 1 9 4975 1 1 24 TRP HZ3 H 8.218 9.456 8.432 1.00 . A A . 24 TRP HZ3 1 1 9 4976 1 1 24 TRP N N 11.596 8.747 15.150 1.00 . A A . 24 TRP N 1 1 9 4977 1 1 24 TRP NE1 N 12.344 11.900 10.367 1.00 . A A . 24 TRP NE1 1 1 9 4978 1 1 24 TRP O O 9.080 9.787 14.880 1.00 . A A . 24 TRP O 1 1 9 4979 1 1 25 ALA C C 8.482 13.383 13.239 1.00 . A A . 25 ALA C 1 1 9 4980 1 1 25 ALA CA C 8.790 12.520 14.465 1.00 . A A . 25 ALA CA 1 1 9 4981 1 1 25 ALA CB C 8.973 13.353 15.734 1.00 . A A . 25 ALA CB 1 1 9 4982 1 1 25 ALA H H 10.770 12.270 13.864 1.00 . A A . 25 ALA H 1 1 9 4983 1 1 25 ALA HA H 7.970 11.818 14.620 1.00 . A A . 25 ALA HA 1 1 9 4984 1 1 25 ALA HB1 H 8.326 12.965 16.520 1.00 . A A . 25 ALA HB1 1 1 9 4985 1 1 25 ALA HB2 H 10.012 13.298 16.059 1.00 . A A . 25 ALA HB2 1 1 9 4986 1 1 25 ALA HB3 H 8.711 14.391 15.528 1.00 . A A . 25 ALA HB3 1 1 9 4987 1 1 25 ALA N N 9.994 11.745 14.216 1.00 . A A . 25 ALA N 1 1 9 4988 1 1 25 ALA O O 9.377 14.010 12.677 1.00 . A A . 25 ALA O 1 1 9 4989 1 1 26 CYS C C 7.385 15.561 11.819 1.00 . A A . 26 CYS C 1 1 9 4990 1 1 26 CYS CA C 6.774 14.163 11.714 1.00 . A A . 26 CYS CA 1 1 9 4991 1 1 26 CYS CB C 5.248 14.213 11.615 1.00 . A A . 26 CYS CB 1 1 9 4992 1 1 26 CYS H H 6.490 12.873 13.326 1.00 . A A . 26 CYS H 1 1 9 4993 1 1 26 CYS HA H 7.140 13.645 10.829 1.00 . A A . 26 CYS HA 1 1 9 4994 1 1 26 CYS HB2 H 4.847 13.243 11.907 1.00 . A A . 26 CYS HB2 1 1 9 4995 1 1 26 CYS HB3 H 4.874 14.942 12.334 1.00 . A A . 26 CYS HB3 1 1 9 4996 1 1 26 CYS N N 7.211 13.386 12.862 1.00 . A A . 26 CYS N 1 1 9 4997 1 1 26 CYS O O 6.976 16.394 12.623 1.00 . A A . 26 CYS O 1 1 9 4998 1 1 26 CYS SG S 4.601 14.640 9.957 1.00 . A A . 26 CYS SG 1 1 9 4999 1 1 27 PRO C C 8.123 18.212 10.893 1.00 . A A . 27 PRO C 1 1 9 5000 1 1 27 PRO CA C 9.110 17.055 10.898 1.00 . A A . 27 PRO CA 1 1 9 5001 1 1 27 PRO CB C 9.880 16.985 9.580 1.00 . A A . 27 PRO CB 1 1 9 5002 1 1 27 PRO CD C 8.897 14.845 10.013 1.00 . A A . 27 PRO CD 1 1 9 5003 1 1 27 PRO CG C 10.209 15.445 9.514 1.00 . A A . 27 PRO CG 1 1 9 5004 1 1 27 PRO HA H 9.801 17.160 11.735 1.00 . A A . 27 PRO HA 1 1 9 5005 1 1 27 PRO HB2 H 9.300 17.373 8.742 1.00 . A A . 27 PRO HB2 1 1 9 5006 1 1 27 PRO HB3 H 10.819 17.528 9.684 1.00 . A A . 27 PRO HB3 1 1 9 5007 1 1 27 PRO HD2 H 8.200 14.695 9.190 1.00 . A A . 27 PRO HD2 1 1 9 5008 1 1 27 PRO HD3 H 9.092 13.901 10.521 1.00 . A A . 27 PRO HD3 1 1 9 5009 1 1 27 PRO HG2 H 10.340 15.196 8.461 1.00 . A A . 27 PRO HG2 1 1 9 5010 1 1 27 PRO HG3 H 11.067 15.112 10.099 1.00 . A A . 27 PRO HG3 1 1 9 5011 1 1 27 PRO N N 8.390 15.802 10.973 1.00 . A A . 27 PRO N 1 1 9 5012 1 1 27 PRO O O 8.520 19.332 11.211 1.00 . A A . 27 PRO O 1 1 9 5013 1 1 28 VAL C C 5.283 19.158 11.903 1.00 . A A . 28 VAL C 1 1 9 5014 1 1 28 VAL CA C 5.858 18.963 10.499 1.00 . A A . 28 VAL CA 1 1 9 5015 1 1 28 VAL CB C 4.793 18.607 9.459 1.00 . A A . 28 VAL CB 1 1 9 5016 1 1 28 VAL CG1 C 3.656 19.633 9.467 1.00 . A A . 28 VAL CG1 1 1 9 5017 1 1 28 VAL CG2 C 5.408 18.480 8.065 1.00 . A A . 28 VAL CG2 1 1 9 5018 1 1 28 VAL H H 6.564 17.015 10.281 1.00 . A A . 28 VAL H 1 1 9 5019 1 1 28 VAL HA H 6.340 19.889 10.185 1.00 . A A . 28 VAL HA 1 1 9 5020 1 1 28 VAL HB H 4.371 17.639 9.730 1.00 . A A . 28 VAL HB 1 1 9 5021 1 1 28 VAL HG11 H 3.308 19.795 8.447 1.00 . A A . 28 VAL HG11 1 1 9 5022 1 1 28 VAL HG12 H 2.834 19.259 10.077 1.00 . A A . 28 VAL HG12 1 1 9 5023 1 1 28 VAL HG13 H 4.019 20.573 9.880 1.00 . A A . 28 VAL HG13 1 1 9 5024 1 1 28 VAL HG21 H 5.247 17.470 7.688 1.00 . A A . 28 VAL HG21 1 1 9 5025 1 1 28 VAL HG22 H 4.937 19.197 7.393 1.00 . A A . 28 VAL HG22 1 1 9 5026 1 1 28 VAL HG23 H 6.477 18.681 8.119 1.00 . A A . 28 VAL HG23 1 1 9 5027 1 1 28 VAL N N 6.878 17.929 10.538 1.00 . A A . 28 VAL N 1 1 9 5028 1 1 28 VAL O O 5.788 19.968 12.677 1.00 . A A . 28 VAL O 1 1 9 5029 1 1 29 CYS C C 4.604 18.107 14.558 1.00 . A A . 29 CYS C 1 1 9 5030 1 1 29 CYS CA C 3.582 18.483 13.484 1.00 . A A . 29 CYS CA 1 1 9 5031 1 1 29 CYS CB C 2.336 17.598 13.548 1.00 . A A . 29 CYS CB 1 1 9 5032 1 1 29 CYS H H 3.826 17.746 11.551 1.00 . A A . 29 CYS H 1 1 9 5033 1 1 29 CYS HA H 3.254 19.516 13.607 1.00 . A A . 29 CYS HA 1 1 9 5034 1 1 29 CYS HB2 H 1.925 17.644 14.557 1.00 . A A . 29 CYS HB2 1 1 9 5035 1 1 29 CYS HB3 H 1.580 18.009 12.878 1.00 . A A . 29 CYS HB3 1 1 9 5036 1 1 29 CYS N N 4.232 18.402 12.187 1.00 . A A . 29 CYS N 1 1 9 5037 1 1 29 CYS O O 4.741 18.804 15.562 1.00 . A A . 29 CYS O 1 1 9 5038 1 1 29 CYS SG S 2.617 15.844 13.109 1.00 . A A . 29 CYS SG 1 1 9 5039 1 1 30 GLY C C 5.891 15.185 15.854 1.00 . A A . 30 GLY C 1 1 9 5040 1 1 30 GLY CA C 6.303 16.527 15.244 1.00 . A A . 30 GLY CA 1 1 9 5041 1 1 30 GLY H H 5.179 16.442 13.492 1.00 . A A . 30 GLY H 1 1 9 5042 1 1 30 GLY HA2 H 7.258 16.420 14.731 1.00 . A A . 30 GLY HA2 1 1 9 5043 1 1 30 GLY HA3 H 6.446 17.261 16.037 1.00 . A A . 30 GLY HA3 1 1 9 5044 1 1 30 GLY N N 5.296 17.004 14.311 1.00 . A A . 30 GLY N 1 1 9 5045 1 1 30 GLY O O 6.719 14.484 16.435 1.00 . A A . 30 GLY O 1 1 9 5046 1 1 31 ALA C C 5.078 12.492 15.952 1.00 . A A . 31 ALA C 1 1 9 5047 1 1 31 ALA CA C 4.085 13.622 16.228 1.00 . A A . 31 ALA CA 1 1 9 5048 1 1 31 ALA CB C 2.709 13.352 15.615 1.00 . A A . 31 ALA CB 1 1 9 5049 1 1 31 ALA H H 3.949 15.443 15.226 1.00 . A A . 31 ALA H 1 1 9 5050 1 1 31 ALA HA H 3.971 13.740 17.306 1.00 . A A . 31 ALA HA 1 1 9 5051 1 1 31 ALA HB1 H 2.329 14.266 15.158 1.00 . A A . 31 ALA HB1 1 1 9 5052 1 1 31 ALA HB2 H 2.795 12.575 14.856 1.00 . A A . 31 ALA HB2 1 1 9 5053 1 1 31 ALA HB3 H 2.022 13.022 16.395 1.00 . A A . 31 ALA HB3 1 1 9 5054 1 1 31 ALA N N 4.615 14.868 15.700 1.00 . A A . 31 ALA N 1 1 9 5055 1 1 31 ALA O O 5.919 12.604 15.062 1.00 . A A . 31 ALA O 1 1 9 5056 1 1 32 SER C C 5.462 9.508 15.311 1.00 . A A . 32 SER C 1 1 9 5057 1 1 32 SER CA C 5.823 10.279 16.582 1.00 . A A . 32 SER CA 1 1 9 5058 1 1 32 SER CB C 5.738 9.359 17.803 1.00 . A A . 32 SER CB 1 1 9 5059 1 1 32 SER H H 4.260 11.346 17.453 1.00 . A A . 32 SER H 1 1 9 5060 1 1 32 SER HA H 6.829 10.690 16.508 1.00 . A A . 32 SER HA 1 1 9 5061 1 1 32 SER HB2 H 6.174 8.391 17.558 1.00 . A A . 32 SER HB2 1 1 9 5062 1 1 32 SER HB3 H 6.331 9.779 18.615 1.00 . A A . 32 SER HB3 1 1 9 5063 1 1 32 SER HG H 3.843 8.791 17.502 1.00 . A A . 32 SER HG 1 1 9 5064 1 1 32 SER N N 4.947 11.429 16.731 1.00 . A A . 32 SER N 1 1 9 5065 1 1 32 SER O O 4.417 9.751 14.709 1.00 . A A . 32 SER O 1 1 9 5066 1 1 32 SER OG O 4.394 9.177 18.241 1.00 . A A . 32 SER OG 1 1 9 5067 1 1 33 LYS C C 5.269 6.577 14.109 1.00 . A A . 33 LYS C 1 1 9 5068 1 1 33 LYS CA C 6.135 7.786 13.751 1.00 . A A . 33 LYS CA 1 1 9 5069 1 1 33 LYS CB C 7.473 7.415 13.109 1.00 . A A . 33 LYS CB 1 1 9 5070 1 1 33 LYS CD C 8.803 5.324 13.576 1.00 . A A . 33 LYS CD 1 1 9 5071 1 1 33 LYS CE C 9.689 5.467 12.338 1.00 . A A . 33 LYS CE 1 1 9 5072 1 1 33 LYS CG C 8.380 6.695 14.108 1.00 . A A . 33 LYS CG 1 1 9 5073 1 1 33 LYS H H 7.194 8.403 15.435 1.00 . A A . 33 LYS H 1 1 9 5074 1 1 33 LYS HA H 5.591 8.400 13.032 1.00 . A A . 33 LYS HA 1 1 9 5075 1 1 33 LYS HB2 H 7.301 6.777 12.242 1.00 . A A . 33 LYS HB2 1 1 9 5076 1 1 33 LYS HB3 H 7.969 8.317 12.747 1.00 . A A . 33 LYS HB3 1 1 9 5077 1 1 33 LYS HD2 H 9.340 4.778 14.351 1.00 . A A . 33 LYS HD2 1 1 9 5078 1 1 33 LYS HD3 H 7.918 4.738 13.329 1.00 . A A . 33 LYS HD3 1 1 9 5079 1 1 33 LYS HE2 H 9.250 6.188 11.649 1.00 . A A . 33 LYS HE2 1 1 9 5080 1 1 33 LYS HE3 H 10.666 5.856 12.626 1.00 . A A . 33 LYS HE3 1 1 9 5081 1 1 33 LYS HG2 H 9.264 7.301 14.306 1.00 . A A . 33 LYS HG2 1 1 9 5082 1 1 33 LYS HG3 H 7.857 6.575 15.057 1.00 . A A . 33 LYS HG3 1 1 9 5083 1 1 33 LYS HZ1 H 10.781 4.043 11.277 1.00 . A A . 33 LYS HZ1 1 1 9 5084 1 1 33 LYS HZ2 H 9.693 3.384 12.294 1.00 . A A . 33 LYS HZ2 1 1 9 5085 1 1 33 LYS N N 6.347 8.594 14.940 1.00 . A A . 33 LYS N 1 1 9 5086 1 1 33 LYS NZ N 9.851 4.161 11.662 1.00 . A A . 33 LYS NZ 1 1 9 5087 1 1 33 LYS O O 5.600 5.446 13.756 1.00 . A A . 33 LYS O 1 1 9 5088 1 1 34 ASP C C 1.897 6.041 14.565 1.00 . A A . 34 ASP C 1 1 9 5089 1 1 34 ASP CA C 3.261 5.805 15.216 1.00 . A A . 34 ASP CA 1 1 9 5090 1 1 34 ASP CB C 3.067 5.805 16.733 1.00 . A A . 34 ASP CB 1 1 9 5091 1 1 34 ASP CG C 2.199 4.668 17.274 1.00 . A A . 34 ASP CG 1 1 9 5092 1 1 34 ASP H H 3.915 7.779 15.089 1.00 . A A . 34 ASP H 1 1 9 5093 1 1 34 ASP HA H 3.726 4.876 14.887 1.00 . A A . 34 ASP HA 1 1 9 5094 1 1 34 ASP HB2 H 4.046 5.753 17.210 1.00 . A A . 34 ASP HB2 1 1 9 5095 1 1 34 ASP HB3 H 2.620 6.755 17.028 1.00 . A A . 34 ASP HB3 1 1 9 5096 1 1 34 ASP HD2 H 3.183 3.193 16.640 1.00 . A A . 34 ASP HD2 1 1 9 5097 1 1 34 ASP N N 4.177 6.856 14.806 1.00 . A A . 34 ASP N 1 1 9 5098 1 1 34 ASP O O 1.292 5.113 14.030 1.00 . A A . 34 ASP O 1 1 9 5099 1 1 34 ASP OD1 O 0.985 4.830 17.472 1.00 . A A . 34 ASP OD1 1 1 9 5100 1 1 34 ASP OD2 O 2.825 3.562 17.498 1.00 . A A . 34 ASP OD2 1 1 9 5101 1 1 35 ALA C C 0.202 7.402 12.547 1.00 . A A . 35 ALA C 1 1 9 5102 1 1 35 ALA CA C 0.170 7.656 14.056 1.00 . A A . 35 ALA CA 1 1 9 5103 1 1 35 ALA CB C -0.141 9.116 14.395 1.00 . A A . 35 ALA CB 1 1 9 5104 1 1 35 ALA H H 1.950 8.036 15.070 1.00 . A A . 35 ALA H 1 1 9 5105 1 1 35 ALA HA H -0.592 7.021 14.506 1.00 . A A . 35 ALA HA 1 1 9 5106 1 1 35 ALA HB1 H 0.654 9.520 15.022 1.00 . A A . 35 ALA HB1 1 1 9 5107 1 1 35 ALA HB2 H -0.208 9.696 13.474 1.00 . A A . 35 ALA HB2 1 1 9 5108 1 1 35 ALA HB3 H -1.089 9.171 14.928 1.00 . A A . 35 ALA HB3 1 1 9 5109 1 1 35 ALA N N 1.452 7.287 14.632 1.00 . A A . 35 ALA N 1 1 9 5110 1 1 35 ALA O O -0.844 7.256 11.916 1.00 . A A . 35 ALA O 1 1 9 5111 1 1 36 PHE C C 1.043 5.756 10.184 1.00 . A A . 36 PHE C 1 1 9 5112 1 1 36 PHE CA C 1.596 7.123 10.589 1.00 . A A . 36 PHE CA 1 1 9 5113 1 1 36 PHE CB C 3.101 7.152 10.321 1.00 . A A . 36 PHE CB 1 1 9 5114 1 1 36 PHE CD1 C 3.958 9.302 11.277 1.00 . A A . 36 PHE CD1 1 1 9 5115 1 1 36 PHE CD2 C 3.918 9.070 8.934 1.00 . A A . 36 PHE CD2 1 1 9 5116 1 1 36 PHE CE1 C 4.495 10.609 11.140 1.00 . A A . 36 PHE CE1 1 1 9 5117 1 1 36 PHE CE2 C 4.456 10.377 8.795 1.00 . A A . 36 PHE CE2 1 1 9 5118 1 1 36 PHE CG C 3.681 8.560 10.172 1.00 . A A . 36 PHE CG 1 1 9 5119 1 1 36 PHE CZ C 4.733 11.119 9.901 1.00 . A A . 36 PHE CZ 1 1 9 5120 1 1 36 PHE H H 2.259 7.478 12.533 1.00 . A A . 36 PHE H 1 1 9 5121 1 1 36 PHE HA H 1.051 7.905 10.061 1.00 . A A . 36 PHE HA 1 1 9 5122 1 1 36 PHE HB2 H 3.616 6.643 11.136 1.00 . A A . 36 PHE HB2 1 1 9 5123 1 1 36 PHE HB3 H 3.309 6.587 9.412 1.00 . A A . 36 PHE HB3 1 1 9 5124 1 1 36 PHE HD1 H 3.768 8.893 12.270 1.00 . A A . 36 PHE HD1 1 1 9 5125 1 1 36 PHE HD2 H 3.696 8.475 8.048 1.00 . A A . 36 PHE HD2 1 1 9 5126 1 1 36 PHE HE1 H 4.718 11.204 12.025 1.00 . A A . 36 PHE HE1 1 1 9 5127 1 1 36 PHE HE2 H 4.646 10.786 7.802 1.00 . A A . 36 PHE HE2 1 1 9 5128 1 1 36 PHE HZ H 5.145 12.122 9.794 1.00 . A A . 36 PHE HZ 1 1 9 5129 1 1 36 PHE N N 1.413 7.357 12.013 1.00 . A A . 36 PHE N 1 1 9 5130 1 1 36 PHE O O 1.302 4.755 10.850 1.00 . A A . 36 PHE O 1 1 9 5131 1 1 37 GLU C C 0.394 4.094 7.299 1.00 . A A . 37 GLU C 1 1 9 5132 1 1 37 GLU CA C -0.301 4.529 8.591 1.00 . A A . 37 GLU CA 1 1 9 5133 1 1 37 GLU CB C -1.807 4.695 8.374 1.00 . A A . 37 GLU CB 1 1 9 5134 1 1 37 GLU CD C -2.188 2.405 9.359 1.00 . A A . 37 GLU CD 1 1 9 5135 1 1 37 GLU CG C -2.486 3.337 8.182 1.00 . A A . 37 GLU CG 1 1 9 5136 1 1 37 GLU H H 0.085 6.576 8.557 1.00 . A A . 37 GLU H 1 1 9 5137 1 1 37 GLU HA H -0.132 3.786 9.370 1.00 . A A . 37 GLU HA 1 1 9 5138 1 1 37 GLU HB2 H -2.246 5.208 9.228 1.00 . A A . 37 GLU HB2 1 1 9 5139 1 1 37 GLU HB3 H -1.985 5.320 7.499 1.00 . A A . 37 GLU HB3 1 1 9 5140 1 1 37 GLU HE2 H -2.723 2.061 11.131 1.00 . A A . 37 GLU HE2 1 1 9 5141 1 1 37 GLU HG2 H -3.563 3.475 8.087 1.00 . A A . 37 GLU HG2 1 1 9 5142 1 1 37 GLU HG3 H -2.139 2.880 7.255 1.00 . A A . 37 GLU HG3 1 1 9 5143 1 1 37 GLU N N 0.290 5.758 9.093 1.00 . A A . 37 GLU N 1 1 9 5144 1 1 37 GLU O O 0.733 4.929 6.460 1.00 . A A . 37 GLU O 1 1 9 5145 1 1 37 GLU OE1 O -1.119 1.777 9.397 1.00 . A A . 37 GLU OE1 1 1 9 5146 1 1 37 GLU OE2 O -3.114 2.346 10.256 1.00 . A A . 37 GLU OE2 1 1 9 5147 1 1 38 LYS C C 0.171 1.772 5.009 1.00 . A A . 38 LYS C 1 1 9 5148 1 1 38 LYS CA C 1.237 2.234 6.004 1.00 . A A . 38 LYS CA 1 1 9 5149 1 1 38 LYS CB C 2.222 1.133 6.406 1.00 . A A . 38 LYS CB 1 1 9 5150 1 1 38 LYS CD C 2.311 -0.629 4.604 1.00 . A A . 38 LYS CD 1 1 9 5151 1 1 38 LYS CE C 3.298 -1.794 4.501 1.00 . A A . 38 LYS CE 1 1 9 5152 1 1 38 LYS CG C 2.988 0.612 5.188 1.00 . A A . 38 LYS CG 1 1 9 5153 1 1 38 LYS H H 0.310 2.117 7.866 1.00 . A A . 38 LYS H 1 1 9 5154 1 1 38 LYS HA H 1.818 3.032 5.543 1.00 . A A . 38 LYS HA 1 1 9 5155 1 1 38 LYS HB2 H 2.923 1.518 7.145 1.00 . A A . 38 LYS HB2 1 1 9 5156 1 1 38 LYS HB3 H 1.682 0.312 6.878 1.00 . A A . 38 LYS HB3 1 1 9 5157 1 1 38 LYS HD2 H 1.467 -0.917 5.230 1.00 . A A . 38 LYS HD2 1 1 9 5158 1 1 38 LYS HD3 H 1.911 -0.398 3.616 1.00 . A A . 38 LYS HD3 1 1 9 5159 1 1 38 LYS HE2 H 4.100 -1.664 5.227 1.00 . A A . 38 LYS HE2 1 1 9 5160 1 1 38 LYS HE3 H 2.793 -2.728 4.747 1.00 . A A . 38 LYS HE3 1 1 9 5161 1 1 38 LYS HG2 H 3.044 1.392 4.429 1.00 . A A . 38 LYS HG2 1 1 9 5162 1 1 38 LYS HG3 H 4.012 0.371 5.475 1.00 . A A . 38 LYS HG3 1 1 9 5163 1 1 38 LYS HZ1 H 4.445 -1.072 2.918 1.00 . A A . 38 LYS HZ1 1 1 9 5164 1 1 38 LYS HZ2 H 4.444 -2.698 3.013 1.00 . A A . 38 LYS HZ2 1 1 9 5165 1 1 38 LYS N N 0.588 2.789 7.179 1.00 . A A . 38 LYS N 1 1 9 5166 1 1 38 LYS NZ N 3.865 -1.875 3.136 1.00 . A A . 38 LYS NZ 1 1 9 5167 1 1 38 LYS O O -0.222 0.606 5.010 1.00 . A A . 38 LYS O 1 1 9 5168 1 1 39 GLN C C -0.674 2.481 1.778 1.00 . A A . 39 GLN C 1 1 9 5169 1 1 39 GLN CA C -1.278 2.415 3.182 1.00 . A A . 39 GLN CA 1 1 9 5170 1 1 39 GLN CB C -2.470 3.366 3.311 1.00 . A A . 39 GLN CB 1 1 9 5171 1 1 39 GLN CD C -4.562 3.881 2.000 1.00 . A A . 39 GLN CD 1 1 9 5172 1 1 39 GLN CG C -3.714 2.780 2.641 1.00 . A A . 39 GLN CG 1 1 9 5173 1 1 39 GLN H H 0.060 3.656 4.187 1.00 . A A . 39 GLN H 1 1 9 5174 1 1 39 GLN HA H -1.608 1.398 3.395 1.00 . A A . 39 GLN HA 1 1 9 5175 1 1 39 GLN HB2 H -2.675 3.555 4.365 1.00 . A A . 39 GLN HB2 1 1 9 5176 1 1 39 GLN HB3 H -2.225 4.325 2.856 1.00 . A A . 39 GLN HB3 1 1 9 5177 1 1 39 GLN HE21 H -5.624 3.997 3.720 1.00 . A A . 39 GLN HE21 1 1 9 5178 1 1 39 GLN HE22 H -6.122 5.083 2.466 1.00 . A A . 39 GLN HE22 1 1 9 5179 1 1 39 GLN HG2 H -3.416 2.057 1.880 1.00 . A A . 39 GLN HG2 1 1 9 5180 1 1 39 GLN HG3 H -4.309 2.239 3.377 1.00 . A A . 39 GLN HG3 1 1 9 5181 1 1 39 GLN N N -0.266 2.710 4.181 1.00 . A A . 39 GLN N 1 1 9 5182 1 1 39 GLN NE2 N -5.514 4.360 2.795 1.00 . A A . 39 GLN NE2 1 1 9 5183 1 1 39 GLN O O 0.438 2.005 1.554 1.00 . A A . 39 GLN O 1 1 9 5184 1 1 39 GLN OE1 O -4.364 4.269 0.860 1.00 . A A . 39 GLN OE1 1 1 10 5185 1 1 1 MET C C 5.038 2.332 -2.352 1.00 . A A . 1 MET C 1 1 10 5186 1 1 1 MET CA C 6.051 2.124 -3.479 1.00 . A A . 1 MET CA 1 1 10 5187 1 1 1 MET CB C 6.584 0.690 -3.427 1.00 . A A . 1 MET CB 1 1 10 5188 1 1 1 MET CE C 5.222 -2.754 -4.131 1.00 . A A . 1 MET CE 1 1 10 5189 1 1 1 MET CG C 5.981 -0.160 -4.547 1.00 . A A . 1 MET CG 1 1 10 5190 1 1 1 MET H1 H 7.134 3.644 -2.555 1.00 . A A . 1 MET H1 1 1 10 5191 1 1 1 MET HA H 5.584 2.339 -4.441 1.00 . A A . 1 MET HA 1 1 10 5192 1 1 1 MET HB2 H 7.671 0.700 -3.518 1.00 . A A . 1 MET HB2 1 1 10 5193 1 1 1 MET HB3 H 6.349 0.246 -2.460 1.00 . A A . 1 MET HB3 1 1 10 5194 1 1 1 MET HE1 H 5.756 -2.824 -5.079 1.00 . A A . 1 MET HE1 1 1 10 5195 1 1 1 MET HE2 H 5.900 -2.992 -3.312 1.00 . A A . 1 MET HE2 1 1 10 5196 1 1 1 MET HE3 H 4.391 -3.459 -4.131 1.00 . A A . 1 MET HE3 1 1 10 5197 1 1 1 MET HG2 H 5.659 0.480 -5.368 1.00 . A A . 1 MET HG2 1 1 10 5198 1 1 1 MET HG3 H 6.737 -0.837 -4.948 1.00 . A A . 1 MET HG3 1 1 10 5199 1 1 1 MET N N 7.158 3.058 -3.365 1.00 . A A . 1 MET N 1 1 10 5200 1 1 1 MET O O 3.840 2.455 -2.602 1.00 . A A . 1 MET O 1 1 10 5201 1 1 1 MET SD S 4.595 -1.096 -3.923 1.00 . A A . 1 MET SD 1 1 10 5202 1 1 2 ASP C C 4.596 4.055 0.333 1.00 . A A . 2 ASP C 1 1 10 5203 1 1 2 ASP CA C 4.713 2.559 0.034 1.00 . A A . 2 ASP CA 1 1 10 5204 1 1 2 ASP CB C 5.313 1.877 1.266 1.00 . A A . 2 ASP CB 1 1 10 5205 1 1 2 ASP CG C 4.316 1.088 2.117 1.00 . A A . 2 ASP CG 1 1 10 5206 1 1 2 ASP H H 6.532 2.266 -0.937 1.00 . A A . 2 ASP H 1 1 10 5207 1 1 2 ASP HA H 3.755 2.109 -0.228 1.00 . A A . 2 ASP HA 1 1 10 5208 1 1 2 ASP HB2 H 6.104 1.202 0.940 1.00 . A A . 2 ASP HB2 1 1 10 5209 1 1 2 ASP HB3 H 5.780 2.638 1.892 1.00 . A A . 2 ASP HB3 1 1 10 5210 1 1 2 ASP HD2 H 4.191 0.061 3.691 1.00 . A A . 2 ASP HD2 1 1 10 5211 1 1 2 ASP N N 5.557 2.366 -1.133 1.00 . A A . 2 ASP N 1 1 10 5212 1 1 2 ASP O O 5.409 4.850 -0.135 1.00 . A A . 2 ASP O 1 1 10 5213 1 1 2 ASP OD1 O 3.220 0.735 1.657 1.00 . A A . 2 ASP OD1 1 1 10 5214 1 1 2 ASP OD2 O 4.710 0.831 3.319 1.00 . A A . 2 ASP OD2 1 1 10 5215 1 1 3 ILE C C 3.021 5.860 2.968 1.00 . A A . 3 ILE C 1 1 10 5216 1 1 3 ILE CA C 3.340 5.778 1.474 1.00 . A A . 3 ILE CA 1 1 10 5217 1 1 3 ILE CB C 2.261 6.393 0.581 1.00 . A A . 3 ILE CB 1 1 10 5218 1 1 3 ILE CD1 C 1.630 5.596 -1.728 1.00 . A A . 3 ILE CD1 1 1 10 5219 1 1 3 ILE CG1 C 2.674 6.341 -0.892 1.00 . A A . 3 ILE CG1 1 1 10 5220 1 1 3 ILE CG2 C 1.922 7.816 1.030 1.00 . A A . 3 ILE CG2 1 1 10 5221 1 1 3 ILE H H 2.918 3.739 1.484 1.00 . A A . 3 ILE H 1 1 10 5222 1 1 3 ILE HA H 4.264 6.326 1.288 1.00 . A A . 3 ILE HA 1 1 10 5223 1 1 3 ILE HB H 1.354 5.799 0.682 1.00 . A A . 3 ILE HB 1 1 10 5224 1 1 3 ILE HD11 H 0.665 5.637 -1.223 1.00 . A A . 3 ILE HD11 1 1 10 5225 1 1 3 ILE HD12 H 1.547 6.065 -2.708 1.00 . A A . 3 ILE HD12 1 1 10 5226 1 1 3 ILE HD13 H 1.935 4.556 -1.847 1.00 . A A . 3 ILE HD13 1 1 10 5227 1 1 3 ILE HG12 H 2.797 7.354 -1.276 1.00 . A A . 3 ILE HG12 1 1 10 5228 1 1 3 ILE HG13 H 3.640 5.845 -0.986 1.00 . A A . 3 ILE HG13 1 1 10 5229 1 1 3 ILE HG21 H 0.863 8.008 0.859 1.00 . A A . 3 ILE HG21 1 1 10 5230 1 1 3 ILE HG22 H 2.145 7.924 2.091 1.00 . A A . 3 ILE HG22 1 1 10 5231 1 1 3 ILE HG23 H 2.517 8.530 0.459 1.00 . A A . 3 ILE HG23 1 1 10 5232 1 1 3 ILE N N 3.576 4.392 1.108 1.00 . A A . 3 ILE N 1 1 10 5233 1 1 3 ILE O O 2.238 5.086 3.512 1.00 . A A . 3 ILE O 1 1 10 5234 1 1 4 TYR C C 2.793 8.386 5.288 1.00 . A A . 4 TYR C 1 1 10 5235 1 1 4 TYR CA C 3.463 7.040 5.049 1.00 . A A . 4 TYR CA 1 1 10 5236 1 1 4 TYR CB C 4.813 6.975 5.759 1.00 . A A . 4 TYR CB 1 1 10 5237 1 1 4 TYR CD1 C 4.931 4.484 5.393 1.00 . A A . 4 TYR CD1 1 1 10 5238 1 1 4 TYR CD2 C 5.788 5.400 7.469 1.00 . A A . 4 TYR CD2 1 1 10 5239 1 1 4 TYR CE1 C 5.277 3.196 5.818 1.00 . A A . 4 TYR CE1 1 1 10 5240 1 1 4 TYR CE2 C 6.133 4.111 7.894 1.00 . A A . 4 TYR CE2 1 1 10 5241 1 1 4 TYR CG C 5.187 5.585 6.217 1.00 . A A . 4 TYR CG 1 1 10 5242 1 1 4 TYR CZ C 5.879 3.010 7.069 1.00 . A A . 4 TYR CZ 1 1 10 5243 1 1 4 TYR H H 4.291 7.443 3.135 1.00 . A A . 4 TYR H 1 1 10 5244 1 1 4 TYR HA H 2.820 6.251 5.440 1.00 . A A . 4 TYR HA 1 1 10 5245 1 1 4 TYR HB2 H 5.583 7.334 5.077 1.00 . A A . 4 TYR HB2 1 1 10 5246 1 1 4 TYR HB3 H 4.781 7.632 6.628 1.00 . A A . 4 TYR HB3 1 1 10 5247 1 1 4 TYR HD1 H 4.467 4.627 4.429 1.00 . A A . 4 TYR HD1 1 1 10 5248 1 1 4 TYR HD2 H 5.985 6.250 8.105 1.00 . A A . 4 TYR HD2 1 1 10 5249 1 1 4 TYR HE1 H 5.080 2.346 5.182 1.00 . A A . 4 TYR HE1 1 1 10 5250 1 1 4 TYR HE2 H 6.597 3.968 8.858 1.00 . A A . 4 TYR HE2 1 1 10 5251 1 1 4 TYR HH H 6.258 1.121 6.765 1.00 . A A . 4 TYR HH 1 1 10 5252 1 1 4 TYR N N 3.656 6.831 3.629 1.00 . A A . 4 TYR N 1 1 10 5253 1 1 4 TYR O O 3.490 9.352 5.591 1.00 . A A . 4 TYR O 1 1 10 5254 1 1 4 TYR OH O 6.216 1.754 7.484 1.00 . A A . 4 TYR OH 1 1 10 5255 1 1 5 VAL C C 0.398 9.805 6.839 1.00 . A A . 5 VAL C 1 1 10 5256 1 1 5 VAL CA C 0.739 9.660 5.354 1.00 . A A . 5 VAL CA 1 1 10 5257 1 1 5 VAL CB C -0.498 9.686 4.452 1.00 . A A . 5 VAL CB 1 1 10 5258 1 1 5 VAL CG1 C -1.392 10.883 4.784 1.00 . A A . 5 VAL CG1 1 1 10 5259 1 1 5 VAL CG2 C -0.100 9.693 2.976 1.00 . A A . 5 VAL CG2 1 1 10 5260 1 1 5 VAL H H 0.915 7.634 4.901 1.00 . A A . 5 VAL H 1 1 10 5261 1 1 5 VAL HA H 1.388 10.483 5.060 1.00 . A A . 5 VAL HA 1 1 10 5262 1 1 5 VAL HB H -1.070 8.778 4.641 1.00 . A A . 5 VAL HB 1 1 10 5263 1 1 5 VAL HG11 H -1.653 11.408 3.865 1.00 . A A . 5 VAL HG11 1 1 10 5264 1 1 5 VAL HG12 H -2.302 10.532 5.272 1.00 . A A . 5 VAL HG12 1 1 10 5265 1 1 5 VAL HG13 H -0.860 11.561 5.452 1.00 . A A . 5 VAL HG13 1 1 10 5266 1 1 5 VAL HG21 H -0.095 8.671 2.596 1.00 . A A . 5 VAL HG21 1 1 10 5267 1 1 5 VAL HG22 H -0.815 10.287 2.408 1.00 . A A . 5 VAL HG22 1 1 10 5268 1 1 5 VAL HG23 H 0.896 10.124 2.869 1.00 . A A . 5 VAL HG23 1 1 10 5269 1 1 5 VAL N N 1.476 8.424 5.149 1.00 . A A . 5 VAL N 1 1 10 5270 1 1 5 VAL O O -0.310 8.972 7.401 1.00 . A A . 5 VAL O 1 1 10 5271 1 1 6 CYS C C -0.828 11.262 9.055 1.00 . A A . 6 CYS C 1 1 10 5272 1 1 6 CYS CA C 0.681 11.135 8.839 1.00 . A A . 6 CYS CA 1 1 10 5273 1 1 6 CYS CB C 1.432 12.379 9.315 1.00 . A A . 6 CYS CB 1 1 10 5274 1 1 6 CYS H H 1.495 11.542 6.966 1.00 . A A . 6 CYS H 1 1 10 5275 1 1 6 CYS HA H 1.080 10.283 9.390 1.00 . A A . 6 CYS HA 1 1 10 5276 1 1 6 CYS HB2 H 2.449 12.346 8.923 1.00 . A A . 6 CYS HB2 1 1 10 5277 1 1 6 CYS HB3 H 0.955 13.260 8.889 1.00 . A A . 6 CYS HB3 1 1 10 5278 1 1 6 CYS N N 0.920 10.869 7.430 1.00 . A A . 6 CYS N 1 1 10 5279 1 1 6 CYS O O -1.554 11.681 8.154 1.00 . A A . 6 CYS O 1 1 10 5280 1 1 6 CYS SG S 1.513 12.578 11.133 1.00 . A A . 6 CYS SG 1 1 10 5281 1 1 7 THR C C -2.914 12.081 11.609 1.00 . A A . 7 THR C 1 1 10 5282 1 1 7 THR CA C -2.666 10.961 10.598 1.00 . A A . 7 THR CA 1 1 10 5283 1 1 7 THR CB C -3.096 9.582 11.101 1.00 . A A . 7 THR CB 1 1 10 5284 1 1 7 THR CG2 C -2.965 8.499 10.028 1.00 . A A . 7 THR CG2 1 1 10 5285 1 1 7 THR H H -0.658 10.554 10.980 1.00 . A A . 7 THR H 1 1 10 5286 1 1 7 THR HA H -3.228 11.212 9.699 1.00 . A A . 7 THR HA 1 1 10 5287 1 1 7 THR HB H -4.109 9.612 11.501 1.00 . A A . 7 THR HB 1 1 10 5288 1 1 7 THR HG1 H -2.155 9.861 12.845 1.00 . A A . 7 THR HG1 1 1 10 5289 1 1 7 THR HG21 H -2.976 7.517 10.499 1.00 . A A . 7 THR HG21 1 1 10 5290 1 1 7 THR HG22 H -3.797 8.577 9.329 1.00 . A A . 7 THR HG22 1 1 10 5291 1 1 7 THR HG23 H -2.025 8.634 9.490 1.00 . A A . 7 THR HG23 1 1 10 5292 1 1 7 THR N N -1.256 10.893 10.253 1.00 . A A . 7 THR N 1 1 10 5293 1 1 7 THR O O -3.956 12.113 12.263 1.00 . A A . 7 THR O 1 1 10 5294 1 1 7 THR OG1 O -2.103 9.238 12.065 1.00 . A A . 7 THR OG1 1 1 10 5295 1 1 8 VAL C C -2.159 15.394 11.832 1.00 . A A . 8 VAL C 1 1 10 5296 1 1 8 VAL CA C -2.039 14.093 12.629 1.00 . A A . 8 VAL CA 1 1 10 5297 1 1 8 VAL CB C -0.847 14.088 13.589 1.00 . A A . 8 VAL CB 1 1 10 5298 1 1 8 VAL CG1 C -0.852 15.335 14.475 1.00 . A A . 8 VAL CG1 1 1 10 5299 1 1 8 VAL CG2 C -0.830 12.814 14.435 1.00 . A A . 8 VAL CG2 1 1 10 5300 1 1 8 VAL H H -1.095 12.940 11.173 1.00 . A A . 8 VAL H 1 1 10 5301 1 1 8 VAL HA H -2.946 13.955 13.216 1.00 . A A . 8 VAL HA 1 1 10 5302 1 1 8 VAL HB H 0.065 14.105 12.991 1.00 . A A . 8 VAL HB 1 1 10 5303 1 1 8 VAL HG11 H -0.417 16.172 13.928 1.00 . A A . 8 VAL HG11 1 1 10 5304 1 1 8 VAL HG12 H -1.878 15.578 14.754 1.00 . A A . 8 VAL HG12 1 1 10 5305 1 1 8 VAL HG13 H -0.266 15.145 15.374 1.00 . A A . 8 VAL HG13 1 1 10 5306 1 1 8 VAL HG21 H -0.057 12.896 15.200 1.00 . A A . 8 VAL HG21 1 1 10 5307 1 1 8 VAL HG22 H -1.801 12.682 14.912 1.00 . A A . 8 VAL HG22 1 1 10 5308 1 1 8 VAL HG23 H -0.620 11.956 13.796 1.00 . A A . 8 VAL HG23 1 1 10 5309 1 1 8 VAL N N -1.939 12.973 11.708 1.00 . A A . 8 VAL N 1 1 10 5310 1 1 8 VAL O O -3.088 16.172 12.045 1.00 . A A . 8 VAL O 1 1 10 5311 1 1 9 CYS C C -1.562 16.378 8.673 1.00 . A A . 9 CYS C 1 1 10 5312 1 1 9 CYS CA C -1.196 16.783 10.103 1.00 . A A . 9 CYS CA 1 1 10 5313 1 1 9 CYS CB C 0.153 17.502 10.165 1.00 . A A . 9 CYS CB 1 1 10 5314 1 1 9 CYS H H -0.456 14.952 10.765 1.00 . A A . 9 CYS H 1 1 10 5315 1 1 9 CYS HA H -1.944 17.459 10.517 1.00 . A A . 9 CYS HA 1 1 10 5316 1 1 9 CYS HB2 H 0.275 18.096 9.259 1.00 . A A . 9 CYS HB2 1 1 10 5317 1 1 9 CYS HB3 H 0.139 18.199 11.003 1.00 . A A . 9 CYS HB3 1 1 10 5318 1 1 9 CYS N N -1.207 15.590 10.932 1.00 . A A . 9 CYS N 1 1 10 5319 1 1 9 CYS O O -1.975 17.217 7.873 1.00 . A A . 9 CYS O 1 1 10 5320 1 1 9 CYS SG S 1.603 16.400 10.344 1.00 . A A . 9 CYS SG 1 1 10 5321 1 1 10 GLY C C -0.456 14.548 6.190 1.00 . A A . 10 GLY C 1 1 10 5322 1 1 10 GLY CA C -1.703 14.567 7.076 1.00 . A A . 10 GLY CA 1 1 10 5323 1 1 10 GLY H H -1.059 14.418 9.052 1.00 . A A . 10 GLY H 1 1 10 5324 1 1 10 GLY HA2 H -2.104 13.558 7.168 1.00 . A A . 10 GLY HA2 1 1 10 5325 1 1 10 GLY HA3 H -2.476 15.177 6.609 1.00 . A A . 10 GLY HA3 1 1 10 5326 1 1 10 GLY N N -1.396 15.094 8.395 1.00 . A A . 10 GLY N 1 1 10 5327 1 1 10 GLY O O -0.514 14.306 4.986 1.00 . A A . 10 GLY O 1 1 10 5328 1 1 11 TYR C C 2.005 13.708 5.100 1.00 . A A . 11 TYR C 1 1 10 5329 1 1 11 TYR CA C 1.959 14.833 6.123 1.00 . A A . 11 TYR CA 1 1 10 5330 1 1 11 TYR CB C 3.096 14.694 7.132 1.00 . A A . 11 TYR CB 1 1 10 5331 1 1 11 TYR CD1 C 4.707 15.899 5.613 1.00 . A A . 11 TYR CD1 1 1 10 5332 1 1 11 TYR CD2 C 5.497 13.978 6.865 1.00 . A A . 11 TYR CD2 1 1 10 5333 1 1 11 TYR CE1 C 5.979 16.053 5.047 1.00 . A A . 11 TYR CE1 1 1 10 5334 1 1 11 TYR CE2 C 6.768 14.132 6.299 1.00 . A A . 11 TYR CE2 1 1 10 5335 1 1 11 TYR CG C 4.467 14.861 6.522 1.00 . A A . 11 TYR CG 1 1 10 5336 1 1 11 TYR CZ C 7.009 15.170 5.390 1.00 . A A . 11 TYR CZ 1 1 10 5337 1 1 11 TYR H H 0.684 15.004 7.813 1.00 . A A . 11 TYR H 1 1 10 5338 1 1 11 TYR HA H 2.061 15.787 5.604 1.00 . A A . 11 TYR HA 1 1 10 5339 1 1 11 TYR HB2 H 2.966 15.448 7.908 1.00 . A A . 11 TYR HB2 1 1 10 5340 1 1 11 TYR HB3 H 3.036 13.707 7.589 1.00 . A A . 11 TYR HB3 1 1 10 5341 1 1 11 TYR HD1 H 3.912 16.580 5.348 1.00 . A A . 11 TYR HD1 1 1 10 5342 1 1 11 TYR HD2 H 5.313 13.179 7.567 1.00 . A A . 11 TYR HD2 1 1 10 5343 1 1 11 TYR HE1 H 6.163 16.852 4.345 1.00 . A A . 11 TYR HE1 1 1 10 5344 1 1 11 TYR HE2 H 7.564 13.452 6.563 1.00 . A A . 11 TYR HE2 1 1 10 5345 1 1 11 TYR HH H 8.847 14.604 5.061 1.00 . A A . 11 TYR HH 1 1 10 5346 1 1 11 TYR N N 0.690 14.812 6.822 1.00 . A A . 11 TYR N 1 1 10 5347 1 1 11 TYR O O 1.395 12.666 5.335 1.00 . A A . 11 TYR O 1 1 10 5348 1 1 11 TYR OH O 8.248 15.320 4.839 1.00 . A A . 11 TYR OH 1 1 10 5349 1 1 12 GLU C C 4.286 12.533 2.752 1.00 . A A . 12 GLU C 1 1 10 5350 1 1 12 GLU CA C 2.822 12.921 2.963 1.00 . A A . 12 GLU CA 1 1 10 5351 1 1 12 GLU CB C 2.189 13.408 1.658 1.00 . A A . 12 GLU CB 1 1 10 5352 1 1 12 GLU CD C 0.762 11.541 0.743 1.00 . A A . 12 GLU CD 1 1 10 5353 1 1 12 GLU CG C 0.766 12.869 1.504 1.00 . A A . 12 GLU CG 1 1 10 5354 1 1 12 GLU H H 3.206 14.782 3.819 1.00 . A A . 12 GLU H 1 1 10 5355 1 1 12 GLU HA H 2.261 12.063 3.334 1.00 . A A . 12 GLU HA 1 1 10 5356 1 1 12 GLU HB2 H 2.173 14.498 1.642 1.00 . A A . 12 GLU HB2 1 1 10 5357 1 1 12 GLU HB3 H 2.797 13.086 0.813 1.00 . A A . 12 GLU HB3 1 1 10 5358 1 1 12 GLU HE2 H -0.125 11.503 -0.918 1.00 . A A . 12 GLU HE2 1 1 10 5359 1 1 12 GLU HG2 H 0.317 12.730 2.487 1.00 . A A . 12 GLU HG2 1 1 10 5360 1 1 12 GLU HG3 H 0.152 13.597 0.975 1.00 . A A . 12 GLU HG3 1 1 10 5361 1 1 12 GLU N N 2.712 13.931 4.003 1.00 . A A . 12 GLU N 1 1 10 5362 1 1 12 GLU O O 5.117 13.329 2.321 1.00 . A A . 12 GLU O 1 1 10 5363 1 1 12 GLU OE1 O 1.735 10.778 0.825 1.00 . A A . 12 GLU OE1 1 1 10 5364 1 1 12 GLU OE2 O -0.301 11.315 0.049 1.00 . A A . 12 GLU OE2 1 1 10 5365 1 1 13 TYR C C 5.908 9.488 2.077 1.00 . A A . 13 TYR C 1 1 10 5366 1 1 13 TYR CA C 5.931 10.750 2.928 1.00 . A A . 13 TYR CA 1 1 10 5367 1 1 13 TYR CB C 6.510 10.459 4.310 1.00 . A A . 13 TYR CB 1 1 10 5368 1 1 13 TYR CD1 C 8.960 10.919 3.937 1.00 . A A . 13 TYR CD1 1 1 10 5369 1 1 13 TYR CD2 C 8.279 8.685 4.588 1.00 . A A . 13 TYR CD2 1 1 10 5370 1 1 13 TYR CE1 C 10.296 10.503 3.905 1.00 . A A . 13 TYR CE1 1 1 10 5371 1 1 13 TYR CE2 C 9.616 8.269 4.557 1.00 . A A . 13 TYR CE2 1 1 10 5372 1 1 13 TYR CG C 7.952 10.010 4.278 1.00 . A A . 13 TYR CG 1 1 10 5373 1 1 13 TYR CZ C 10.625 9.178 4.216 1.00 . A A . 13 TYR CZ 1 1 10 5374 1 1 13 TYR H H 3.867 10.657 3.421 1.00 . A A . 13 TYR H 1 1 10 5375 1 1 13 TYR HA H 6.552 11.497 2.435 1.00 . A A . 13 TYR HA 1 1 10 5376 1 1 13 TYR HB2 H 6.441 11.363 4.915 1.00 . A A . 13 TYR HB2 1 1 10 5377 1 1 13 TYR HB3 H 5.914 9.677 4.781 1.00 . A A . 13 TYR HB3 1 1 10 5378 1 1 13 TYR HD1 H 8.707 11.942 3.698 1.00 . A A . 13 TYR HD1 1 1 10 5379 1 1 13 TYR HD2 H 7.502 7.983 4.851 1.00 . A A . 13 TYR HD2 1 1 10 5380 1 1 13 TYR HE1 H 11.074 11.204 3.642 1.00 . A A . 13 TYR HE1 1 1 10 5381 1 1 13 TYR HE2 H 9.869 7.246 4.797 1.00 . A A . 13 TYR HE2 1 1 10 5382 1 1 13 TYR HH H 12.526 9.405 4.586 1.00 . A A . 13 TYR HH 1 1 10 5383 1 1 13 TYR N N 4.587 11.272 3.070 1.00 . A A . 13 TYR N 1 1 10 5384 1 1 13 TYR O O 4.843 8.888 1.932 1.00 . A A . 13 TYR O 1 1 10 5385 1 1 13 TYR OH O 11.927 8.772 4.185 1.00 . A A . 13 TYR OH 1 1 10 5386 1 1 14 ASP C C 8.362 7.100 1.133 1.00 . A A . 14 ASP C 1 1 10 5387 1 1 14 ASP CA C 7.146 7.925 0.708 1.00 . A A . 14 ASP CA 1 1 10 5388 1 1 14 ASP CB C 7.316 8.293 -0.767 1.00 . A A . 14 ASP CB 1 1 10 5389 1 1 14 ASP CG C 6.825 7.236 -1.758 1.00 . A A . 14 ASP CG 1 1 10 5390 1 1 14 ASP H H 7.919 9.608 1.661 1.00 . A A . 14 ASP H 1 1 10 5391 1 1 14 ASP HA H 6.207 7.395 0.868 1.00 . A A . 14 ASP HA 1 1 10 5392 1 1 14 ASP HB2 H 6.783 9.224 -0.957 1.00 . A A . 14 ASP HB2 1 1 10 5393 1 1 14 ASP HB3 H 8.372 8.486 -0.957 1.00 . A A . 14 ASP HB3 1 1 10 5394 1 1 14 ASP HD2 H 4.960 7.125 -1.997 1.00 . A A . 14 ASP HD2 1 1 10 5395 1 1 14 ASP N N 7.060 9.114 1.539 1.00 . A A . 14 ASP N 1 1 10 5396 1 1 14 ASP O O 9.472 7.268 0.634 1.00 . A A . 14 ASP O 1 1 10 5397 1 1 14 ASP OD1 O 7.428 6.163 -1.898 1.00 . A A . 14 ASP OD1 1 1 10 5398 1 1 14 ASP OD2 O 5.761 7.557 -2.413 1.00 . A A . 14 ASP OD2 1 1 10 5399 1 1 15 PRO C C 10.117 4.916 1.541 1.00 . A A . 15 PRO C 1 1 10 5400 1 1 15 PRO CA C 9.126 5.302 2.630 1.00 . A A . 15 PRO CA 1 1 10 5401 1 1 15 PRO CB C 8.345 4.084 3.116 1.00 . A A . 15 PRO CB 1 1 10 5402 1 1 15 PRO CD C 6.832 5.966 2.691 1.00 . A A . 15 PRO CD 1 1 10 5403 1 1 15 PRO CG C 7.047 4.800 3.654 1.00 . A A . 15 PRO CG 1 1 10 5404 1 1 15 PRO HA H 9.653 5.771 3.460 1.00 . A A . 15 PRO HA 1 1 10 5405 1 1 15 PRO HB2 H 8.167 3.361 2.320 1.00 . A A . 15 PRO HB2 1 1 10 5406 1 1 15 PRO HB3 H 8.882 3.621 3.945 1.00 . A A . 15 PRO HB3 1 1 10 5407 1 1 15 PRO HD2 H 6.074 5.720 1.946 1.00 . A A . 15 PRO HD2 1 1 10 5408 1 1 15 PRO HD3 H 6.540 6.856 3.249 1.00 . A A . 15 PRO HD3 1 1 10 5409 1 1 15 PRO HG2 H 6.260 4.061 3.504 1.00 . A A . 15 PRO HG2 1 1 10 5410 1 1 15 PRO HG3 H 7.081 5.122 4.694 1.00 . A A . 15 PRO HG3 1 1 10 5411 1 1 15 PRO N N 8.124 6.190 2.082 1.00 . A A . 15 PRO N 1 1 10 5412 1 1 15 PRO O O 9.745 4.169 0.637 1.00 . A A . 15 PRO O 1 1 10 5413 1 1 16 ALA C C 13.597 5.971 0.926 1.00 . A A . 16 ALA C 1 1 10 5414 1 1 16 ALA CA C 12.358 5.117 0.654 1.00 . A A . 16 ALA CA 1 1 10 5415 1 1 16 ALA CB C 11.793 5.340 -0.750 1.00 . A A . 16 ALA CB 1 1 10 5416 1 1 16 ALA H H 11.632 6.028 2.381 1.00 . A A . 16 ALA H 1 1 10 5417 1 1 16 ALA HA H 12.622 4.065 0.763 1.00 . A A . 16 ALA HA 1 1 10 5418 1 1 16 ALA HB1 H 12.593 5.657 -1.418 1.00 . A A . 16 ALA HB1 1 1 10 5419 1 1 16 ALA HB2 H 11.358 4.411 -1.119 1.00 . A A . 16 ALA HB2 1 1 10 5420 1 1 16 ALA HB3 H 11.024 6.111 -0.713 1.00 . A A . 16 ALA HB3 1 1 10 5421 1 1 16 ALA N N 11.337 5.421 1.643 1.00 . A A . 16 ALA N 1 1 10 5422 1 1 16 ALA O O 13.913 6.876 0.155 1.00 . A A . 16 ALA O 1 1 10 5423 1 1 17 PHE C C 16.519 5.438 2.984 1.00 . A A . 17 PHE C 1 1 10 5424 1 1 17 PHE CA C 15.463 6.383 2.408 1.00 . A A . 17 PHE CA 1 1 10 5425 1 1 17 PHE CB C 15.051 7.386 3.489 1.00 . A A . 17 PHE CB 1 1 10 5426 1 1 17 PHE CD1 C 14.072 9.184 2.046 1.00 . A A . 17 PHE CD1 1 1 10 5427 1 1 17 PHE CD2 C 15.818 9.769 3.515 1.00 . A A . 17 PHE CD2 1 1 10 5428 1 1 17 PHE CE1 C 14.006 10.527 1.591 1.00 . A A . 17 PHE CE1 1 1 10 5429 1 1 17 PHE CE2 C 15.751 11.112 3.061 1.00 . A A . 17 PHE CE2 1 1 10 5430 1 1 17 PHE CG C 14.978 8.833 2.998 1.00 . A A . 17 PHE CG 1 1 10 5431 1 1 17 PHE CZ C 14.846 11.463 2.108 1.00 . A A . 17 PHE CZ 1 1 10 5432 1 1 17 PHE H H 14.003 4.918 2.647 1.00 . A A . 17 PHE H 1 1 10 5433 1 1 17 PHE HA H 15.856 6.858 1.509 1.00 . A A . 17 PHE HA 1 1 10 5434 1 1 17 PHE HB2 H 14.077 7.097 3.885 1.00 . A A . 17 PHE HB2 1 1 10 5435 1 1 17 PHE HB3 H 15.760 7.328 4.314 1.00 . A A . 17 PHE HB3 1 1 10 5436 1 1 17 PHE HD1 H 13.399 8.433 1.632 1.00 . A A . 17 PHE HD1 1 1 10 5437 1 1 17 PHE HD2 H 16.544 9.488 4.279 1.00 . A A . 17 PHE HD2 1 1 10 5438 1 1 17 PHE HE1 H 13.280 10.808 0.827 1.00 . A A . 17 PHE HE1 1 1 10 5439 1 1 17 PHE HE2 H 16.424 11.863 3.475 1.00 . A A . 17 PHE HE2 1 1 10 5440 1 1 17 PHE HZ H 14.793 12.495 1.759 1.00 . A A . 17 PHE HZ 1 1 10 5441 1 1 17 PHE N N 14.266 5.655 2.025 1.00 . A A . 17 PHE N 1 1 10 5442 1 1 17 PHE O O 16.404 4.220 2.856 1.00 . A A . 17 PHE O 1 1 10 5443 1 1 18 GLU C C 18.666 5.514 5.709 1.00 . A A . 18 GLU C 1 1 10 5444 1 1 18 GLU CA C 18.601 5.261 4.202 1.00 . A A . 18 GLU CA 1 1 10 5445 1 1 18 GLU CB C 19.941 5.579 3.535 1.00 . A A . 18 GLU CB 1 1 10 5446 1 1 18 GLU CD C 22.336 4.854 3.848 1.00 . A A . 18 GLU CD 1 1 10 5447 1 1 18 GLU CG C 20.896 4.388 3.624 1.00 . A A . 18 GLU CG 1 1 10 5448 1 1 18 GLU H H 17.613 7.025 3.707 1.00 . A A . 18 GLU H 1 1 10 5449 1 1 18 GLU HA H 18.348 4.218 4.013 1.00 . A A . 18 GLU HA 1 1 10 5450 1 1 18 GLU HB2 H 19.777 5.842 2.490 1.00 . A A . 18 GLU HB2 1 1 10 5451 1 1 18 GLU HB3 H 20.393 6.448 4.015 1.00 . A A . 18 GLU HB3 1 1 10 5452 1 1 18 GLU HE2 H 23.448 3.354 4.097 1.00 . A A . 18 GLU HE2 1 1 10 5453 1 1 18 GLU HG2 H 20.590 3.732 4.440 1.00 . A A . 18 GLU HG2 1 1 10 5454 1 1 18 GLU HG3 H 20.838 3.801 2.707 1.00 . A A . 18 GLU HG3 1 1 10 5455 1 1 18 GLU N N 17.526 6.034 3.606 1.00 . A A . 18 GLU N 1 1 10 5456 1 1 18 GLU O O 18.632 4.573 6.502 1.00 . A A . 18 GLU O 1 1 10 5457 1 1 18 GLU OE1 O 22.557 5.933 4.418 1.00 . A A . 18 GLU OE1 1 1 10 5458 1 1 18 GLU OE2 O 23.244 4.050 3.408 1.00 . A A . 18 GLU OE2 1 1 10 5459 1 1 19 ASP C C 17.418 7.162 8.057 1.00 . A A . 19 ASP C 1 1 10 5460 1 1 19 ASP CA C 18.827 7.176 7.459 1.00 . A A . 19 ASP CA 1 1 10 5461 1 1 19 ASP CB C 19.389 8.591 7.610 1.00 . A A . 19 ASP CB 1 1 10 5462 1 1 19 ASP CG C 20.437 8.754 8.713 1.00 . A A . 19 ASP CG 1 1 10 5463 1 1 19 ASP H H 18.784 7.546 5.409 1.00 . A A . 19 ASP H 1 1 10 5464 1 1 19 ASP HA H 19.486 6.446 7.926 1.00 . A A . 19 ASP HA 1 1 10 5465 1 1 19 ASP HB2 H 19.833 8.892 6.661 1.00 . A A . 19 ASP HB2 1 1 10 5466 1 1 19 ASP HB3 H 18.565 9.275 7.809 1.00 . A A . 19 ASP HB3 1 1 10 5467 1 1 19 ASP HD2 H 21.480 10.315 8.871 1.00 . A A . 19 ASP HD2 1 1 10 5468 1 1 19 ASP N N 18.757 6.788 6.060 1.00 . A A . 19 ASP N 1 1 10 5469 1 1 19 ASP O O 16.651 8.105 7.870 1.00 . A A . 19 ASP O 1 1 10 5470 1 1 19 ASP OD1 O 20.269 8.249 9.833 1.00 . A A . 19 ASP OD1 1 1 10 5471 1 1 19 ASP OD2 O 21.476 9.443 8.381 1.00 . A A . 19 ASP OD2 1 1 10 5472 1 1 20 LEU C C 16.004 5.425 10.824 1.00 . A A . 20 LEU C 1 1 10 5473 1 1 20 LEU CA C 15.820 5.932 9.393 1.00 . A A . 20 LEU CA 1 1 10 5474 1 1 20 LEU CB C 14.913 5.046 8.538 1.00 . A A . 20 LEU CB 1 1 10 5475 1 1 20 LEU CD1 C 12.591 4.910 7.562 1.00 . A A . 20 LEU CD1 1 1 10 5476 1 1 20 LEU CD2 C 13.013 4.183 9.956 1.00 . A A . 20 LEU CD2 1 1 10 5477 1 1 20 LEU CG C 13.414 5.141 8.832 1.00 . A A . 20 LEU CG 1 1 10 5478 1 1 20 LEU H H 17.753 5.319 8.912 1.00 . A A . 20 LEU H 1 1 10 5479 1 1 20 LEU HA H 15.362 6.921 9.433 1.00 . A A . 20 LEU HA 1 1 10 5480 1 1 20 LEU HB2 H 15.074 5.298 7.490 1.00 . A A . 20 LEU HB2 1 1 10 5481 1 1 20 LEU HB3 H 15.222 4.009 8.668 1.00 . A A . 20 LEU HB3 1 1 10 5482 1 1 20 LEU HD11 H 12.222 5.867 7.190 1.00 . A A . 20 LEU HD11 1 1 10 5483 1 1 20 LEU HD12 H 13.217 4.442 6.804 1.00 . A A . 20 LEU HD12 1 1 10 5484 1 1 20 LEU HD13 H 11.746 4.260 7.789 1.00 . A A . 20 LEU HD13 1 1 10 5485 1 1 20 LEU HD21 H 12.646 4.755 10.808 1.00 . A A . 20 LEU HD21 1 1 10 5486 1 1 20 LEU HD22 H 12.227 3.515 9.601 1.00 . A A . 20 LEU HD22 1 1 10 5487 1 1 20 LEU HD23 H 13.880 3.595 10.258 1.00 . A A . 20 LEU HD23 1 1 10 5488 1 1 20 LEU HG H 13.196 6.151 9.178 1.00 . A A . 20 LEU HG 1 1 10 5489 1 1 20 LEU N N 17.122 6.082 8.766 1.00 . A A . 20 LEU N 1 1 10 5490 1 1 20 LEU O O 15.902 4.234 11.113 1.00 . A A . 20 LEU O 1 1 10 5491 1 1 21 PRO C C 15.363 5.247 13.672 1.00 . A A . 21 PRO C 1 1 10 5492 1 1 21 PRO CA C 16.492 6.115 13.136 1.00 . A A . 21 PRO CA 1 1 10 5493 1 1 21 PRO CB C 16.479 7.496 13.789 1.00 . A A . 21 PRO CB 1 1 10 5494 1 1 21 PRO CD C 16.408 7.778 11.421 1.00 . A A . 21 PRO CD 1 1 10 5495 1 1 21 PRO CG C 17.077 8.389 12.651 1.00 . A A . 21 PRO CG 1 1 10 5496 1 1 21 PRO HA H 17.449 5.623 13.306 1.00 . A A . 21 PRO HA 1 1 10 5497 1 1 21 PRO HB2 H 15.478 7.800 14.092 1.00 . A A . 21 PRO HB2 1 1 10 5498 1 1 21 PRO HB3 H 17.157 7.495 14.642 1.00 . A A . 21 PRO HB3 1 1 10 5499 1 1 21 PRO HD2 H 15.437 8.238 11.239 1.00 . A A . 21 PRO HD2 1 1 10 5500 1 1 21 PRO HD3 H 17.054 7.898 10.552 1.00 . A A . 21 PRO HD3 1 1 10 5501 1 1 21 PRO HG2 H 16.775 9.432 12.743 1.00 . A A . 21 PRO HG2 1 1 10 5502 1 1 21 PRO HG3 H 18.163 8.302 12.617 1.00 . A A . 21 PRO HG3 1 1 10 5503 1 1 21 PRO N N 16.281 6.369 11.727 1.00 . A A . 21 PRO N 1 1 10 5504 1 1 21 PRO O O 14.396 5.016 12.947 1.00 . A A . 21 PRO O 1 1 10 5505 1 1 22 ASP C C 13.542 4.821 16.349 1.00 . A A . 22 ASP C 1 1 10 5506 1 1 22 ASP CA C 14.482 3.949 15.513 1.00 . A A . 22 ASP CA 1 1 10 5507 1 1 22 ASP CB C 15.107 2.905 16.440 1.00 . A A . 22 ASP CB 1 1 10 5508 1 1 22 ASP CG C 16.341 3.378 17.209 1.00 . A A . 22 ASP CG 1 1 10 5509 1 1 22 ASP H H 16.292 4.981 15.490 1.00 . A A . 22 ASP H 1 1 10 5510 1 1 22 ASP HA H 13.972 3.469 14.678 1.00 . A A . 22 ASP HA 1 1 10 5511 1 1 22 ASP HB2 H 14.354 2.578 17.156 1.00 . A A . 22 ASP HB2 1 1 10 5512 1 1 22 ASP HB3 H 15.381 2.032 15.846 1.00 . A A . 22 ASP HB3 1 1 10 5513 1 1 22 ASP HD2 H 17.389 2.054 16.375 1.00 . A A . 22 ASP HD2 1 1 10 5514 1 1 22 ASP N N 15.501 4.789 14.907 1.00 . A A . 22 ASP N 1 1 10 5515 1 1 22 ASP O O 13.106 4.413 17.425 1.00 . A A . 22 ASP O 1 1 10 5516 1 1 22 ASP OD1 O 16.370 4.497 17.744 1.00 . A A . 22 ASP OD1 1 1 10 5517 1 1 22 ASP OD2 O 17.317 2.535 17.249 1.00 . A A . 22 ASP OD2 1 1 10 5518 1 1 23 ASP C C 12.096 8.128 15.594 1.00 . A A . 23 ASP C 1 1 10 5519 1 1 23 ASP CA C 12.378 6.934 16.508 1.00 . A A . 23 ASP CA 1 1 10 5520 1 1 23 ASP CB C 13.024 7.461 17.790 1.00 . A A . 23 ASP CB 1 1 10 5521 1 1 23 ASP CG C 14.544 7.626 17.728 1.00 . A A . 23 ASP CG 1 1 10 5522 1 1 23 ASP H H 13.617 6.326 14.947 1.00 . A A . 23 ASP H 1 1 10 5523 1 1 23 ASP HA H 11.478 6.362 16.736 1.00 . A A . 23 ASP HA 1 1 10 5524 1 1 23 ASP HB2 H 12.579 8.427 18.032 1.00 . A A . 23 ASP HB2 1 1 10 5525 1 1 23 ASP HB3 H 12.779 6.783 18.608 1.00 . A A . 23 ASP HB3 1 1 10 5526 1 1 23 ASP HD2 H 14.851 8.203 15.962 1.00 . A A . 23 ASP HD2 1 1 10 5527 1 1 23 ASP N N 13.258 6.003 15.823 1.00 . A A . 23 ASP N 1 1 10 5528 1 1 23 ASP O O 12.238 9.278 16.008 1.00 . A A . 23 ASP O 1 1 10 5529 1 1 23 ASP OD1 O 15.291 6.930 18.433 1.00 . A A . 23 ASP OD1 1 1 10 5530 1 1 23 ASP OD2 O 14.962 8.525 16.902 1.00 . A A . 23 ASP OD2 1 1 10 5531 1 1 24 TRP C C 10.172 9.617 13.882 1.00 . A A . 24 TRP C 1 1 10 5532 1 1 24 TRP CA C 11.400 8.848 13.392 1.00 . A A . 24 TRP CA 1 1 10 5533 1 1 24 TRP CB C 11.212 8.248 11.997 1.00 . A A . 24 TRP CB 1 1 10 5534 1 1 24 TRP CD1 C 12.551 9.981 10.631 1.00 . A A . 24 TRP CD1 1 1 10 5535 1 1 24 TRP CD2 C 10.547 9.558 9.785 1.00 . A A . 24 TRP CD2 1 1 10 5536 1 1 24 TRP CE2 C 11.152 10.491 8.968 1.00 . A A . 24 TRP CE2 1 1 10 5537 1 1 24 TRP CE3 C 9.254 9.077 9.516 1.00 . A A . 24 TRP CE3 1 1 10 5538 1 1 24 TRP CG C 11.459 9.236 10.856 1.00 . A A . 24 TRP CG 1 1 10 5539 1 1 24 TRP CH2 C 9.249 10.558 7.539 1.00 . A A . 24 TRP CH2 1 1 10 5540 1 1 24 TRP CZ2 C 10.539 11.022 7.827 1.00 . A A . 24 TRP CZ2 1 1 10 5541 1 1 24 TRP CZ3 C 8.654 9.618 8.373 1.00 . A A . 24 TRP CZ3 1 1 10 5542 1 1 24 TRP H H 11.590 6.877 14.039 1.00 . A A . 24 TRP H 1 1 10 5543 1 1 24 TRP HA H 12.260 9.517 13.336 1.00 . A A . 24 TRP HA 1 1 10 5544 1 1 24 TRP HB2 H 11.889 7.400 11.884 1.00 . A A . 24 TRP HB2 1 1 10 5545 1 1 24 TRP HB3 H 10.198 7.859 11.915 1.00 . A A . 24 TRP HB3 1 1 10 5546 1 1 24 TRP HD1 H 13.439 9.975 11.264 1.00 . A A . 24 TRP HD1 1 1 10 5547 1 1 24 TRP HE1 H 13.147 11.449 9.095 1.00 . A A . 24 TRP HE1 1 1 10 5548 1 1 24 TRP HE3 H 8.755 8.340 10.145 1.00 . A A . 24 TRP HE3 1 1 10 5549 1 1 24 TRP HH2 H 8.715 10.931 6.666 1.00 . A A . 24 TRP HH2 1 1 10 5550 1 1 24 TRP HZ2 H 11.038 11.759 7.197 1.00 . A A . 24 TRP HZ2 1 1 10 5551 1 1 24 TRP HZ3 H 7.651 9.279 8.118 1.00 . A A . 24 TRP HZ3 1 1 10 5552 1 1 24 TRP N N 11.703 7.815 14.368 1.00 . A A . 24 TRP N 1 1 10 5553 1 1 24 TRP NE1 N 12.409 10.755 9.499 1.00 . A A . 24 TRP NE1 1 1 10 5554 1 1 24 TRP O O 9.213 9.018 14.367 1.00 . A A . 24 TRP O 1 1 10 5555 1 1 25 ALA C C 8.765 12.727 13.014 1.00 . A A . 25 ALA C 1 1 10 5556 1 1 25 ALA CA C 9.145 11.788 14.162 1.00 . A A . 25 ALA CA 1 1 10 5557 1 1 25 ALA CB C 9.549 12.549 15.426 1.00 . A A . 25 ALA CB 1 1 10 5558 1 1 25 ALA H H 11.023 11.412 13.345 1.00 . A A . 25 ALA H 1 1 10 5559 1 1 25 ALA HA H 8.294 11.149 14.395 1.00 . A A . 25 ALA HA 1 1 10 5560 1 1 25 ALA HB1 H 8.849 12.318 16.229 1.00 . A A . 25 ALA HB1 1 1 10 5561 1 1 25 ALA HB2 H 10.554 12.249 15.725 1.00 . A A . 25 ALA HB2 1 1 10 5562 1 1 25 ALA HB3 H 9.534 13.620 15.227 1.00 . A A . 25 ALA HB3 1 1 10 5563 1 1 25 ALA N N 10.240 10.932 13.740 1.00 . A A . 25 ALA N 1 1 10 5564 1 1 25 ALA O O 9.637 13.275 12.341 1.00 . A A . 25 ALA O 1 1 10 5565 1 1 26 CYS C C 7.658 15.101 11.883 1.00 . A A . 26 CYS C 1 1 10 5566 1 1 26 CYS CA C 6.957 13.746 11.773 1.00 . A A . 26 CYS CA 1 1 10 5567 1 1 26 CYS CB C 5.435 13.884 11.836 1.00 . A A . 26 CYS CB 1 1 10 5568 1 1 26 CYS H H 6.760 12.434 13.379 1.00 . A A . 26 CYS H 1 1 10 5569 1 1 26 CYS HA H 7.200 13.259 10.827 1.00 . A A . 26 CYS HA 1 1 10 5570 1 1 26 CYS HB2 H 4.994 12.887 11.886 1.00 . A A . 26 CYS HB2 1 1 10 5571 1 1 26 CYS HB3 H 5.169 14.396 12.762 1.00 . A A . 26 CYS HB3 1 1 10 5572 1 1 26 CYS N N 7.463 12.883 12.826 1.00 . A A . 26 CYS N 1 1 10 5573 1 1 26 CYS O O 7.786 15.684 12.956 1.00 . A A . 26 CYS O 1 1 10 5574 1 1 26 CYS SG S 4.686 14.787 10.432 1.00 . A A . 26 CYS SG 1 1 10 5575 1 1 27 PRO C C 7.818 18.002 10.773 1.00 . A A . 27 PRO C 1 1 10 5576 1 1 27 PRO CA C 8.807 16.859 10.600 1.00 . A A . 27 PRO CA 1 1 10 5577 1 1 27 PRO CB C 9.388 16.845 9.187 1.00 . A A . 27 PRO CB 1 1 10 5578 1 1 27 PRO CD C 7.983 14.934 9.448 1.00 . A A . 27 PRO CD 1 1 10 5579 1 1 27 PRO CG C 8.273 16.020 8.413 1.00 . A A . 27 PRO CG 1 1 10 5580 1 1 27 PRO HA H 9.605 16.946 11.337 1.00 . A A . 27 PRO HA 1 1 10 5581 1 1 27 PRO HB2 H 9.510 17.849 8.781 1.00 . A A . 27 PRO HB2 1 1 10 5582 1 1 27 PRO HB3 H 10.339 16.313 9.196 1.00 . A A . 27 PRO HB3 1 1 10 5583 1 1 27 PRO HD2 H 6.982 14.523 9.311 1.00 . A A . 27 PRO HD2 1 1 10 5584 1 1 27 PRO HD3 H 8.731 14.144 9.374 1.00 . A A . 27 PRO HD3 1 1 10 5585 1 1 27 PRO HG2 H 7.335 16.478 8.102 1.00 . A A . 27 PRO HG2 1 1 10 5586 1 1 27 PRO HG3 H 8.820 15.636 7.553 1.00 . A A . 27 PRO HG3 1 1 10 5587 1 1 27 PRO N N 8.116 15.594 10.729 1.00 . A A . 27 PRO N 1 1 10 5588 1 1 27 PRO O O 8.229 19.159 10.705 1.00 . A A . 27 PRO O 1 1 10 5589 1 1 28 VAL C C 4.988 18.611 12.593 1.00 . A A . 28 VAL C 1 1 10 5590 1 1 28 VAL CA C 5.529 18.681 11.163 1.00 . A A . 28 VAL CA 1 1 10 5591 1 1 28 VAL CB C 4.440 18.514 10.102 1.00 . A A . 28 VAL CB 1 1 10 5592 1 1 28 VAL CG1 C 3.381 19.611 10.228 1.00 . A A . 28 VAL CG1 1 1 10 5593 1 1 28 VAL CG2 C 5.043 18.493 8.696 1.00 . A A . 28 VAL CG2 1 1 10 5594 1 1 28 VAL H H 6.227 16.722 11.040 1.00 . A A . 28 VAL H 1 1 10 5595 1 1 28 VAL HA H 6.000 19.653 11.013 1.00 . A A . 28 VAL HA 1 1 10 5596 1 1 28 VAL HB H 3.951 17.555 10.272 1.00 . A A . 28 VAL HB 1 1 10 5597 1 1 28 VAL HG11 H 3.723 20.508 9.712 1.00 . A A . 28 VAL HG11 1 1 10 5598 1 1 28 VAL HG12 H 2.448 19.268 9.779 1.00 . A A . 28 VAL HG12 1 1 10 5599 1 1 28 VAL HG13 H 3.216 19.839 11.281 1.00 . A A . 28 VAL HG13 1 1 10 5600 1 1 28 VAL HG21 H 5.908 17.830 8.682 1.00 . A A . 28 VAL HG21 1 1 10 5601 1 1 28 VAL HG22 H 4.297 18.132 7.987 1.00 . A A . 28 VAL HG22 1 1 10 5602 1 1 28 VAL HG23 H 5.351 19.500 8.417 1.00 . A A . 28 VAL HG23 1 1 10 5603 1 1 28 VAL N N 6.554 17.666 10.987 1.00 . A A . 28 VAL N 1 1 10 5604 1 1 28 VAL O O 5.546 19.223 13.502 1.00 . A A . 28 VAL O 1 1 10 5605 1 1 29 CYS C C 4.382 17.387 15.070 1.00 . A A . 29 CYS C 1 1 10 5606 1 1 29 CYS CA C 3.286 17.700 14.049 1.00 . A A . 29 CYS CA 1 1 10 5607 1 1 29 CYS CB C 2.200 16.622 14.030 1.00 . A A . 29 CYS CB 1 1 10 5608 1 1 29 CYS H H 3.461 17.363 12.000 1.00 . A A . 29 CYS H 1 1 10 5609 1 1 29 CYS HA H 2.800 18.647 14.281 1.00 . A A . 29 CYS HA 1 1 10 5610 1 1 29 CYS HB2 H 1.838 16.473 15.047 1.00 . A A . 29 CYS HB2 1 1 10 5611 1 1 29 CYS HB3 H 1.357 16.986 13.441 1.00 . A A . 29 CYS HB3 1 1 10 5612 1 1 29 CYS N N 3.909 17.858 12.746 1.00 . A A . 29 CYS N 1 1 10 5613 1 1 29 CYS O O 4.406 17.964 16.156 1.00 . A A . 29 CYS O 1 1 10 5614 1 1 29 CYS SG S 2.733 15.007 13.354 1.00 . A A . 29 CYS SG 1 1 10 5615 1 1 30 GLY C C 6.076 14.726 16.210 1.00 . A A . 30 GLY C 1 1 10 5616 1 1 30 GLY CA C 6.357 16.079 15.554 1.00 . A A . 30 GLY CA 1 1 10 5617 1 1 30 GLY H H 5.236 16.010 13.800 1.00 . A A . 30 GLY H 1 1 10 5618 1 1 30 GLY HA2 H 7.281 16.022 14.978 1.00 . A A . 30 GLY HA2 1 1 10 5619 1 1 30 GLY HA3 H 6.508 16.836 16.324 1.00 . A A . 30 GLY HA3 1 1 10 5620 1 1 30 GLY N N 5.263 16.475 14.685 1.00 . A A . 30 GLY N 1 1 10 5621 1 1 30 GLY O O 6.936 14.172 16.893 1.00 . A A . 30 GLY O 1 1 10 5622 1 1 31 ALA C C 5.434 11.869 16.077 1.00 . A A . 31 ALA C 1 1 10 5623 1 1 31 ALA CA C 4.462 12.955 16.540 1.00 . A A . 31 ALA CA 1 1 10 5624 1 1 31 ALA CB C 3.017 12.655 16.134 1.00 . A A . 31 ALA CB 1 1 10 5625 1 1 31 ALA H H 4.174 14.690 15.423 1.00 . A A . 31 ALA H 1 1 10 5626 1 1 31 ALA HA H 4.512 13.038 17.626 1.00 . A A . 31 ALA HA 1 1 10 5627 1 1 31 ALA HB1 H 3.012 11.953 15.301 1.00 . A A . 31 ALA HB1 1 1 10 5628 1 1 31 ALA HB2 H 2.485 12.221 16.980 1.00 . A A . 31 ALA HB2 1 1 10 5629 1 1 31 ALA HB3 H 2.526 13.580 15.832 1.00 . A A . 31 ALA HB3 1 1 10 5630 1 1 31 ALA N N 4.867 14.233 15.980 1.00 . A A . 31 ALA N 1 1 10 5631 1 1 31 ALA O O 6.195 12.073 15.133 1.00 . A A . 31 ALA O 1 1 10 5632 1 1 32 SER C C 5.667 8.838 15.254 1.00 . A A . 32 SER C 1 1 10 5633 1 1 32 SER CA C 6.244 9.618 16.436 1.00 . A A . 32 SER CA 1 1 10 5634 1 1 32 SER CB C 6.431 8.694 17.642 1.00 . A A . 32 SER CB 1 1 10 5635 1 1 32 SER H H 4.755 10.579 17.531 1.00 . A A . 32 SER H 1 1 10 5636 1 1 32 SER HA H 7.202 10.063 16.169 1.00 . A A . 32 SER HA 1 1 10 5637 1 1 32 SER HB2 H 7.284 8.038 17.467 1.00 . A A . 32 SER HB2 1 1 10 5638 1 1 32 SER HB3 H 6.664 9.290 18.523 1.00 . A A . 32 SER HB3 1 1 10 5639 1 1 32 SER HG H 5.018 7.396 17.073 1.00 . A A . 32 SER HG 1 1 10 5640 1 1 32 SER N N 5.377 10.737 16.765 1.00 . A A . 32 SER N 1 1 10 5641 1 1 32 SER O O 4.583 9.157 14.765 1.00 . A A . 32 SER O 1 1 10 5642 1 1 32 SER OG O 5.271 7.906 17.895 1.00 . A A . 32 SER OG 1 1 10 5643 1 1 33 LYS C C 5.011 5.939 14.216 1.00 . A A . 33 LYS C 1 1 10 5644 1 1 33 LYS CA C 5.989 7.003 13.713 1.00 . A A . 33 LYS CA 1 1 10 5645 1 1 33 LYS CB C 7.203 6.424 12.982 1.00 . A A . 33 LYS CB 1 1 10 5646 1 1 33 LYS CD C 9.188 5.928 14.456 1.00 . A A . 33 LYS CD 1 1 10 5647 1 1 33 LYS CE C 10.134 4.799 14.872 1.00 . A A . 33 LYS CE 1 1 10 5648 1 1 33 LYS CG C 7.906 5.367 13.836 1.00 . A A . 33 LYS CG 1 1 10 5649 1 1 33 LYS H H 7.293 7.577 15.232 1.00 . A A . 33 LYS H 1 1 10 5650 1 1 33 LYS HA H 5.465 7.647 13.007 1.00 . A A . 33 LYS HA 1 1 10 5651 1 1 33 LYS HB2 H 6.887 5.982 12.037 1.00 . A A . 33 LYS HB2 1 1 10 5652 1 1 33 LYS HB3 H 7.902 7.225 12.740 1.00 . A A . 33 LYS HB3 1 1 10 5653 1 1 33 LYS HD2 H 9.687 6.581 13.740 1.00 . A A . 33 LYS HD2 1 1 10 5654 1 1 33 LYS HD3 H 8.939 6.537 15.325 1.00 . A A . 33 LYS HD3 1 1 10 5655 1 1 33 LYS HE2 H 9.930 3.908 14.277 1.00 . A A . 33 LYS HE2 1 1 10 5656 1 1 33 LYS HE3 H 11.165 5.088 14.670 1.00 . A A . 33 LYS HE3 1 1 10 5657 1 1 33 LYS HG2 H 7.234 5.027 14.625 1.00 . A A . 33 LYS HG2 1 1 10 5658 1 1 33 LYS HG3 H 8.144 4.498 13.223 1.00 . A A . 33 LYS HG3 1 1 10 5659 1 1 33 LYS HZ1 H 9.158 4.946 16.708 1.00 . A A . 33 LYS HZ1 1 1 10 5660 1 1 33 LYS HZ2 H 9.860 3.496 16.475 1.00 . A A . 33 LYS HZ2 1 1 10 5661 1 1 33 LYS N N 6.414 7.831 14.829 1.00 . A A . 33 LYS N 1 1 10 5662 1 1 33 LYS NZ N 9.972 4.490 16.310 1.00 . A A . 33 LYS NZ 1 1 10 5663 1 1 33 LYS O O 5.176 4.753 13.931 1.00 . A A . 33 LYS O 1 1 10 5664 1 1 34 ASP C C 1.649 5.831 14.879 1.00 . A A . 34 ASP C 1 1 10 5665 1 1 34 ASP CA C 3.009 5.503 15.500 1.00 . A A . 34 ASP CA 1 1 10 5666 1 1 34 ASP CB C 2.888 5.668 17.017 1.00 . A A . 34 ASP CB 1 1 10 5667 1 1 34 ASP CG C 1.915 4.703 17.697 1.00 . A A . 34 ASP CG 1 1 10 5668 1 1 34 ASP H H 3.886 7.366 15.182 1.00 . A A . 34 ASP H 1 1 10 5669 1 1 34 ASP HA H 3.353 4.500 15.248 1.00 . A A . 34 ASP HA 1 1 10 5670 1 1 34 ASP HB2 H 3.875 5.540 17.461 1.00 . A A . 34 ASP HB2 1 1 10 5671 1 1 34 ASP HB3 H 2.573 6.690 17.232 1.00 . A A . 34 ASP HB3 1 1 10 5672 1 1 34 ASP HD2 H 0.411 4.799 18.826 1.00 . A A . 34 ASP HD2 1 1 10 5673 1 1 34 ASP N N 4.013 6.400 14.955 1.00 . A A . 34 ASP N 1 1 10 5674 1 1 34 ASP O O 0.899 4.929 14.508 1.00 . A A . 34 ASP O 1 1 10 5675 1 1 34 ASP OD1 O 1.717 3.568 17.239 1.00 . A A . 34 ASP OD1 1 1 10 5676 1 1 34 ASP OD2 O 1.339 5.164 18.755 1.00 . A A . 34 ASP OD2 1 1 10 5677 1 1 35 ALA C C 0.111 7.299 12.713 1.00 . A A . 35 ALA C 1 1 10 5678 1 1 35 ALA CA C 0.116 7.579 14.216 1.00 . A A . 35 ALA CA 1 1 10 5679 1 1 35 ALA CB C -0.078 9.064 14.534 1.00 . A A . 35 ALA CB 1 1 10 5680 1 1 35 ALA H H 1.987 7.850 15.090 1.00 . A A . 35 ALA H 1 1 10 5681 1 1 35 ALA HA H -0.687 7.012 14.687 1.00 . A A . 35 ALA HA 1 1 10 5682 1 1 35 ALA HB1 H -0.894 9.178 15.248 1.00 . A A . 35 ALA HB1 1 1 10 5683 1 1 35 ALA HB2 H 0.839 9.468 14.960 1.00 . A A . 35 ALA HB2 1 1 10 5684 1 1 35 ALA HB3 H -0.320 9.602 13.617 1.00 . A A . 35 ALA HB3 1 1 10 5685 1 1 35 ALA N N 1.372 7.123 14.786 1.00 . A A . 35 ALA N 1 1 10 5686 1 1 35 ALA O O -0.951 7.157 12.108 1.00 . A A . 35 ALA O 1 1 10 5687 1 1 36 PHE C C 0.932 5.574 10.371 1.00 . A A . 36 PHE C 1 1 10 5688 1 1 36 PHE CA C 1.456 6.966 10.731 1.00 . A A . 36 PHE CA 1 1 10 5689 1 1 36 PHE CB C 2.952 7.031 10.416 1.00 . A A . 36 PHE CB 1 1 10 5690 1 1 36 PHE CD1 C 3.899 9.108 11.446 1.00 . A A . 36 PHE CD1 1 1 10 5691 1 1 36 PHE CD2 C 3.608 9.064 9.110 1.00 . A A . 36 PHE CD2 1 1 10 5692 1 1 36 PHE CE1 C 4.412 10.428 11.358 1.00 . A A . 36 PHE CE1 1 1 10 5693 1 1 36 PHE CE2 C 4.122 10.384 9.020 1.00 . A A . 36 PHE CE2 1 1 10 5694 1 1 36 PHE CG C 3.507 8.453 10.320 1.00 . A A . 36 PHE CG 1 1 10 5695 1 1 36 PHE CZ C 4.514 11.038 10.147 1.00 . A A . 36 PHE CZ 1 1 10 5696 1 1 36 PHE H H 2.168 7.344 12.651 1.00 . A A . 36 PHE H 1 1 10 5697 1 1 36 PHE HA H 0.873 7.719 10.201 1.00 . A A . 36 PHE HA 1 1 10 5698 1 1 36 PHE HB2 H 3.498 6.490 11.188 1.00 . A A . 36 PHE HB2 1 1 10 5699 1 1 36 PHE HB3 H 3.138 6.516 9.474 1.00 . A A . 36 PHE HB3 1 1 10 5700 1 1 36 PHE HD1 H 3.816 8.619 12.417 1.00 . A A . 36 PHE HD1 1 1 10 5701 1 1 36 PHE HD2 H 3.294 8.539 8.206 1.00 . A A . 36 PHE HD2 1 1 10 5702 1 1 36 PHE HE1 H 4.726 10.953 12.260 1.00 . A A . 36 PHE HE1 1 1 10 5703 1 1 36 PHE HE2 H 4.204 10.873 8.049 1.00 . A A . 36 PHE HE2 1 1 10 5704 1 1 36 PHE HZ H 4.909 12.052 10.079 1.00 . A A . 36 PHE HZ 1 1 10 5705 1 1 36 PHE N N 1.309 7.227 12.153 1.00 . A A . 36 PHE N 1 1 10 5706 1 1 36 PHE O O 1.237 4.596 11.053 1.00 . A A . 36 PHE O 1 1 10 5707 1 1 37 GLU C C -0.473 4.239 7.316 1.00 . A A . 37 GLU C 1 1 10 5708 1 1 37 GLU CA C -0.420 4.272 8.844 1.00 . A A . 37 GLU CA 1 1 10 5709 1 1 37 GLU CB C -1.809 4.049 9.446 1.00 . A A . 37 GLU CB 1 1 10 5710 1 1 37 GLU CD C -3.504 2.234 9.879 1.00 . A A . 37 GLU CD 1 1 10 5711 1 1 37 GLU CG C -2.015 2.580 9.817 1.00 . A A . 37 GLU CG 1 1 10 5712 1 1 37 GLU H H -0.093 6.328 8.754 1.00 . A A . 37 GLU H 1 1 10 5713 1 1 37 GLU HA H 0.256 3.498 9.208 1.00 . A A . 37 GLU HA 1 1 10 5714 1 1 37 GLU HB2 H -1.928 4.672 10.333 1.00 . A A . 37 GLU HB2 1 1 10 5715 1 1 37 GLU HB3 H -2.572 4.358 8.733 1.00 . A A . 37 GLU HB3 1 1 10 5716 1 1 37 GLU HE2 H -5.112 2.450 8.925 1.00 . A A . 37 GLU HE2 1 1 10 5717 1 1 37 GLU HG2 H -1.520 1.943 9.084 1.00 . A A . 37 GLU HG2 1 1 10 5718 1 1 37 GLU HG3 H -1.550 2.375 10.782 1.00 . A A . 37 GLU HG3 1 1 10 5719 1 1 37 GLU N N 0.150 5.529 9.302 1.00 . A A . 37 GLU N 1 1 10 5720 1 1 37 GLU O O -0.922 5.196 6.686 1.00 . A A . 37 GLU O 1 1 10 5721 1 1 37 GLU OE1 O -4.016 1.890 10.955 1.00 . A A . 37 GLU OE1 1 1 10 5722 1 1 37 GLU OE2 O -4.134 2.333 8.758 1.00 . A A . 37 GLU OE2 1 1 10 5723 1 1 38 LYS C C -1.403 3.205 4.771 1.00 . A A . 38 LYS C 1 1 10 5724 1 1 38 LYS CA C 0.004 2.959 5.320 1.00 . A A . 38 LYS CA 1 1 10 5725 1 1 38 LYS CB C 0.580 1.592 4.946 1.00 . A A . 38 LYS CB 1 1 10 5726 1 1 38 LYS CD C -0.419 1.080 2.688 1.00 . A A . 38 LYS CD 1 1 10 5727 1 1 38 LYS CE C -0.395 -0.417 2.372 1.00 . A A . 38 LYS CE 1 1 10 5728 1 1 38 LYS CG C 0.844 1.501 3.442 1.00 . A A . 38 LYS CG 1 1 10 5729 1 1 38 LYS H H 0.357 2.356 7.283 1.00 . A A . 38 LYS H 1 1 10 5730 1 1 38 LYS HA H 0.673 3.715 4.907 1.00 . A A . 38 LYS HA 1 1 10 5731 1 1 38 LYS HB2 H 1.507 1.422 5.493 1.00 . A A . 38 LYS HB2 1 1 10 5732 1 1 38 LYS HB3 H -0.114 0.807 5.246 1.00 . A A . 38 LYS HB3 1 1 10 5733 1 1 38 LYS HD2 H -1.300 1.315 3.286 1.00 . A A . 38 LYS HD2 1 1 10 5734 1 1 38 LYS HD3 H -0.501 1.649 1.762 1.00 . A A . 38 LYS HD3 1 1 10 5735 1 1 38 LYS HE2 H 0.223 -0.939 3.102 1.00 . A A . 38 LYS HE2 1 1 10 5736 1 1 38 LYS HE3 H -1.402 -0.827 2.455 1.00 . A A . 38 LYS HE3 1 1 10 5737 1 1 38 LYS HG2 H 1.189 2.467 3.070 1.00 . A A . 38 LYS HG2 1 1 10 5738 1 1 38 LYS HG3 H 1.642 0.784 3.251 1.00 . A A . 38 LYS HG3 1 1 10 5739 1 1 38 LYS HZ1 H -0.585 -0.996 0.379 1.00 . A A . 38 LYS HZ1 1 1 10 5740 1 1 38 LYS HZ2 H 0.502 0.198 0.594 1.00 . A A . 38 LYS HZ2 1 1 10 5741 1 1 38 LYS N N -0.007 3.129 6.763 1.00 . A A . 38 LYS N 1 1 10 5742 1 1 38 LYS NZ N 0.131 -0.651 1.009 1.00 . A A . 38 LYS NZ 1 1 10 5743 1 1 38 LYS O O -2.388 2.745 5.349 1.00 . A A . 38 LYS O 1 1 10 5744 1 1 39 GLN C C -2.669 3.903 1.537 1.00 . A A . 39 GLN C 1 1 10 5745 1 1 39 GLN CA C -2.724 4.239 3.029 1.00 . A A . 39 GLN CA 1 1 10 5746 1 1 39 GLN CB C -3.100 5.706 3.248 1.00 . A A . 39 GLN CB 1 1 10 5747 1 1 39 GLN CD C -4.841 7.263 4.198 1.00 . A A . 39 GLN CD 1 1 10 5748 1 1 39 GLN CG C -4.543 5.834 3.738 1.00 . A A . 39 GLN CG 1 1 10 5749 1 1 39 GLN H H -0.648 4.297 3.199 1.00 . A A . 39 GLN H 1 1 10 5750 1 1 39 GLN HA H -3.458 3.604 3.525 1.00 . A A . 39 GLN HA 1 1 10 5751 1 1 39 GLN HB2 H -2.424 6.154 3.975 1.00 . A A . 39 GLN HB2 1 1 10 5752 1 1 39 GLN HB3 H -2.978 6.259 2.317 1.00 . A A . 39 GLN HB3 1 1 10 5753 1 1 39 GLN HE21 H -4.033 6.802 5.995 1.00 . A A . 39 GLN HE21 1 1 10 5754 1 1 39 GLN HE22 H -4.619 8.424 5.840 1.00 . A A . 39 GLN HE22 1 1 10 5755 1 1 39 GLN HG2 H -5.228 5.555 2.938 1.00 . A A . 39 GLN HG2 1 1 10 5756 1 1 39 GLN HG3 H -4.714 5.140 4.561 1.00 . A A . 39 GLN HG3 1 1 10 5757 1 1 39 GLN N N -1.453 3.927 3.662 1.00 . A A . 39 GLN N 1 1 10 5758 1 1 39 GLN NE2 N -4.467 7.518 5.447 1.00 . A A . 39 GLN NE2 1 1 10 5759 1 1 39 GLN O O -1.603 3.603 1.003 1.00 . A A . 39 GLN O 1 1 10 5760 1 1 39 GLN OE1 O -5.376 8.079 3.466 1.00 . A A . 39 GLN OE1 1 1 11 5761 1 1 1 MET C C 2.385 2.097 -1.209 1.00 . A A . 1 MET C 1 1 11 5762 1 1 1 MET CA C 1.779 1.834 -2.590 1.00 . A A . 1 MET CA 1 1 11 5763 1 1 1 MET CB C 2.447 2.746 -3.622 1.00 . A A . 1 MET CB 1 1 11 5764 1 1 1 MET CE C 2.448 2.312 -7.725 1.00 . A A . 1 MET CE 1 1 11 5765 1 1 1 MET CG C 2.479 2.081 -5.000 1.00 . A A . 1 MET CG 1 1 11 5766 1 1 1 MET H1 H -0.110 1.889 -1.714 1.00 . A A . 1 MET H1 1 1 11 5767 1 1 1 MET HA H 1.898 0.783 -2.852 1.00 . A A . 1 MET HA 1 1 11 5768 1 1 1 MET HB2 H 1.906 3.690 -3.682 1.00 . A A . 1 MET HB2 1 1 11 5769 1 1 1 MET HB3 H 3.462 2.980 -3.303 1.00 . A A . 1 MET HB3 1 1 11 5770 1 1 1 MET HE1 H 2.413 2.954 -8.605 1.00 . A A . 1 MET HE1 1 1 11 5771 1 1 1 MET HE2 H 3.438 1.864 -7.641 1.00 . A A . 1 MET HE2 1 1 11 5772 1 1 1 MET HE3 H 1.699 1.526 -7.819 1.00 . A A . 1 MET HE3 1 1 11 5773 1 1 1 MET HG2 H 3.461 1.644 -5.178 1.00 . A A . 1 MET HG2 1 1 11 5774 1 1 1 MET HG3 H 1.755 1.268 -5.037 1.00 . A A . 1 MET HG3 1 1 11 5775 1 1 1 MET N N 0.346 2.075 -2.584 1.00 . A A . 1 MET N 1 1 11 5776 1 1 1 MET O O 1.704 2.591 -0.312 1.00 . A A . 1 MET O 1 1 11 5777 1 1 1 MET SD S 2.109 3.284 -6.266 1.00 . A A . 1 MET SD 1 1 11 5778 1 1 2 ASP C C 4.460 3.444 0.475 1.00 . A A . 2 ASP C 1 1 11 5779 1 1 2 ASP CA C 4.363 1.947 0.174 1.00 . A A . 2 ASP CA 1 1 11 5780 1 1 2 ASP CB C 5.785 1.386 0.099 1.00 . A A . 2 ASP CB 1 1 11 5781 1 1 2 ASP CG C 6.003 0.072 0.851 1.00 . A A . 2 ASP CG 1 1 11 5782 1 1 2 ASP H H 4.205 1.352 -1.816 1.00 . A A . 2 ASP H 1 1 11 5783 1 1 2 ASP HA H 3.776 1.408 0.917 1.00 . A A . 2 ASP HA 1 1 11 5784 1 1 2 ASP HB2 H 6.045 1.235 -0.949 1.00 . A A . 2 ASP HB2 1 1 11 5785 1 1 2 ASP HB3 H 6.474 2.132 0.494 1.00 . A A . 2 ASP HB3 1 1 11 5786 1 1 2 ASP HD2 H 7.865 -0.210 0.869 1.00 . A A . 2 ASP HD2 1 1 11 5787 1 1 2 ASP N N 3.658 1.754 -1.082 1.00 . A A . 2 ASP N 1 1 11 5788 1 1 2 ASP O O 5.350 4.126 -0.030 1.00 . A A . 2 ASP O 1 1 11 5789 1 1 2 ASP OD1 O 5.227 -0.285 1.749 1.00 . A A . 2 ASP OD1 1 1 11 5790 1 1 2 ASP OD2 O 7.035 -0.606 0.477 1.00 . A A . 2 ASP OD2 1 1 11 5791 1 1 3 ILE C C 3.129 5.434 3.151 1.00 . A A . 3 ILE C 1 1 11 5792 1 1 3 ILE CA C 3.501 5.314 1.672 1.00 . A A . 3 ILE CA 1 1 11 5793 1 1 3 ILE CB C 2.574 6.097 0.739 1.00 . A A . 3 ILE CB 1 1 11 5794 1 1 3 ILE CD1 C 2.425 6.061 -1.778 1.00 . A A . 3 ILE CD1 1 1 11 5795 1 1 3 ILE CG1 C 3.284 6.446 -0.571 1.00 . A A . 3 ILE CG1 1 1 11 5796 1 1 3 ILE CG2 C 2.016 7.338 1.437 1.00 . A A . 3 ILE CG2 1 1 11 5797 1 1 3 ILE H H 2.811 3.348 1.703 1.00 . A A . 3 ILE H 1 1 11 5798 1 1 3 ILE HA H 4.506 5.710 1.535 1.00 . A A . 3 ILE HA 1 1 11 5799 1 1 3 ILE HB H 1.726 5.461 0.487 1.00 . A A . 3 ILE HB 1 1 11 5800 1 1 3 ILE HD11 H 2.760 5.100 -2.169 1.00 . A A . 3 ILE HD11 1 1 11 5801 1 1 3 ILE HD12 H 1.382 5.985 -1.473 1.00 . A A . 3 ILE HD12 1 1 11 5802 1 1 3 ILE HD13 H 2.524 6.822 -2.552 1.00 . A A . 3 ILE HD13 1 1 11 5803 1 1 3 ILE HG12 H 3.497 7.514 -0.599 1.00 . A A . 3 ILE HG12 1 1 11 5804 1 1 3 ILE HG13 H 4.241 5.927 -0.620 1.00 . A A . 3 ILE HG13 1 1 11 5805 1 1 3 ILE HG21 H 1.471 7.038 2.333 1.00 . A A . 3 ILE HG21 1 1 11 5806 1 1 3 ILE HG22 H 2.837 7.999 1.716 1.00 . A A . 3 ILE HG22 1 1 11 5807 1 1 3 ILE HG23 H 1.341 7.863 0.761 1.00 . A A . 3 ILE HG23 1 1 11 5808 1 1 3 ILE N N 3.531 3.910 1.297 1.00 . A A . 3 ILE N 1 1 11 5809 1 1 3 ILE O O 2.363 4.644 3.698 1.00 . A A . 3 ILE O 1 1 11 5810 1 1 4 TYR C C 2.851 8.095 5.379 1.00 . A A . 4 TYR C 1 1 11 5811 1 1 4 TYR CA C 3.449 6.707 5.199 1.00 . A A . 4 TYR CA 1 1 11 5812 1 1 4 TYR CB C 4.756 6.576 5.977 1.00 . A A . 4 TYR CB 1 1 11 5813 1 1 4 TYR CD1 C 4.796 4.358 7.174 1.00 . A A . 4 TYR CD1 1 1 11 5814 1 1 4 TYR CD2 C 6.129 4.625 5.166 1.00 . A A . 4 TYR CD2 1 1 11 5815 1 1 4 TYR CE1 C 5.243 3.037 7.296 1.00 . A A . 4 TYR CE1 1 1 11 5816 1 1 4 TYR CE2 C 6.577 3.303 5.289 1.00 . A A . 4 TYR CE2 1 1 11 5817 1 1 4 TYR CG C 5.239 5.151 6.108 1.00 . A A . 4 TYR CG 1 1 11 5818 1 1 4 TYR CZ C 6.133 2.509 6.353 1.00 . A A . 4 TYR CZ 1 1 11 5819 1 1 4 TYR H H 4.320 7.078 3.298 1.00 . A A . 4 TYR H 1 1 11 5820 1 1 4 TYR HA H 2.741 5.966 5.571 1.00 . A A . 4 TYR HA 1 1 11 5821 1 1 4 TYR HB2 H 5.524 7.158 5.467 1.00 . A A . 4 TYR HB2 1 1 11 5822 1 1 4 TYR HB3 H 4.610 6.988 6.975 1.00 . A A . 4 TYR HB3 1 1 11 5823 1 1 4 TYR HD1 H 4.108 4.765 7.901 1.00 . A A . 4 TYR HD1 1 1 11 5824 1 1 4 TYR HD2 H 6.473 5.236 4.345 1.00 . A A . 4 TYR HD2 1 1 11 5825 1 1 4 TYR HE1 H 4.901 2.425 8.117 1.00 . A A . 4 TYR HE1 1 1 11 5826 1 1 4 TYR HE2 H 7.264 2.896 4.562 1.00 . A A . 4 TYR HE2 1 1 11 5827 1 1 4 TYR HH H 6.523 0.893 7.373 1.00 . A A . 4 TYR HH 1 1 11 5828 1 1 4 TYR N N 3.698 6.456 3.794 1.00 . A A . 4 TYR N 1 1 11 5829 1 1 4 TYR O O 3.587 9.020 5.717 1.00 . A A . 4 TYR O 1 1 11 5830 1 1 4 TYR OH O 6.569 1.222 6.473 1.00 . A A . 4 TYR OH 1 1 11 5831 1 1 5 VAL C C 0.440 9.676 6.752 1.00 . A A . 5 VAL C 1 1 11 5832 1 1 5 VAL CA C 0.881 9.495 5.297 1.00 . A A . 5 VAL CA 1 1 11 5833 1 1 5 VAL CB C -0.279 9.594 4.305 1.00 . A A . 5 VAL CB 1 1 11 5834 1 1 5 VAL CG1 C -1.147 10.820 4.595 1.00 . A A . 5 VAL CG1 1 1 11 5835 1 1 5 VAL CG2 C 0.234 9.613 2.863 1.00 . A A . 5 VAL CG2 1 1 11 5836 1 1 5 VAL H H 0.958 7.456 4.880 1.00 . A A . 5 VAL H 1 1 11 5837 1 1 5 VAL HA H 1.604 10.273 5.050 1.00 . A A . 5 VAL HA 1 1 11 5838 1 1 5 VAL HB H -0.901 8.707 4.427 1.00 . A A . 5 VAL HB 1 1 11 5839 1 1 5 VAL HG11 H -1.489 11.254 3.655 1.00 . A A . 5 VAL HG11 1 1 11 5840 1 1 5 VAL HG12 H -2.008 10.521 5.193 1.00 . A A . 5 VAL HG12 1 1 11 5841 1 1 5 VAL HG13 H -0.561 11.557 5.144 1.00 . A A . 5 VAL HG13 1 1 11 5842 1 1 5 VAL HG21 H 1.288 9.890 2.856 1.00 . A A . 5 VAL HG21 1 1 11 5843 1 1 5 VAL HG22 H 0.115 8.624 2.422 1.00 . A A . 5 VAL HG22 1 1 11 5844 1 1 5 VAL HG23 H -0.337 10.340 2.284 1.00 . A A . 5 VAL HG23 1 1 11 5845 1 1 5 VAL N N 1.550 8.214 5.155 1.00 . A A . 5 VAL N 1 1 11 5846 1 1 5 VAL O O -0.407 8.933 7.244 1.00 . A A . 5 VAL O 1 1 11 5847 1 1 6 CYS C C -0.808 10.993 8.929 1.00 . A A . 6 CYS C 1 1 11 5848 1 1 6 CYS CA C 0.715 10.955 8.786 1.00 . A A . 6 CYS CA 1 1 11 5849 1 1 6 CYS CB C 1.365 12.258 9.258 1.00 . A A . 6 CYS CB 1 1 11 5850 1 1 6 CYS H H 1.724 11.268 6.990 1.00 . A A . 6 CYS H 1 1 11 5851 1 1 6 CYS HA H 1.140 10.146 9.379 1.00 . A A . 6 CYS HA 1 1 11 5852 1 1 6 CYS HB2 H 2.413 12.254 8.959 1.00 . A A . 6 CYS HB2 1 1 11 5853 1 1 6 CYS HB3 H 0.889 13.092 8.743 1.00 . A A . 6 CYS HB3 1 1 11 5854 1 1 6 CYS N N 1.035 10.668 7.398 1.00 . A A . 6 CYS N 1 1 11 5855 1 1 6 CYS O O -1.517 11.313 7.976 1.00 . A A . 6 CYS O 1 1 11 5856 1 1 6 CYS SG S 1.270 12.552 11.062 1.00 . A A . 6 CYS SG 1 1 11 5857 1 1 7 THR C C -3.055 11.794 11.359 1.00 . A A . 7 THR C 1 1 11 5858 1 1 7 THR CA C -2.692 10.652 10.408 1.00 . A A . 7 THR CA 1 1 11 5859 1 1 7 THR CB C -3.059 9.270 10.950 1.00 . A A . 7 THR CB 1 1 11 5860 1 1 7 THR CG2 C -2.803 8.156 9.934 1.00 . A A . 7 THR CG2 1 1 11 5861 1 1 7 THR H H -0.683 10.403 10.897 1.00 . A A . 7 THR H 1 1 11 5862 1 1 7 THR HA H -3.227 10.832 9.475 1.00 . A A . 7 THR HA 1 1 11 5863 1 1 7 THR HB H -4.091 9.249 11.299 1.00 . A A . 7 THR HB 1 1 11 5864 1 1 7 THR HG1 H -2.225 9.686 12.722 1.00 . A A . 7 THR HG1 1 1 11 5865 1 1 7 THR HG21 H -1.814 8.285 9.495 1.00 . A A . 7 THR HG21 1 1 11 5866 1 1 7 THR HG22 H -2.853 7.189 10.435 1.00 . A A . 7 THR HG22 1 1 11 5867 1 1 7 THR HG23 H -3.557 8.199 9.149 1.00 . A A . 7 THR HG23 1 1 11 5868 1 1 7 THR N N -1.266 10.661 10.127 1.00 . A A . 7 THR N 1 1 11 5869 1 1 7 THR O O -4.127 11.789 11.961 1.00 . A A . 7 THR O 1 1 11 5870 1 1 7 THR OG1 O -2.097 9.033 11.975 1.00 . A A . 7 THR OG1 1 1 11 5871 1 1 8 VAL C C -2.494 15.154 11.480 1.00 . A A . 8 VAL C 1 1 11 5872 1 1 8 VAL CA C -2.351 13.894 12.333 1.00 . A A . 8 VAL CA 1 1 11 5873 1 1 8 VAL CB C -1.218 13.990 13.358 1.00 . A A . 8 VAL CB 1 1 11 5874 1 1 8 VAL CG1 C -1.134 15.397 13.952 1.00 . A A . 8 VAL CG1 1 1 11 5875 1 1 8 VAL CG2 C -1.381 12.939 14.457 1.00 . A A . 8 VAL CG2 1 1 11 5876 1 1 8 VAL H H -1.270 12.745 10.973 1.00 . A A . 8 VAL H 1 1 11 5877 1 1 8 VAL HA H -3.282 13.729 12.875 1.00 . A A . 8 VAL HA 1 1 11 5878 1 1 8 VAL HB H -0.280 13.789 12.839 1.00 . A A . 8 VAL HB 1 1 11 5879 1 1 8 VAL HG11 H -2.131 15.730 14.240 1.00 . A A . 8 VAL HG11 1 1 11 5880 1 1 8 VAL HG12 H -0.488 15.383 14.829 1.00 . A A . 8 VAL HG12 1 1 11 5881 1 1 8 VAL HG13 H -0.724 16.082 13.209 1.00 . A A . 8 VAL HG13 1 1 11 5882 1 1 8 VAL HG21 H -1.135 11.955 14.058 1.00 . A A . 8 VAL HG21 1 1 11 5883 1 1 8 VAL HG22 H -0.712 13.173 15.285 1.00 . A A . 8 VAL HG22 1 1 11 5884 1 1 8 VAL HG23 H -2.412 12.940 14.810 1.00 . A A . 8 VAL HG23 1 1 11 5885 1 1 8 VAL N N -2.141 12.747 11.465 1.00 . A A . 8 VAL N 1 1 11 5886 1 1 8 VAL O O -3.470 15.891 11.612 1.00 . A A . 8 VAL O 1 1 11 5887 1 1 9 CYS C C -1.779 16.048 8.318 1.00 . A A . 9 CYS C 1 1 11 5888 1 1 9 CYS CA C -1.510 16.525 9.747 1.00 . A A . 9 CYS CA 1 1 11 5889 1 1 9 CYS CB C -0.203 17.314 9.848 1.00 . A A . 9 CYS CB 1 1 11 5890 1 1 9 CYS H H -0.716 14.762 10.520 1.00 . A A . 9 CYS H 1 1 11 5891 1 1 9 CYS HA H -2.312 17.177 10.095 1.00 . A A . 9 CYS HA 1 1 11 5892 1 1 9 CYS HB2 H -0.096 17.928 8.953 1.00 . A A . 9 CYS HB2 1 1 11 5893 1 1 9 CYS HB3 H -0.272 17.998 10.695 1.00 . A A . 9 CYS HB3 1 1 11 5894 1 1 9 CYS N N -1.507 15.366 10.622 1.00 . A A . 9 CYS N 1 1 11 5895 1 1 9 CYS O O -2.199 16.831 7.467 1.00 . A A . 9 CYS O 1 1 11 5896 1 1 9 CYS SG S 1.300 16.289 10.042 1.00 . A A . 9 CYS SG 1 1 11 5897 1 1 10 GLY C C -0.452 14.215 5.957 1.00 . A A . 10 GLY C 1 1 11 5898 1 1 10 GLY CA C -1.736 14.175 6.788 1.00 . A A . 10 GLY CA 1 1 11 5899 1 1 10 GLY H H -1.185 14.136 8.797 1.00 . A A . 10 GLY H 1 1 11 5900 1 1 10 GLY HA2 H -2.070 13.143 6.899 1.00 . A A . 10 GLY HA2 1 1 11 5901 1 1 10 GLY HA3 H -2.528 14.711 6.267 1.00 . A A . 10 GLY HA3 1 1 11 5902 1 1 10 GLY N N -1.526 14.766 8.099 1.00 . A A . 10 GLY N 1 1 11 5903 1 1 10 GLY O O -0.441 13.942 4.759 1.00 . A A . 10 GLY O 1 1 11 5904 1 1 11 TYR C C 2.108 13.503 5.006 1.00 . A A . 11 TYR C 1 1 11 5905 1 1 11 TYR CA C 1.940 14.654 5.987 1.00 . A A . 11 TYR CA 1 1 11 5906 1 1 11 TYR CB C 3.037 14.623 7.048 1.00 . A A . 11 TYR CB 1 1 11 5907 1 1 11 TYR CD1 C 4.637 15.812 5.505 1.00 . A A . 11 TYR CD1 1 1 11 5908 1 1 11 TYR CD2 C 5.494 14.066 6.954 1.00 . A A . 11 TYR CD2 1 1 11 5909 1 1 11 TYR CE1 C 5.923 16.012 4.986 1.00 . A A . 11 TYR CE1 1 1 11 5910 1 1 11 TYR CE2 C 6.778 14.266 6.436 1.00 . A A . 11 TYR CE2 1 1 11 5911 1 1 11 TYR CG C 4.424 14.840 6.489 1.00 . A A . 11 TYR CG 1 1 11 5912 1 1 11 TYR CZ C 6.993 15.238 5.451 1.00 . A A . 11 TYR CZ 1 1 11 5913 1 1 11 TYR H H 0.582 14.782 7.616 1.00 . A A . 11 TYR H 1 1 11 5914 1 1 11 TYR HA H 2.002 15.596 5.442 1.00 . A A . 11 TYR HA 1 1 11 5915 1 1 11 TYR HB2 H 2.833 15.404 7.782 1.00 . A A . 11 TYR HB2 1 1 11 5916 1 1 11 TYR HB3 H 3.011 13.656 7.549 1.00 . A A . 11 TYR HB3 1 1 11 5917 1 1 11 TYR HD1 H 3.811 16.409 5.147 1.00 . A A . 11 TYR HD1 1 1 11 5918 1 1 11 TYR HD2 H 5.328 13.317 7.713 1.00 . A A . 11 TYR HD2 1 1 11 5919 1 1 11 TYR HE1 H 6.088 16.762 4.227 1.00 . A A . 11 TYR HE1 1 1 11 5920 1 1 11 TYR HE2 H 7.605 13.669 6.794 1.00 . A A . 11 TYR HE2 1 1 11 5921 1 1 11 TYR HH H 8.940 15.227 5.575 1.00 . A A . 11 TYR HH 1 1 11 5922 1 1 11 TYR N N 0.645 14.567 6.631 1.00 . A A . 11 TYR N 1 1 11 5923 1 1 11 TYR O O 1.434 12.486 5.162 1.00 . A A . 11 TYR O 1 1 11 5924 1 1 11 TYR OH O 8.245 15.432 4.946 1.00 . A A . 11 TYR OH 1 1 11 5925 1 1 12 GLU C C 4.706 12.271 3.002 1.00 . A A . 12 GLU C 1 1 11 5926 1 1 12 GLU CA C 3.222 12.641 3.040 1.00 . A A . 12 GLU CA 1 1 11 5927 1 1 12 GLU CB C 2.731 13.079 1.658 1.00 . A A . 12 GLU CB 1 1 11 5928 1 1 12 GLU CD C 1.029 12.443 -0.089 1.00 . A A . 12 GLU CD 1 1 11 5929 1 1 12 GLU CG C 1.300 12.602 1.408 1.00 . A A . 12 GLU CG 1 1 11 5930 1 1 12 GLU H H 3.531 14.509 3.910 1.00 . A A . 12 GLU H 1 1 11 5931 1 1 12 GLU HA H 2.636 11.784 3.372 1.00 . A A . 12 GLU HA 1 1 11 5932 1 1 12 GLU HB2 H 2.775 14.166 1.581 1.00 . A A . 12 GLU HB2 1 1 11 5933 1 1 12 GLU HB3 H 3.393 12.679 0.890 1.00 . A A . 12 GLU HB3 1 1 11 5934 1 1 12 GLU HE2 H -0.767 12.038 0.306 1.00 . A A . 12 GLU HE2 1 1 11 5935 1 1 12 GLU HG2 H 1.136 11.650 1.914 1.00 . A A . 12 GLU HG2 1 1 11 5936 1 1 12 GLU HG3 H 0.595 13.316 1.835 1.00 . A A . 12 GLU HG3 1 1 11 5937 1 1 12 GLU N N 2.987 13.678 4.029 1.00 . A A . 12 GLU N 1 1 11 5938 1 1 12 GLU O O 5.586 13.114 2.847 1.00 . A A . 12 GLU O 1 1 11 5939 1 1 12 GLU OE1 O 1.975 12.319 -0.881 1.00 . A A . 12 GLU OE1 1 1 11 5940 1 1 12 GLU OE2 O -0.218 12.449 -0.421 1.00 . A A . 12 GLU OE2 1 1 11 5941 1 1 13 TYR C C 6.576 9.696 1.846 1.00 . A A . 13 TYR C 1 1 11 5942 1 1 13 TYR CA C 6.322 10.458 3.139 1.00 . A A . 13 TYR CA 1 1 11 5943 1 1 13 TYR CB C 6.531 9.553 4.350 1.00 . A A . 13 TYR CB 1 1 11 5944 1 1 13 TYR CD1 C 8.934 10.158 4.820 1.00 . A A . 13 TYR CD1 1 1 11 5945 1 1 13 TYR CD2 C 8.355 7.820 4.529 1.00 . A A . 13 TYR CD2 1 1 11 5946 1 1 13 TYR CE1 C 10.272 9.800 5.025 1.00 . A A . 13 TYR CE1 1 1 11 5947 1 1 13 TYR CE2 C 9.693 7.464 4.734 1.00 . A A . 13 TYR CE2 1 1 11 5948 1 1 13 TYR CG C 7.975 9.168 4.572 1.00 . A A . 13 TYR CG 1 1 11 5949 1 1 13 TYR CZ C 10.651 8.453 4.982 1.00 . A A . 13 TYR CZ 1 1 11 5950 1 1 13 TYR H H 4.207 10.317 3.274 1.00 . A A . 13 TYR H 1 1 11 5951 1 1 13 TYR HA H 7.018 11.295 3.198 1.00 . A A . 13 TYR HA 1 1 11 5952 1 1 13 TYR HB2 H 6.170 10.071 5.238 1.00 . A A . 13 TYR HB2 1 1 11 5953 1 1 13 TYR HB3 H 5.947 8.644 4.211 1.00 . A A . 13 TYR HB3 1 1 11 5954 1 1 13 TYR HD1 H 8.641 11.197 4.853 1.00 . A A . 13 TYR HD1 1 1 11 5955 1 1 13 TYR HD2 H 7.615 7.057 4.338 1.00 . A A . 13 TYR HD2 1 1 11 5956 1 1 13 TYR HE1 H 11.011 10.564 5.217 1.00 . A A . 13 TYR HE1 1 1 11 5957 1 1 13 TYR HE2 H 9.986 6.425 4.701 1.00 . A A . 13 TYR HE2 1 1 11 5958 1 1 13 TYR HH H 12.572 8.703 4.754 1.00 . A A . 13 TYR HH 1 1 11 5959 1 1 13 TYR N N 4.967 10.970 3.150 1.00 . A A . 13 TYR N 1 1 11 5960 1 1 13 TYR O O 5.620 9.204 1.248 1.00 . A A . 13 TYR O 1 1 11 5961 1 1 13 TYR OH O 11.955 8.106 5.182 1.00 . A A . 13 TYR OH 1 1 11 5962 1 1 14 ASP C C 9.383 7.993 0.493 1.00 . A A . 14 ASP C 1 1 11 5963 1 1 14 ASP CA C 8.186 8.905 0.223 1.00 . A A . 14 ASP CA 1 1 11 5964 1 1 14 ASP CB C 8.578 9.885 -0.885 1.00 . A A . 14 ASP CB 1 1 11 5965 1 1 14 ASP CG C 8.390 9.358 -2.309 1.00 . A A . 14 ASP CG 1 1 11 5966 1 1 14 ASP H H 8.608 10.014 1.936 1.00 . A A . 14 ASP H 1 1 11 5967 1 1 14 ASP HA H 7.290 8.349 -0.053 1.00 . A A . 14 ASP HA 1 1 11 5968 1 1 14 ASP HB2 H 7.991 10.795 -0.770 1.00 . A A . 14 ASP HB2 1 1 11 5969 1 1 14 ASP HB3 H 9.624 10.162 -0.752 1.00 . A A . 14 ASP HB3 1 1 11 5970 1 1 14 ASP HD2 H 9.910 8.264 -2.507 1.00 . A A . 14 ASP HD2 1 1 11 5971 1 1 14 ASP N N 7.835 9.612 1.444 1.00 . A A . 14 ASP N 1 1 11 5972 1 1 14 ASP O O 10.538 8.344 0.258 1.00 . A A . 14 ASP O 1 1 11 5973 1 1 14 ASP OD1 O 7.258 9.237 -2.801 1.00 . A A . 14 ASP OD1 1 1 11 5974 1 1 14 ASP OD2 O 9.481 9.062 -2.930 1.00 . A A . 14 ASP OD2 1 1 11 5975 1 1 15 PRO C C 11.198 5.823 0.328 1.00 . A A . 15 PRO C 1 1 11 5976 1 1 15 PRO CA C 10.051 5.776 1.327 1.00 . A A . 15 PRO CA 1 1 11 5977 1 1 15 PRO CB C 9.287 4.457 1.222 1.00 . A A . 15 PRO CB 1 1 11 5978 1 1 15 PRO CD C 7.731 6.350 1.286 1.00 . A A . 15 PRO CD 1 1 11 5979 1 1 15 PRO CG C 7.886 4.904 1.753 1.00 . A A . 15 PRO CG 1 1 11 5980 1 1 15 PRO HA H 10.435 5.912 2.337 1.00 . A A . 15 PRO HA 1 1 11 5981 1 1 15 PRO HB2 H 9.300 4.052 0.210 1.00 . A A . 15 PRO HB2 1 1 11 5982 1 1 15 PRO HB3 H 9.707 3.742 1.929 1.00 . A A . 15 PRO HB3 1 1 11 5983 1 1 15 PRO HD2 H 7.094 6.408 0.404 1.00 . A A . 15 PRO HD2 1 1 11 5984 1 1 15 PRO HD3 H 7.320 6.957 2.093 1.00 . A A . 15 PRO HD3 1 1 11 5985 1 1 15 PRO HG2 H 7.207 4.269 1.184 1.00 . A A . 15 PRO HG2 1 1 11 5986 1 1 15 PRO HG3 H 7.712 4.794 2.823 1.00 . A A . 15 PRO HG3 1 1 11 5987 1 1 15 PRO N N 9.077 6.795 0.998 1.00 . A A . 15 PRO N 1 1 11 5988 1 1 15 PRO O O 11.015 5.384 -0.807 1.00 . A A . 15 PRO O 1 1 11 5989 1 1 16 ALA C C 14.712 6.873 0.697 1.00 . A A . 16 ALA C 1 1 11 5990 1 1 16 ALA CA C 13.492 6.441 -0.120 1.00 . A A . 16 ALA CA 1 1 11 5991 1 1 16 ALA CB C 13.188 7.407 -1.267 1.00 . A A . 16 ALA CB 1 1 11 5992 1 1 16 ALA H H 12.476 6.703 1.680 1.00 . A A . 16 ALA H 1 1 11 5993 1 1 16 ALA HA H 13.676 5.451 -0.535 1.00 . A A . 16 ALA HA 1 1 11 5994 1 1 16 ALA HB1 H 14.114 7.673 -1.774 1.00 . A A . 16 ALA HB1 1 1 11 5995 1 1 16 ALA HB2 H 12.511 6.929 -1.975 1.00 . A A . 16 ALA HB2 1 1 11 5996 1 1 16 ALA HB3 H 12.720 8.308 -0.868 1.00 . A A . 16 ALA HB3 1 1 11 5997 1 1 16 ALA N N 12.337 6.348 0.756 1.00 . A A . 16 ALA N 1 1 11 5998 1 1 16 ALA O O 15.575 7.594 0.197 1.00 . A A . 16 ALA O 1 1 11 5999 1 1 17 PHE C C 16.773 5.545 3.022 1.00 . A A . 17 PHE C 1 1 11 6000 1 1 17 PHE CA C 15.843 6.745 2.831 1.00 . A A . 17 PHE CA 1 1 11 6001 1 1 17 PHE CB C 15.228 7.119 4.181 1.00 . A A . 17 PHE CB 1 1 11 6002 1 1 17 PHE CD1 C 13.042 5.920 4.412 1.00 . A A . 17 PHE CD1 1 1 11 6003 1 1 17 PHE CD2 C 14.864 5.162 5.699 1.00 . A A . 17 PHE CD2 1 1 11 6004 1 1 17 PHE CE1 C 12.223 4.905 4.975 1.00 . A A . 17 PHE CE1 1 1 11 6005 1 1 17 PHE CE2 C 14.045 4.147 6.262 1.00 . A A . 17 PHE CE2 1 1 11 6006 1 1 17 PHE CG C 14.346 6.026 4.787 1.00 . A A . 17 PHE CG 1 1 11 6007 1 1 17 PHE CZ C 12.741 4.040 5.887 1.00 . A A . 17 PHE CZ 1 1 11 6008 1 1 17 PHE H H 14.038 5.830 2.338 1.00 . A A . 17 PHE H 1 1 11 6009 1 1 17 PHE HA H 16.398 7.563 2.371 1.00 . A A . 17 PHE HA 1 1 11 6010 1 1 17 PHE HB2 H 16.029 7.354 4.881 1.00 . A A . 17 PHE HB2 1 1 11 6011 1 1 17 PHE HB3 H 14.634 8.025 4.060 1.00 . A A . 17 PHE HB3 1 1 11 6012 1 1 17 PHE HD1 H 12.627 6.612 3.680 1.00 . A A . 17 PHE HD1 1 1 11 6013 1 1 17 PHE HD2 H 15.907 5.247 6.000 1.00 . A A . 17 PHE HD2 1 1 11 6014 1 1 17 PHE HE1 H 11.179 4.819 4.674 1.00 . A A . 17 PHE HE1 1 1 11 6015 1 1 17 PHE HE2 H 14.459 3.454 6.993 1.00 . A A . 17 PHE HE2 1 1 11 6016 1 1 17 PHE HZ H 12.112 3.261 6.318 1.00 . A A . 17 PHE HZ 1 1 11 6017 1 1 17 PHE N N 14.744 6.415 1.940 1.00 . A A . 17 PHE N 1 1 11 6018 1 1 17 PHE O O 16.524 4.470 2.480 1.00 . A A . 17 PHE O 1 1 11 6019 1 1 18 GLU C C 19.038 4.599 5.571 1.00 . A A . 18 GLU C 1 1 11 6020 1 1 18 GLU CA C 18.793 4.720 4.066 1.00 . A A . 18 GLU CA 1 1 11 6021 1 1 18 GLU CB C 20.102 4.976 3.316 1.00 . A A . 18 GLU CB 1 1 11 6022 1 1 18 GLU CD C 21.609 3.550 1.881 1.00 . A A . 18 GLU CD 1 1 11 6023 1 1 18 GLU CG C 20.956 3.708 3.256 1.00 . A A . 18 GLU CG 1 1 11 6024 1 1 18 GLU H H 18.021 6.647 4.233 1.00 . A A . 18 GLU H 1 1 11 6025 1 1 18 GLU HA H 18.339 3.804 3.689 1.00 . A A . 18 GLU HA 1 1 11 6026 1 1 18 GLU HB2 H 19.885 5.320 2.304 1.00 . A A . 18 GLU HB2 1 1 11 6027 1 1 18 GLU HB3 H 20.660 5.771 3.810 1.00 . A A . 18 GLU HB3 1 1 11 6028 1 1 18 GLU HE2 H 21.802 5.119 0.857 1.00 . A A . 18 GLU HE2 1 1 11 6029 1 1 18 GLU HG2 H 21.726 3.747 4.026 1.00 . A A . 18 GLU HG2 1 1 11 6030 1 1 18 GLU HG3 H 20.335 2.837 3.469 1.00 . A A . 18 GLU HG3 1 1 11 6031 1 1 18 GLU N N 17.825 5.769 3.796 1.00 . A A . 18 GLU N 1 1 11 6032 1 1 18 GLU O O 19.507 5.543 6.205 1.00 . A A . 18 GLU O 1 1 11 6033 1 1 18 GLU OE1 O 21.432 2.513 1.225 1.00 . A A . 18 GLU OE1 1 1 11 6034 1 1 18 GLU OE2 O 22.322 4.554 1.498 1.00 . A A . 18 GLU OE2 1 1 11 6035 1 1 19 ASP C C 18.349 4.357 8.319 1.00 . A A . 19 ASP C 1 1 11 6036 1 1 19 ASP CA C 18.891 3.171 7.517 1.00 . A A . 19 ASP CA 1 1 11 6037 1 1 19 ASP CB C 20.371 3.004 7.864 1.00 . A A . 19 ASP CB 1 1 11 6038 1 1 19 ASP CG C 20.784 1.589 8.274 1.00 . A A . 19 ASP CG 1 1 11 6039 1 1 19 ASP H H 18.331 2.666 5.575 1.00 . A A . 19 ASP H 1 1 11 6040 1 1 19 ASP HA H 18.342 2.250 7.713 1.00 . A A . 19 ASP HA 1 1 11 6041 1 1 19 ASP HB2 H 20.967 3.305 7.003 1.00 . A A . 19 ASP HB2 1 1 11 6042 1 1 19 ASP HB3 H 20.618 3.687 8.677 1.00 . A A . 19 ASP HB3 1 1 11 6043 1 1 19 ASP HD2 H 21.932 0.198 7.732 1.00 . A A . 19 ASP HD2 1 1 11 6044 1 1 19 ASP N N 18.712 3.428 6.099 1.00 . A A . 19 ASP N 1 1 11 6045 1 1 19 ASP O O 19.090 5.285 8.639 1.00 . A A . 19 ASP O 1 1 11 6046 1 1 19 ASP OD1 O 20.056 0.896 9.001 1.00 . A A . 19 ASP OD1 1 1 11 6047 1 1 19 ASP OD2 O 21.921 1.196 7.808 1.00 . A A . 19 ASP OD2 1 1 11 6048 1 1 20 LEU C C 16.494 5.019 10.870 1.00 . A A . 20 LEU C 1 1 11 6049 1 1 20 LEU CA C 16.411 5.343 9.377 1.00 . A A . 20 LEU CA 1 1 11 6050 1 1 20 LEU CB C 14.983 5.563 8.874 1.00 . A A . 20 LEU CB 1 1 11 6051 1 1 20 LEU CD1 C 13.807 7.745 9.336 1.00 . A A . 20 LEU CD1 1 1 11 6052 1 1 20 LEU CD2 C 12.735 5.549 10.018 1.00 . A A . 20 LEU CD2 1 1 11 6053 1 1 20 LEU CG C 14.046 6.314 9.822 1.00 . A A . 20 LEU CG 1 1 11 6054 1 1 20 LEU H H 16.465 3.529 8.356 1.00 . A A . 20 LEU H 1 1 11 6055 1 1 20 LEU HA H 16.963 6.265 9.193 1.00 . A A . 20 LEU HA 1 1 11 6056 1 1 20 LEU HB2 H 15.031 6.110 7.933 1.00 . A A . 20 LEU HB2 1 1 11 6057 1 1 20 LEU HB3 H 14.542 4.591 8.655 1.00 . A A . 20 LEU HB3 1 1 11 6058 1 1 20 LEU HD11 H 14.734 8.151 8.930 1.00 . A A . 20 LEU HD11 1 1 11 6059 1 1 20 LEU HD12 H 13.041 7.742 8.560 1.00 . A A . 20 LEU HD12 1 1 11 6060 1 1 20 LEU HD13 H 13.475 8.362 10.170 1.00 . A A . 20 LEU HD13 1 1 11 6061 1 1 20 LEU HD21 H 12.929 4.478 9.966 1.00 . A A . 20 LEU HD21 1 1 11 6062 1 1 20 LEU HD22 H 12.314 5.796 10.993 1.00 . A A . 20 LEU HD22 1 1 11 6063 1 1 20 LEU HD23 H 12.030 5.829 9.235 1.00 . A A . 20 LEU HD23 1 1 11 6064 1 1 20 LEU HG H 14.528 6.382 10.796 1.00 . A A . 20 LEU HG 1 1 11 6065 1 1 20 LEU N N 17.061 4.287 8.620 1.00 . A A . 20 LEU N 1 1 11 6066 1 1 20 LEU O O 16.446 3.865 11.291 1.00 . A A . 20 LEU O 1 1 11 6067 1 1 21 PRO C C 15.461 5.351 13.674 1.00 . A A . 21 PRO C 1 1 11 6068 1 1 21 PRO CA C 16.715 6.005 13.114 1.00 . A A . 21 PRO CA 1 1 11 6069 1 1 21 PRO CB C 16.828 7.456 13.574 1.00 . A A . 21 PRO CB 1 1 11 6070 1 1 21 PRO CD C 16.680 7.449 11.211 1.00 . A A . 21 PRO CD 1 1 11 6071 1 1 21 PRO CG C 16.213 8.286 12.399 1.00 . A A . 21 PRO CG 1 1 11 6072 1 1 21 PRO HA H 17.595 5.440 13.420 1.00 . A A . 21 PRO HA 1 1 11 6073 1 1 21 PRO HB2 H 16.303 7.635 14.513 1.00 . A A . 21 PRO HB2 1 1 11 6074 1 1 21 PRO HB3 H 17.880 7.724 13.663 1.00 . A A . 21 PRO HB3 1 1 11 6075 1 1 21 PRO HD2 H 16.036 7.609 10.346 1.00 . A A . 21 PRO HD2 1 1 11 6076 1 1 21 PRO HD3 H 17.712 7.699 10.966 1.00 . A A . 21 PRO HD3 1 1 11 6077 1 1 21 PRO HG2 H 15.124 8.264 12.447 1.00 . A A . 21 PRO HG2 1 1 11 6078 1 1 21 PRO HG3 H 16.577 9.313 12.353 1.00 . A A . 21 PRO HG3 1 1 11 6079 1 1 21 PRO N N 16.620 6.079 11.671 1.00 . A A . 21 PRO N 1 1 11 6080 1 1 21 PRO O O 14.514 5.136 12.918 1.00 . A A . 21 PRO O 1 1 11 6081 1 1 22 ASP C C 13.578 5.460 16.435 1.00 . A A . 22 ASP C 1 1 11 6082 1 1 22 ASP CA C 14.327 4.421 15.598 1.00 . A A . 22 ASP CA 1 1 11 6083 1 1 22 ASP CB C 14.764 3.290 16.531 1.00 . A A . 22 ASP CB 1 1 11 6084 1 1 22 ASP CG C 16.016 3.583 17.360 1.00 . A A . 22 ASP CG 1 1 11 6085 1 1 22 ASP H H 16.247 5.228 15.572 1.00 . A A . 22 ASP H 1 1 11 6086 1 1 22 ASP HA H 13.724 4.033 14.778 1.00 . A A . 22 ASP HA 1 1 11 6087 1 1 22 ASP HB2 H 13.943 3.060 17.209 1.00 . A A . 22 ASP HB2 1 1 11 6088 1 1 22 ASP HB3 H 14.944 2.396 15.934 1.00 . A A . 22 ASP HB3 1 1 11 6089 1 1 22 ASP HD2 H 16.737 3.492 19.098 1.00 . A A . 22 ASP HD2 1 1 11 6090 1 1 22 ASP N N 15.474 5.050 14.965 1.00 . A A . 22 ASP N 1 1 11 6091 1 1 22 ASP O O 13.378 5.270 17.633 1.00 . A A . 22 ASP O 1 1 11 6092 1 1 22 ASP OD1 O 17.096 3.855 16.814 1.00 . A A . 22 ASP OD1 1 1 11 6093 1 1 22 ASP OD2 O 15.850 3.524 18.638 1.00 . A A . 22 ASP OD2 1 1 11 6094 1 1 23 ASP C C 12.301 8.785 15.474 1.00 . A A . 23 ASP C 1 1 11 6095 1 1 23 ASP CA C 12.463 7.606 16.437 1.00 . A A . 23 ASP CA 1 1 11 6096 1 1 23 ASP CB C 13.226 8.103 17.667 1.00 . A A . 23 ASP CB 1 1 11 6097 1 1 23 ASP CG C 12.805 7.463 18.991 1.00 . A A . 23 ASP CG 1 1 11 6098 1 1 23 ASP H H 13.352 6.684 14.795 1.00 . A A . 23 ASP H 1 1 11 6099 1 1 23 ASP HA H 11.507 7.170 16.727 1.00 . A A . 23 ASP HA 1 1 11 6100 1 1 23 ASP HB2 H 14.290 7.920 17.514 1.00 . A A . 23 ASP HB2 1 1 11 6101 1 1 23 ASP HB3 H 13.097 9.182 17.745 1.00 . A A . 23 ASP HB3 1 1 11 6102 1 1 23 ASP HD2 H 11.086 6.922 19.536 1.00 . A A . 23 ASP HD2 1 1 11 6103 1 1 23 ASP N N 13.185 6.537 15.770 1.00 . A A . 23 ASP N 1 1 11 6104 1 1 23 ASP O O 12.930 9.826 15.650 1.00 . A A . 23 ASP O 1 1 11 6105 1 1 23 ASP OD1 O 13.577 6.720 19.616 1.00 . A A . 23 ASP OD1 1 1 11 6106 1 1 23 ASP OD2 O 11.613 7.759 19.384 1.00 . A A . 23 ASP OD2 1 1 11 6107 1 1 24 TRP C C 9.960 10.393 13.924 1.00 . A A . 24 TRP C 1 1 11 6108 1 1 24 TRP CA C 11.200 9.612 13.486 1.00 . A A . 24 TRP CA 1 1 11 6109 1 1 24 TRP CB C 11.062 9.007 12.088 1.00 . A A . 24 TRP CB 1 1 11 6110 1 1 24 TRP CD1 C 12.176 10.897 10.728 1.00 . A A . 24 TRP CD1 1 1 11 6111 1 1 24 TRP CD2 C 10.229 10.250 9.894 1.00 . A A . 24 TRP CD2 1 1 11 6112 1 1 24 TRP CE2 C 10.712 11.255 9.081 1.00 . A A . 24 TRP CE2 1 1 11 6113 1 1 24 TRP CE3 C 8.998 9.624 9.630 1.00 . A A . 24 TRP CE3 1 1 11 6114 1 1 24 TRP CG C 11.182 10.028 10.954 1.00 . A A . 24 TRP CG 1 1 11 6115 1 1 24 TRP CH2 C 8.802 11.112 7.669 1.00 . A A . 24 TRP CH2 1 1 11 6116 1 1 24 TRP CZ2 C 10.030 11.722 7.951 1.00 . A A . 24 TRP CZ2 1 1 11 6117 1 1 24 TRP CZ3 C 8.329 10.101 8.497 1.00 . A A . 24 TRP CZ3 1 1 11 6118 1 1 24 TRP H H 10.944 7.729 14.341 1.00 . A A . 24 TRP H 1 1 11 6119 1 1 24 TRP HA H 12.067 10.271 13.463 1.00 . A A . 24 TRP HA 1 1 11 6120 1 1 24 TRP HB2 H 11.828 8.243 11.957 1.00 . A A . 24 TRP HB2 1 1 11 6121 1 1 24 TRP HB3 H 10.097 8.507 12.012 1.00 . A A . 24 TRP HB3 1 1 11 6122 1 1 24 TRP HD1 H 13.064 10.990 11.353 1.00 . A A . 24 TRP HD1 1 1 11 6123 1 1 24 TRP HE1 H 12.583 12.440 9.202 1.00 . A A . 24 TRP HE1 1 1 11 6124 1 1 24 TRP HE3 H 8.594 8.828 10.256 1.00 . A A . 24 TRP HE3 1 1 11 6125 1 1 24 TRP HH2 H 8.220 11.429 6.804 1.00 . A A . 24 TRP HH2 1 1 11 6126 1 1 24 TRP HZ2 H 10.434 12.518 7.324 1.00 . A A . 24 TRP HZ2 1 1 11 6127 1 1 24 TRP HZ3 H 7.369 9.650 8.246 1.00 . A A . 24 TRP HZ3 1 1 11 6128 1 1 24 TRP N N 11.453 8.580 14.478 1.00 . A A . 24 TRP N 1 1 11 6129 1 1 24 TRP NE1 N 11.934 11.661 9.605 1.00 . A A . 24 TRP NE1 1 1 11 6130 1 1 24 TRP O O 9.005 9.813 14.437 1.00 . A A . 24 TRP O 1 1 11 6131 1 1 25 ALA C C 8.504 13.410 12.860 1.00 . A A . 25 ALA C 1 1 11 6132 1 1 25 ALA CA C 8.907 12.566 14.070 1.00 . A A . 25 ALA CA 1 1 11 6133 1 1 25 ALA CB C 9.305 13.424 15.272 1.00 . A A . 25 ALA CB 1 1 11 6134 1 1 25 ALA H H 10.795 12.163 13.287 1.00 . A A . 25 ALA H 1 1 11 6135 1 1 25 ALA HA H 8.068 11.931 14.356 1.00 . A A . 25 ALA HA 1 1 11 6136 1 1 25 ALA HB1 H 10.017 12.877 15.890 1.00 . A A . 25 ALA HB1 1 1 11 6137 1 1 25 ALA HB2 H 9.765 14.349 14.922 1.00 . A A . 25 ALA HB2 1 1 11 6138 1 1 25 ALA HB3 H 8.419 13.659 15.861 1.00 . A A . 25 ALA HB3 1 1 11 6139 1 1 25 ALA N N 10.014 11.699 13.705 1.00 . A A . 25 ALA N 1 1 11 6140 1 1 25 ALA O O 9.362 13.914 12.137 1.00 . A A . 25 ALA O 1 1 11 6141 1 1 26 CYS C C 7.258 15.722 11.640 1.00 . A A . 26 CYS C 1 1 11 6142 1 1 26 CYS CA C 6.671 14.310 11.564 1.00 . A A . 26 CYS CA 1 1 11 6143 1 1 26 CYS CB C 5.141 14.328 11.562 1.00 . A A . 26 CYS CB 1 1 11 6144 1 1 26 CYS H H 6.507 13.123 13.267 1.00 . A A . 26 CYS H 1 1 11 6145 1 1 26 CYS HA H 6.991 13.807 10.651 1.00 . A A . 26 CYS HA 1 1 11 6146 1 1 26 CYS HB2 H 4.780 13.369 11.931 1.00 . A A . 26 CYS HB2 1 1 11 6147 1 1 26 CYS HB3 H 4.799 15.090 12.263 1.00 . A A . 26 CYS HB3 1 1 11 6148 1 1 26 CYS N N 7.199 13.537 12.675 1.00 . A A . 26 CYS N 1 1 11 6149 1 1 26 CYS O O 7.274 16.366 12.687 1.00 . A A . 26 CYS O 1 1 11 6150 1 1 26 CYS SG S 4.380 14.651 9.928 1.00 . A A . 26 CYS SG 1 1 11 6151 1 1 27 PRO C C 7.267 18.571 10.433 1.00 . A A . 27 PRO C 1 1 11 6152 1 1 27 PRO CA C 8.345 17.501 10.333 1.00 . A A . 27 PRO CA 1 1 11 6153 1 1 27 PRO CB C 8.970 17.480 8.940 1.00 . A A . 27 PRO CB 1 1 11 6154 1 1 27 PRO CD C 7.744 15.462 9.242 1.00 . A A . 27 PRO CD 1 1 11 6155 1 1 27 PRO CG C 8.048 16.508 8.172 1.00 . A A . 27 PRO CG 1 1 11 6156 1 1 27 PRO HA H 9.111 17.675 11.090 1.00 . A A . 27 PRO HA 1 1 11 6157 1 1 27 PRO HB2 H 8.979 18.467 8.476 1.00 . A A . 27 PRO HB2 1 1 11 6158 1 1 27 PRO HB3 H 9.980 17.075 9.004 1.00 . A A . 27 PRO HB3 1 1 11 6159 1 1 27 PRO HD2 H 6.781 14.986 9.057 1.00 . A A . 27 PRO HD2 1 1 11 6160 1 1 27 PRO HD3 H 8.538 14.715 9.263 1.00 . A A . 27 PRO HD3 1 1 11 6161 1 1 27 PRO HG2 H 7.111 16.924 7.800 1.00 . A A . 27 PRO HG2 1 1 11 6162 1 1 27 PRO HG3 H 8.643 16.103 7.353 1.00 . A A . 27 PRO HG3 1 1 11 6163 1 1 27 PRO N N 7.747 16.193 10.490 1.00 . A A . 27 PRO N 1 1 11 6164 1 1 27 PRO O O 7.597 19.754 10.362 1.00 . A A . 27 PRO O 1 1 11 6165 1 1 28 VAL C C 4.391 19.087 12.133 1.00 . A A . 28 VAL C 1 1 11 6166 1 1 28 VAL CA C 4.920 19.086 10.697 1.00 . A A . 28 VAL CA 1 1 11 6167 1 1 28 VAL CB C 3.843 18.747 9.663 1.00 . A A . 28 VAL CB 1 1 11 6168 1 1 28 VAL CG1 C 2.678 19.736 9.741 1.00 . A A . 28 VAL CG1 1 1 11 6169 1 1 28 VAL CG2 C 4.433 18.704 8.251 1.00 . A A . 28 VAL CG2 1 1 11 6170 1 1 28 VAL H H 5.763 17.182 10.650 1.00 . A A . 28 VAL H 1 1 11 6171 1 1 28 VAL HA H 5.309 20.078 10.466 1.00 . A A . 28 VAL HA 1 1 11 6172 1 1 28 VAL HB H 3.457 17.756 9.895 1.00 . A A . 28 VAL HB 1 1 11 6173 1 1 28 VAL HG11 H 2.938 20.551 10.416 1.00 . A A . 28 VAL HG11 1 1 11 6174 1 1 28 VAL HG12 H 2.476 20.138 8.748 1.00 . A A . 28 VAL HG12 1 1 11 6175 1 1 28 VAL HG13 H 1.791 19.224 10.114 1.00 . A A . 28 VAL HG13 1 1 11 6176 1 1 28 VAL HG21 H 5.019 19.607 8.076 1.00 . A A . 28 VAL HG21 1 1 11 6177 1 1 28 VAL HG22 H 5.075 17.829 8.153 1.00 . A A . 28 VAL HG22 1 1 11 6178 1 1 28 VAL HG23 H 3.625 18.646 7.522 1.00 . A A . 28 VAL HG23 1 1 11 6179 1 1 28 VAL N N 6.023 18.147 10.592 1.00 . A A . 28 VAL N 1 1 11 6180 1 1 28 VAL O O 4.884 19.831 12.979 1.00 . A A . 28 VAL O 1 1 11 6181 1 1 29 CYS C C 3.912 17.969 14.707 1.00 . A A . 29 CYS C 1 1 11 6182 1 1 29 CYS CA C 2.792 18.141 13.681 1.00 . A A . 29 CYS CA 1 1 11 6183 1 1 29 CYS CB C 1.774 16.999 13.748 1.00 . A A . 29 CYS CB 1 1 11 6184 1 1 29 CYS H H 2.997 17.646 11.668 1.00 . A A . 29 CYS H 1 1 11 6185 1 1 29 CYS HA H 2.248 19.070 13.853 1.00 . A A . 29 CYS HA 1 1 11 6186 1 1 29 CYS HB2 H 1.408 16.919 14.772 1.00 . A A . 29 CYS HB2 1 1 11 6187 1 1 29 CYS HB3 H 0.920 17.255 13.122 1.00 . A A . 29 CYS HB3 1 1 11 6188 1 1 29 CYS N N 3.393 18.246 12.362 1.00 . A A . 29 CYS N 1 1 11 6189 1 1 29 CYS O O 3.950 18.675 15.714 1.00 . A A . 29 CYS O 1 1 11 6190 1 1 29 CYS SG S 2.417 15.367 13.226 1.00 . A A . 29 CYS SG 1 1 11 6191 1 1 30 GLY C C 5.737 15.410 16.016 1.00 . A A . 30 GLY C 1 1 11 6192 1 1 30 GLY CA C 5.917 16.753 15.303 1.00 . A A . 30 GLY CA 1 1 11 6193 1 1 30 GLY H H 4.759 16.457 13.596 1.00 . A A . 30 GLY H 1 1 11 6194 1 1 30 GLY HA2 H 6.844 16.743 14.731 1.00 . A A . 30 GLY HA2 1 1 11 6195 1 1 30 GLY HA3 H 6.005 17.551 16.041 1.00 . A A . 30 GLY HA3 1 1 11 6196 1 1 30 GLY N N 4.798 17.027 14.418 1.00 . A A . 30 GLY N 1 1 11 6197 1 1 30 GLY O O 6.665 14.911 16.649 1.00 . A A . 30 GLY O 1 1 11 6198 1 1 31 ALA C C 5.271 12.555 16.098 1.00 . A A . 31 ALA C 1 1 11 6199 1 1 31 ALA CA C 4.222 13.590 16.510 1.00 . A A . 31 ALA CA 1 1 11 6200 1 1 31 ALA CB C 2.803 13.168 16.125 1.00 . A A . 31 ALA CB 1 1 11 6201 1 1 31 ALA H H 3.787 15.279 15.369 1.00 . A A . 31 ALA H 1 1 11 6202 1 1 31 ALA HA H 4.266 13.729 17.590 1.00 . A A . 31 ALA HA 1 1 11 6203 1 1 31 ALA HB1 H 2.766 12.086 16.004 1.00 . A A . 31 ALA HB1 1 1 11 6204 1 1 31 ALA HB2 H 2.109 13.472 16.908 1.00 . A A . 31 ALA HB2 1 1 11 6205 1 1 31 ALA HB3 H 2.524 13.649 15.187 1.00 . A A . 31 ALA HB3 1 1 11 6206 1 1 31 ALA N N 4.536 14.865 15.887 1.00 . A A . 31 ALA N 1 1 11 6207 1 1 31 ALA O O 6.016 12.767 15.143 1.00 . A A . 31 ALA O 1 1 11 6208 1 1 32 SER C C 5.661 9.439 15.508 1.00 . A A . 32 SER C 1 1 11 6209 1 1 32 SER CA C 6.238 10.387 16.562 1.00 . A A . 32 SER CA 1 1 11 6210 1 1 32 SER CB C 6.585 9.616 17.837 1.00 . A A . 32 SER CB 1 1 11 6211 1 1 32 SER H H 4.684 11.291 17.613 1.00 . A A . 32 SER H 1 1 11 6212 1 1 32 SER HA H 7.132 10.882 16.182 1.00 . A A . 32 SER HA 1 1 11 6213 1 1 32 SER HB2 H 7.393 8.915 17.627 1.00 . A A . 32 SER HB2 1 1 11 6214 1 1 32 SER HB3 H 6.955 10.311 18.591 1.00 . A A . 32 SER HB3 1 1 11 6215 1 1 32 SER HG H 4.616 9.370 18.095 1.00 . A A . 32 SER HG 1 1 11 6216 1 1 32 SER N N 5.294 11.456 16.838 1.00 . A A . 32 SER N 1 1 11 6217 1 1 32 SER O O 4.519 9.601 15.082 1.00 . A A . 32 SER O 1 1 11 6218 1 1 32 SER OG O 5.463 8.906 18.354 1.00 . A A . 32 SER OG 1 1 11 6219 1 1 33 LYS C C 5.123 6.478 14.775 1.00 . A A . 33 LYS C 1 1 11 6220 1 1 33 LYS CA C 6.063 7.495 14.125 1.00 . A A . 33 LYS CA 1 1 11 6221 1 1 33 LYS CB C 7.283 6.864 13.453 1.00 . A A . 33 LYS CB 1 1 11 6222 1 1 33 LYS CD C 8.076 5.403 11.556 1.00 . A A . 33 LYS CD 1 1 11 6223 1 1 33 LYS CE C 8.511 6.414 10.493 1.00 . A A . 33 LYS CE 1 1 11 6224 1 1 33 LYS CG C 6.859 5.912 12.333 1.00 . A A . 33 LYS CG 1 1 11 6225 1 1 33 LYS H H 7.405 8.346 15.472 1.00 . A A . 33 LYS H 1 1 11 6226 1 1 33 LYS HA H 5.510 8.032 13.354 1.00 . A A . 33 LYS HA 1 1 11 6227 1 1 33 LYS HB2 H 7.924 7.646 13.047 1.00 . A A . 33 LYS HB2 1 1 11 6228 1 1 33 LYS HB3 H 7.871 6.322 14.193 1.00 . A A . 33 LYS HB3 1 1 11 6229 1 1 33 LYS HD2 H 8.900 5.218 12.245 1.00 . A A . 33 LYS HD2 1 1 11 6230 1 1 33 LYS HD3 H 7.838 4.451 11.082 1.00 . A A . 33 LYS HD3 1 1 11 6231 1 1 33 LYS HE2 H 7.671 7.057 10.230 1.00 . A A . 33 LYS HE2 1 1 11 6232 1 1 33 LYS HE3 H 9.292 7.059 10.894 1.00 . A A . 33 LYS HE3 1 1 11 6233 1 1 33 LYS HG2 H 6.314 5.068 12.754 1.00 . A A . 33 LYS HG2 1 1 11 6234 1 1 33 LYS HG3 H 6.179 6.423 11.653 1.00 . A A . 33 LYS HG3 1 1 11 6235 1 1 33 LYS HZ1 H 9.315 6.366 8.571 1.00 . A A . 33 LYS HZ1 1 1 11 6236 1 1 33 LYS HZ2 H 9.794 5.111 9.494 1.00 . A A . 33 LYS HZ2 1 1 11 6237 1 1 33 LYS N N 6.477 8.471 15.121 1.00 . A A . 33 LYS N 1 1 11 6238 1 1 33 LYS NZ N 9.006 5.716 9.286 1.00 . A A . 33 LYS NZ 1 1 11 6239 1 1 33 LYS O O 5.372 5.275 14.720 1.00 . A A . 33 LYS O 1 1 11 6240 1 1 34 ASP C C 1.742 6.268 15.310 1.00 . A A . 34 ASP C 1 1 11 6241 1 1 34 ASP CA C 3.085 6.150 16.035 1.00 . A A . 34 ASP CA 1 1 11 6242 1 1 34 ASP CB C 2.876 6.578 17.489 1.00 . A A . 34 ASP CB 1 1 11 6243 1 1 34 ASP CG C 1.927 5.688 18.295 1.00 . A A . 34 ASP CG 1 1 11 6244 1 1 34 ASP H H 3.868 7.979 15.415 1.00 . A A . 34 ASP H 1 1 11 6245 1 1 34 ASP HA H 3.498 5.143 15.985 1.00 . A A . 34 ASP HA 1 1 11 6246 1 1 34 ASP HB2 H 3.844 6.598 17.989 1.00 . A A . 34 ASP HB2 1 1 11 6247 1 1 34 ASP HB3 H 2.491 7.598 17.501 1.00 . A A . 34 ASP HB3 1 1 11 6248 1 1 34 ASP HD2 H 0.897 6.202 19.785 1.00 . A A . 34 ASP HD2 1 1 11 6249 1 1 34 ASP N N 4.062 6.998 15.376 1.00 . A A . 34 ASP N 1 1 11 6250 1 1 34 ASP O O 1.124 5.259 14.974 1.00 . A A . 34 ASP O 1 1 11 6251 1 1 34 ASP OD1 O 2.158 4.479 18.443 1.00 . A A . 34 ASP OD1 1 1 11 6252 1 1 34 ASP OD2 O 0.901 6.293 18.789 1.00 . A A . 34 ASP OD2 1 1 11 6253 1 1 35 ALA C C 0.198 7.367 12.942 1.00 . A A . 35 ALA C 1 1 11 6254 1 1 35 ALA CA C 0.073 7.771 14.413 1.00 . A A . 35 ALA CA 1 1 11 6255 1 1 35 ALA CB C -0.300 9.245 14.582 1.00 . A A . 35 ALA CB 1 1 11 6256 1 1 35 ALA H H 1.840 8.324 15.369 1.00 . A A . 35 ALA H 1 1 11 6257 1 1 35 ALA HA H -0.694 7.158 14.886 1.00 . A A . 35 ALA HA 1 1 11 6258 1 1 35 ALA HB1 H 0.056 9.601 15.549 1.00 . A A . 35 ALA HB1 1 1 11 6259 1 1 35 ALA HB2 H 0.160 9.831 13.787 1.00 . A A . 35 ALA HB2 1 1 11 6260 1 1 35 ALA HB3 H -1.384 9.353 14.534 1.00 . A A . 35 ALA HB3 1 1 11 6261 1 1 35 ALA N N 1.331 7.508 15.091 1.00 . A A . 35 ALA N 1 1 11 6262 1 1 35 ALA O O -0.800 7.063 12.292 1.00 . A A . 35 ALA O 1 1 11 6263 1 1 36 PHE C C 1.256 5.581 10.792 1.00 . A A . 36 PHE C 1 1 11 6264 1 1 36 PHE CA C 1.701 7.016 11.080 1.00 . A A . 36 PHE CA 1 1 11 6265 1 1 36 PHE CB C 3.214 7.119 10.877 1.00 . A A . 36 PHE CB 1 1 11 6266 1 1 36 PHE CD1 C 3.916 9.395 11.649 1.00 . A A . 36 PHE CD1 1 1 11 6267 1 1 36 PHE CD2 C 3.947 8.952 9.336 1.00 . A A . 36 PHE CD2 1 1 11 6268 1 1 36 PHE CE1 C 4.377 10.716 11.402 1.00 . A A . 36 PHE CE1 1 1 11 6269 1 1 36 PHE CE2 C 4.408 10.272 9.090 1.00 . A A . 36 PHE CE2 1 1 11 6270 1 1 36 PHE CG C 3.711 8.542 10.610 1.00 . A A . 36 PHE CG 1 1 11 6271 1 1 36 PHE CZ C 4.614 11.126 10.128 1.00 . A A . 36 PHE CZ 1 1 11 6272 1 1 36 PHE H H 2.240 7.627 12.997 1.00 . A A . 36 PHE H 1 1 11 6273 1 1 36 PHE HA H 1.135 7.703 10.450 1.00 . A A . 36 PHE HA 1 1 11 6274 1 1 36 PHE HB2 H 3.717 6.729 11.762 1.00 . A A . 36 PHE HB2 1 1 11 6275 1 1 36 PHE HB3 H 3.502 6.483 10.040 1.00 . A A . 36 PHE HB3 1 1 11 6276 1 1 36 PHE HD1 H 3.727 9.067 12.671 1.00 . A A . 36 PHE HD1 1 1 11 6277 1 1 36 PHE HD2 H 3.782 8.267 8.504 1.00 . A A . 36 PHE HD2 1 1 11 6278 1 1 36 PHE HE1 H 4.542 11.400 12.235 1.00 . A A . 36 PHE HE1 1 1 11 6279 1 1 36 PHE HE2 H 4.597 10.602 8.067 1.00 . A A . 36 PHE HE2 1 1 11 6280 1 1 36 PHE HZ H 4.968 12.139 9.938 1.00 . A A . 36 PHE HZ 1 1 11 6281 1 1 36 PHE N N 1.433 7.378 12.462 1.00 . A A . 36 PHE N 1 1 11 6282 1 1 36 PHE O O 1.551 4.669 11.564 1.00 . A A . 36 PHE O 1 1 11 6283 1 1 37 GLU C C 0.499 3.802 7.848 1.00 . A A . 37 GLU C 1 1 11 6284 1 1 37 GLU CA C 0.065 4.116 9.281 1.00 . A A . 37 GLU CA 1 1 11 6285 1 1 37 GLU CB C -1.456 4.031 9.425 1.00 . A A . 37 GLU CB 1 1 11 6286 1 1 37 GLU CD C -3.187 2.602 10.574 1.00 . A A . 37 GLU CD 1 1 11 6287 1 1 37 GLU CG C -1.897 2.603 9.752 1.00 . A A . 37 GLU CG 1 1 11 6288 1 1 37 GLU H H 0.318 6.172 9.058 1.00 . A A . 37 GLU H 1 1 11 6289 1 1 37 GLU HA H 0.529 3.411 9.971 1.00 . A A . 37 GLU HA 1 1 11 6290 1 1 37 GLU HB2 H -1.789 4.707 10.212 1.00 . A A . 37 GLU HB2 1 1 11 6291 1 1 37 GLU HB3 H -1.931 4.360 8.501 1.00 . A A . 37 GLU HB3 1 1 11 6292 1 1 37 GLU HE2 H -4.494 3.113 9.320 1.00 . A A . 37 GLU HE2 1 1 11 6293 1 1 37 GLU HG2 H -2.051 2.046 8.827 1.00 . A A . 37 GLU HG2 1 1 11 6294 1 1 37 GLU HG3 H -1.108 2.092 10.304 1.00 . A A . 37 GLU HG3 1 1 11 6295 1 1 37 GLU N N 0.554 5.425 9.680 1.00 . A A . 37 GLU N 1 1 11 6296 1 1 37 GLU O O 0.685 4.710 7.039 1.00 . A A . 37 GLU O 1 1 11 6297 1 1 37 GLU OE1 O -3.146 2.844 11.790 1.00 . A A . 37 GLU OE1 1 1 11 6298 1 1 37 GLU OE2 O -4.259 2.339 9.908 1.00 . A A . 37 GLU OE2 1 1 11 6299 1 1 38 LYS C C -0.176 1.969 5.352 1.00 . A A . 38 LYS C 1 1 11 6300 1 1 38 LYS CA C 1.054 2.068 6.255 1.00 . A A . 38 LYS CA 1 1 11 6301 1 1 38 LYS CB C 1.853 0.766 6.352 1.00 . A A . 38 LYS CB 1 1 11 6302 1 1 38 LYS CD C 1.914 -0.120 3.991 1.00 . A A . 38 LYS CD 1 1 11 6303 1 1 38 LYS CE C 2.180 -1.626 3.964 1.00 . A A . 38 LYS CE 1 1 11 6304 1 1 38 LYS CG C 2.715 0.558 5.104 1.00 . A A . 38 LYS CG 1 1 11 6305 1 1 38 LYS H H 0.493 1.781 8.241 1.00 . A A . 38 LYS H 1 1 11 6306 1 1 38 LYS HA H 1.723 2.826 5.847 1.00 . A A . 38 LYS HA 1 1 11 6307 1 1 38 LYS HB2 H 2.487 0.788 7.237 1.00 . A A . 38 LYS HB2 1 1 11 6308 1 1 38 LYS HB3 H 1.169 -0.075 6.470 1.00 . A A . 38 LYS HB3 1 1 11 6309 1 1 38 LYS HD2 H 0.849 0.063 4.140 1.00 . A A . 38 LYS HD2 1 1 11 6310 1 1 38 LYS HD3 H 2.180 0.318 3.029 1.00 . A A . 38 LYS HD3 1 1 11 6311 1 1 38 LYS HE2 H 1.776 -2.055 3.046 1.00 . A A . 38 LYS HE2 1 1 11 6312 1 1 38 LYS HE3 H 3.253 -1.812 3.958 1.00 . A A . 38 LYS HE3 1 1 11 6313 1 1 38 LYS HG2 H 3.091 1.519 4.754 1.00 . A A . 38 LYS HG2 1 1 11 6314 1 1 38 LYS HG3 H 3.582 -0.051 5.356 1.00 . A A . 38 LYS HG3 1 1 11 6315 1 1 38 LYS HZ1 H 2.225 -2.405 5.896 1.00 . A A . 38 LYS HZ1 1 1 11 6316 1 1 38 LYS HZ2 H 0.787 -1.744 5.510 1.00 . A A . 38 LYS HZ2 1 1 11 6317 1 1 38 LYS N N 0.646 2.513 7.577 1.00 . A A . 38 LYS N 1 1 11 6318 1 1 38 LYS NZ N 1.563 -2.283 5.138 1.00 . A A . 38 LYS NZ 1 1 11 6319 1 1 38 LYS O O -0.972 1.040 5.480 1.00 . A A . 38 LYS O 1 1 11 6320 1 1 39 GLN C C -0.967 3.517 2.177 1.00 . A A . 39 GLN C 1 1 11 6321 1 1 39 GLN CA C -1.416 2.976 3.535 1.00 . A A . 39 GLN CA 1 1 11 6322 1 1 39 GLN CB C -2.569 3.806 4.102 1.00 . A A . 39 GLN CB 1 1 11 6323 1 1 39 GLN CD C -3.813 2.084 5.460 1.00 . A A . 39 GLN CD 1 1 11 6324 1 1 39 GLN CG C -3.844 2.969 4.213 1.00 . A A . 39 GLN CG 1 1 11 6325 1 1 39 GLN H H 0.357 3.694 4.362 1.00 . A A . 39 GLN H 1 1 11 6326 1 1 39 GLN HA H -1.738 1.940 3.433 1.00 . A A . 39 GLN HA 1 1 11 6327 1 1 39 GLN HB2 H -2.295 4.191 5.085 1.00 . A A . 39 GLN HB2 1 1 11 6328 1 1 39 GLN HB3 H -2.750 4.669 3.462 1.00 . A A . 39 GLN HB3 1 1 11 6329 1 1 39 GLN HE21 H -3.755 0.462 4.249 1.00 . A A . 39 GLN HE21 1 1 11 6330 1 1 39 GLN HE22 H -3.742 0.119 5.948 1.00 . A A . 39 GLN HE22 1 1 11 6331 1 1 39 GLN HG2 H -4.713 3.627 4.252 1.00 . A A . 39 GLN HG2 1 1 11 6332 1 1 39 GLN HG3 H -3.955 2.347 3.324 1.00 . A A . 39 GLN HG3 1 1 11 6333 1 1 39 GLN N N -0.295 2.941 4.460 1.00 . A A . 39 GLN N 1 1 11 6334 1 1 39 GLN NE2 N -3.767 0.780 5.198 1.00 . A A . 39 GLN NE2 1 1 11 6335 1 1 39 GLN O O -1.795 3.797 1.311 1.00 . A A . 39 GLN O 1 1 11 6336 1 1 39 GLN OE1 O -3.829 2.552 6.586 1.00 . A A . 39 GLN OE1 1 1 12 6337 1 1 1 MET C C 5.638 1.713 -1.603 1.00 . A A . 1 MET C 1 1 12 6338 1 1 1 MET CA C 5.811 1.415 -3.094 1.00 . A A . 1 MET CA 1 1 12 6339 1 1 1 MET CB C 6.515 0.068 -3.267 1.00 . A A . 1 MET CB 1 1 12 6340 1 1 1 MET CE C 6.478 -3.310 -4.691 1.00 . A A . 1 MET CE 1 1 12 6341 1 1 1 MET CG C 6.100 -0.603 -4.578 1.00 . A A . 1 MET CG 1 1 12 6342 1 1 1 MET H1 H 6.217 3.380 -3.653 1.00 . A A . 1 MET H1 1 1 12 6343 1 1 1 MET HA H 4.839 1.421 -3.587 1.00 . A A . 1 MET HA 1 1 12 6344 1 1 1 MET HB2 H 7.595 0.214 -3.254 1.00 . A A . 1 MET HB2 1 1 12 6345 1 1 1 MET HB3 H 6.272 -0.584 -2.428 1.00 . A A . 1 MET HB3 1 1 12 6346 1 1 1 MET HE1 H 5.609 -3.408 -5.341 1.00 . A A . 1 MET HE1 1 1 12 6347 1 1 1 MET HE2 H 7.147 -4.155 -4.849 1.00 . A A . 1 MET HE2 1 1 12 6348 1 1 1 MET HE3 H 6.154 -3.291 -3.651 1.00 . A A . 1 MET HE3 1 1 12 6349 1 1 1 MET HG2 H 5.138 -1.098 -4.454 1.00 . A A . 1 MET HG2 1 1 12 6350 1 1 1 MET HG3 H 5.975 0.149 -5.356 1.00 . A A . 1 MET HG3 1 1 12 6351 1 1 1 MET N N 6.587 2.455 -3.746 1.00 . A A . 1 MET N 1 1 12 6352 1 1 1 MET O O 6.570 2.173 -0.946 1.00 . A A . 1 MET O 1 1 12 6353 1 1 1 MET SD S 7.337 -1.791 -5.073 1.00 . A A . 1 MET SD 1 1 12 6354 1 1 2 ASP C C 4.228 3.169 0.585 1.00 . A A . 2 ASP C 1 1 12 6355 1 1 2 ASP CA C 4.131 1.671 0.289 1.00 . A A . 2 ASP CA 1 1 12 6356 1 1 2 ASP CB C 5.124 0.945 1.199 1.00 . A A . 2 ASP CB 1 1 12 6357 1 1 2 ASP CG C 4.576 -0.310 1.881 1.00 . A A . 2 ASP CG 1 1 12 6358 1 1 2 ASP H H 3.685 1.064 -1.653 1.00 . A A . 2 ASP H 1 1 12 6359 1 1 2 ASP HA H 3.123 1.283 0.429 1.00 . A A . 2 ASP HA 1 1 12 6360 1 1 2 ASP HB2 H 5.998 0.668 0.608 1.00 . A A . 2 ASP HB2 1 1 12 6361 1 1 2 ASP HB3 H 5.465 1.639 1.966 1.00 . A A . 2 ASP HB3 1 1 12 6362 1 1 2 ASP HD2 H 5.264 0.096 3.586 1.00 . A A . 2 ASP HD2 1 1 12 6363 1 1 2 ASP N N 4.438 1.439 -1.112 1.00 . A A . 2 ASP N 1 1 12 6364 1 1 2 ASP O O 5.174 3.831 0.160 1.00 . A A . 2 ASP O 1 1 12 6365 1 1 2 ASP OD1 O 3.597 -0.914 1.418 1.00 . A A . 2 ASP OD1 1 1 12 6366 1 1 2 ASP OD2 O 5.207 -0.670 2.946 1.00 . A A . 2 ASP OD2 1 1 12 6367 1 1 3 ILE C C 2.749 5.208 3.127 1.00 . A A . 3 ILE C 1 1 12 6368 1 1 3 ILE CA C 3.196 5.070 1.671 1.00 . A A . 3 ILE CA 1 1 12 6369 1 1 3 ILE CB C 2.327 5.849 0.682 1.00 . A A . 3 ILE CB 1 1 12 6370 1 1 3 ILE CD1 C 1.980 5.985 -1.812 1.00 . A A . 3 ILE CD1 1 1 12 6371 1 1 3 ILE CG1 C 3.011 5.958 -0.682 1.00 . A A . 3 ILE CG1 1 1 12 6372 1 1 3 ILE CG2 C 1.953 7.222 1.246 1.00 . A A . 3 ILE CG2 1 1 12 6373 1 1 3 ILE H H 2.470 3.117 1.654 1.00 . A A . 3 ILE H 1 1 12 6374 1 1 3 ILE HA H 4.212 5.456 1.583 1.00 . A A . 3 ILE HA 1 1 12 6375 1 1 3 ILE HB H 1.399 5.298 0.535 1.00 . A A . 3 ILE HB 1 1 12 6376 1 1 3 ILE HD11 H 2.486 5.859 -2.769 1.00 . A A . 3 ILE HD11 1 1 12 6377 1 1 3 ILE HD12 H 1.265 5.174 -1.670 1.00 . A A . 3 ILE HD12 1 1 12 6378 1 1 3 ILE HD13 H 1.454 6.939 -1.802 1.00 . A A . 3 ILE HD13 1 1 12 6379 1 1 3 ILE HG12 H 3.618 6.863 -0.718 1.00 . A A . 3 ILE HG12 1 1 12 6380 1 1 3 ILE HG13 H 3.688 5.115 -0.822 1.00 . A A . 3 ILE HG13 1 1 12 6381 1 1 3 ILE HG21 H 1.460 7.810 0.472 1.00 . A A . 3 ILE HG21 1 1 12 6382 1 1 3 ILE HG22 H 1.276 7.094 2.091 1.00 . A A . 3 ILE HG22 1 1 12 6383 1 1 3 ILE HG23 H 2.854 7.737 1.576 1.00 . A A . 3 ILE HG23 1 1 12 6384 1 1 3 ILE N N 3.235 3.661 1.313 1.00 . A A . 3 ILE N 1 1 12 6385 1 1 3 ILE O O 1.865 4.502 3.608 1.00 . A A . 3 ILE O 1 1 12 6386 1 1 4 TYR C C 2.546 7.821 5.379 1.00 . A A . 4 TYR C 1 1 12 6387 1 1 4 TYR CA C 3.080 6.404 5.219 1.00 . A A . 4 TYR CA 1 1 12 6388 1 1 4 TYR CB C 4.337 6.202 6.060 1.00 . A A . 4 TYR CB 1 1 12 6389 1 1 4 TYR CD1 C 3.790 4.113 7.360 1.00 . A A . 4 TYR CD1 1 1 12 6390 1 1 4 TYR CD2 C 5.647 4.064 5.802 1.00 . A A . 4 TYR CD2 1 1 12 6391 1 1 4 TYR CE1 C 4.031 2.774 7.690 1.00 . A A . 4 TYR CE1 1 1 12 6392 1 1 4 TYR CE2 C 5.888 2.725 6.131 1.00 . A A . 4 TYR CE2 1 1 12 6393 1 1 4 TYR CG C 4.598 4.757 6.416 1.00 . A A . 4 TYR CG 1 1 12 6394 1 1 4 TYR CZ C 5.080 2.080 7.075 1.00 . A A . 4 TYR CZ 1 1 12 6395 1 1 4 TYR H H 4.106 6.704 3.383 1.00 . A A . 4 TYR H 1 1 12 6396 1 1 4 TYR HA H 2.316 5.699 5.549 1.00 . A A . 4 TYR HA 1 1 12 6397 1 1 4 TYR HB2 H 5.194 6.583 5.505 1.00 . A A . 4 TYR HB2 1 1 12 6398 1 1 4 TYR HB3 H 4.235 6.774 6.982 1.00 . A A . 4 TYR HB3 1 1 12 6399 1 1 4 TYR HD1 H 2.981 4.648 7.834 1.00 . A A . 4 TYR HD1 1 1 12 6400 1 1 4 TYR HD2 H 6.270 4.561 5.073 1.00 . A A . 4 TYR HD2 1 1 12 6401 1 1 4 TYR HE1 H 3.408 2.275 8.419 1.00 . A A . 4 TYR HE1 1 1 12 6402 1 1 4 TYR HE2 H 6.697 2.189 5.657 1.00 . A A . 4 TYR HE2 1 1 12 6403 1 1 4 TYR HH H 6.248 0.549 7.393 1.00 . A A . 4 TYR HH 1 1 12 6404 1 1 4 TYR N N 3.387 6.149 3.826 1.00 . A A . 4 TYR N 1 1 12 6405 1 1 4 TYR O O 3.346 8.748 5.497 1.00 . A A . 4 TYR O 1 1 12 6406 1 1 4 TYR OH O 5.315 0.775 7.396 1.00 . A A . 4 TYR OH 1 1 12 6407 1 1 5 VAL C C 0.298 9.518 7.004 1.00 . A A . 5 VAL C 1 1 12 6408 1 1 5 VAL CA C 0.617 9.271 5.527 1.00 . A A . 5 VAL CA 1 1 12 6409 1 1 5 VAL CB C -0.614 9.378 4.624 1.00 . A A . 5 VAL CB 1 1 12 6410 1 1 5 VAL CG1 C -1.318 10.723 4.813 1.00 . A A . 5 VAL CG1 1 1 12 6411 1 1 5 VAL CG2 C -0.238 9.156 3.158 1.00 . A A . 5 VAL CG2 1 1 12 6412 1 1 5 VAL H H 0.585 7.203 5.285 1.00 . A A . 5 VAL H 1 1 12 6413 1 1 5 VAL HA H 1.343 10.014 5.197 1.00 . A A . 5 VAL HA 1 1 12 6414 1 1 5 VAL HB H -1.311 8.592 4.914 1.00 . A A . 5 VAL HB 1 1 12 6415 1 1 5 VAL HG11 H -2.395 10.564 4.868 1.00 . A A . 5 VAL HG11 1 1 12 6416 1 1 5 VAL HG12 H -0.971 11.188 5.736 1.00 . A A . 5 VAL HG12 1 1 12 6417 1 1 5 VAL HG13 H -1.088 11.374 3.970 1.00 . A A . 5 VAL HG13 1 1 12 6418 1 1 5 VAL HG21 H -0.525 10.031 2.573 1.00 . A A . 5 VAL HG21 1 1 12 6419 1 1 5 VAL HG22 H 0.838 9.002 3.078 1.00 . A A . 5 VAL HG22 1 1 12 6420 1 1 5 VAL HG23 H -0.761 8.278 2.778 1.00 . A A . 5 VAL HG23 1 1 12 6421 1 1 5 VAL N N 1.229 7.962 5.380 1.00 . A A . 5 VAL N 1 1 12 6422 1 1 5 VAL O O -0.442 8.752 7.618 1.00 . A A . 5 VAL O 1 1 12 6423 1 1 6 CYS C C -0.847 11.079 9.157 1.00 . A A . 6 CYS C 1 1 12 6424 1 1 6 CYS CA C 0.659 10.948 8.921 1.00 . A A . 6 CYS CA 1 1 12 6425 1 1 6 CYS CB C 1.409 12.225 9.298 1.00 . A A . 6 CYS CB 1 1 12 6426 1 1 6 CYS H H 1.473 11.208 7.022 1.00 . A A . 6 CYS H 1 1 12 6427 1 1 6 CYS HA H 1.075 10.137 9.519 1.00 . A A . 6 CYS HA 1 1 12 6428 1 1 6 CYS HB2 H 2.431 12.154 8.927 1.00 . A A . 6 CYS HB2 1 1 12 6429 1 1 6 CYS HB3 H 0.943 13.068 8.788 1.00 . A A . 6 CYS HB3 1 1 12 6430 1 1 6 CYS N N 0.872 10.590 7.529 1.00 . A A . 6 CYS N 1 1 12 6431 1 1 6 CYS O O -1.599 11.391 8.236 1.00 . A A . 6 CYS O 1 1 12 6432 1 1 6 CYS SG S 1.462 12.583 11.092 1.00 . A A . 6 CYS SG 1 1 12 6433 1 1 7 THR C C -2.882 12.126 11.681 1.00 . A A . 7 THR C 1 1 12 6434 1 1 7 THR CA C -2.645 10.922 10.768 1.00 . A A . 7 THR CA 1 1 12 6435 1 1 7 THR CB C -3.051 9.589 11.401 1.00 . A A . 7 THR CB 1 1 12 6436 1 1 7 THR CG2 C -2.937 8.417 10.424 1.00 . A A . 7 THR CG2 1 1 12 6437 1 1 7 THR H H -0.625 10.581 11.143 1.00 . A A . 7 THR H 1 1 12 6438 1 1 7 THR HA H -3.229 11.087 9.863 1.00 . A A . 7 THR HA 1 1 12 6439 1 1 7 THR HB H -4.054 9.648 11.822 1.00 . A A . 7 THR HB 1 1 12 6440 1 1 7 THR HG1 H -2.068 10.027 13.088 1.00 . A A . 7 THR HG1 1 1 12 6441 1 1 7 THR HG21 H -2.009 8.504 9.860 1.00 . A A . 7 THR HG21 1 1 12 6442 1 1 7 THR HG22 H -2.939 7.479 10.979 1.00 . A A . 7 THR HG22 1 1 12 6443 1 1 7 THR HG23 H -3.783 8.434 9.737 1.00 . A A . 7 THR HG23 1 1 12 6444 1 1 7 THR N N -1.243 10.834 10.398 1.00 . A A . 7 THR N 1 1 12 6445 1 1 7 THR O O -3.921 12.221 12.332 1.00 . A A . 7 THR O 1 1 12 6446 1 1 7 THR OG1 O -2.032 9.338 12.364 1.00 . A A . 7 THR OG1 1 1 12 6447 1 1 8 VAL C C -2.120 15.438 11.620 1.00 . A A . 8 VAL C 1 1 12 6448 1 1 8 VAL CA C -1.989 14.210 12.522 1.00 . A A . 8 VAL CA 1 1 12 6449 1 1 8 VAL CB C -0.787 14.287 13.466 1.00 . A A . 8 VAL CB 1 1 12 6450 1 1 8 VAL CG1 C -0.815 15.577 14.287 1.00 . A A . 8 VAL CG1 1 1 12 6451 1 1 8 VAL CG2 C -0.725 13.058 14.376 1.00 . A A . 8 VAL CG2 1 1 12 6452 1 1 8 VAL H H -1.058 12.931 11.167 1.00 . A A . 8 VAL H 1 1 12 6453 1 1 8 VAL HA H -2.890 14.124 13.131 1.00 . A A . 8 VAL HA 1 1 12 6454 1 1 8 VAL HB H 0.117 14.296 12.856 1.00 . A A . 8 VAL HB 1 1 12 6455 1 1 8 VAL HG11 H -1.411 16.326 13.765 1.00 . A A . 8 VAL HG11 1 1 12 6456 1 1 8 VAL HG12 H -1.255 15.377 15.263 1.00 . A A . 8 VAL HG12 1 1 12 6457 1 1 8 VAL HG13 H 0.202 15.948 14.415 1.00 . A A . 8 VAL HG13 1 1 12 6458 1 1 8 VAL HG21 H -1.675 12.525 14.331 1.00 . A A . 8 VAL HG21 1 1 12 6459 1 1 8 VAL HG22 H 0.078 12.400 14.045 1.00 . A A . 8 VAL HG22 1 1 12 6460 1 1 8 VAL HG23 H -0.534 13.376 15.402 1.00 . A A . 8 VAL HG23 1 1 12 6461 1 1 8 VAL N N -1.901 13.016 11.700 1.00 . A A . 8 VAL N 1 1 12 6462 1 1 8 VAL O O -3.039 16.239 11.784 1.00 . A A . 8 VAL O 1 1 12 6463 1 1 9 CYS C C -1.558 16.136 8.370 1.00 . A A . 9 CYS C 1 1 12 6464 1 1 9 CYS CA C -1.186 16.664 9.757 1.00 . A A . 9 CYS CA 1 1 12 6465 1 1 9 CYS CB C 0.160 17.391 9.747 1.00 . A A . 9 CYS CB 1 1 12 6466 1 1 9 CYS H H -0.442 14.891 10.559 1.00 . A A . 9 CYS H 1 1 12 6467 1 1 9 CYS HA H -1.934 17.371 10.115 1.00 . A A . 9 CYS HA 1 1 12 6468 1 1 9 CYS HB2 H 0.241 17.966 8.824 1.00 . A A . 9 CYS HB2 1 1 12 6469 1 1 9 CYS HB3 H 0.178 18.106 10.569 1.00 . A A . 9 CYS HB3 1 1 12 6470 1 1 9 CYS N N -1.186 15.547 10.686 1.00 . A A . 9 CYS N 1 1 12 6471 1 1 9 CYS O O -1.967 16.902 7.499 1.00 . A A . 9 CYS O 1 1 12 6472 1 1 9 CYS SG S 1.623 16.300 9.887 1.00 . A A . 9 CYS SG 1 1 12 6473 1 1 10 GLY C C -0.481 14.095 6.052 1.00 . A A . 10 GLY C 1 1 12 6474 1 1 10 GLY CA C -1.721 14.190 6.943 1.00 . A A . 10 GLY CA 1 1 12 6475 1 1 10 GLY H H -1.072 14.214 8.922 1.00 . A A . 10 GLY H 1 1 12 6476 1 1 10 GLY HA2 H -2.119 13.192 7.125 1.00 . A A . 10 GLY HA2 1 1 12 6477 1 1 10 GLY HA3 H -2.499 14.755 6.429 1.00 . A A . 10 GLY HA3 1 1 12 6478 1 1 10 GLY N N -1.406 14.830 8.208 1.00 . A A . 10 GLY N 1 1 12 6479 1 1 10 GLY O O -0.547 13.747 4.875 1.00 . A A . 10 GLY O 1 1 12 6480 1 1 11 TYR C C 1.981 13.161 5.033 1.00 . A A . 11 TYR C 1 1 12 6481 1 1 11 TYR CA C 1.933 14.380 5.941 1.00 . A A . 11 TYR CA 1 1 12 6482 1 1 11 TYR CB C 3.078 14.349 6.950 1.00 . A A . 11 TYR CB 1 1 12 6483 1 1 11 TYR CD1 C 4.656 15.455 5.325 1.00 . A A . 11 TYR CD1 1 1 12 6484 1 1 11 TYR CD2 C 5.493 13.662 6.727 1.00 . A A . 11 TYR CD2 1 1 12 6485 1 1 11 TYR CE1 C 5.920 15.587 4.740 1.00 . A A . 11 TYR CE1 1 1 12 6486 1 1 11 TYR CE2 C 6.757 13.793 6.140 1.00 . A A . 11 TYR CE2 1 1 12 6487 1 1 11 TYR CG C 4.442 14.492 6.318 1.00 . A A . 11 TYR CG 1 1 12 6488 1 1 11 TYR CZ C 6.971 14.757 5.147 1.00 . A A . 11 TYR CZ 1 1 12 6489 1 1 11 TYR H H 0.670 14.698 7.619 1.00 . A A . 11 TYR H 1 1 12 6490 1 1 11 TYR HA H 2.024 15.279 5.332 1.00 . A A . 11 TYR HA 1 1 12 6491 1 1 11 TYR HB2 H 2.937 15.161 7.663 1.00 . A A . 11 TYR HB2 1 1 12 6492 1 1 11 TYR HB3 H 3.041 13.401 7.489 1.00 . A A . 11 TYR HB3 1 1 12 6493 1 1 11 TYR HD1 H 3.845 16.096 5.011 1.00 . A A . 11 TYR HD1 1 1 12 6494 1 1 11 TYR HD2 H 5.327 12.919 7.493 1.00 . A A . 11 TYR HD2 1 1 12 6495 1 1 11 TYR HE1 H 6.085 16.330 3.973 1.00 . A A . 11 TYR HE1 1 1 12 6496 1 1 11 TYR HE2 H 7.568 13.153 6.455 1.00 . A A . 11 TYR HE2 1 1 12 6497 1 1 11 TYR HH H 8.834 14.235 4.894 1.00 . A A . 11 TYR HH 1 1 12 6498 1 1 11 TYR N N 0.669 14.417 6.649 1.00 . A A . 11 TYR N 1 1 12 6499 1 1 11 TYR O O 1.250 12.204 5.283 1.00 . A A . 11 TYR O 1 1 12 6500 1 1 11 TYR OH O 8.203 14.885 4.576 1.00 . A A . 11 TYR OH 1 1 12 6501 1 1 12 GLU C C 4.413 11.691 2.941 1.00 . A A . 12 GLU C 1 1 12 6502 1 1 12 GLU CA C 2.947 12.102 3.085 1.00 . A A . 12 GLU CA 1 1 12 6503 1 1 12 GLU CB C 2.339 12.453 1.725 1.00 . A A . 12 GLU CB 1 1 12 6504 1 1 12 GLU CD C 0.377 12.120 0.177 1.00 . A A . 12 GLU CD 1 1 12 6505 1 1 12 GLU CG C 0.990 11.759 1.532 1.00 . A A . 12 GLU CG 1 1 12 6506 1 1 12 GLU H H 3.415 13.996 3.816 1.00 . A A . 12 GLU H 1 1 12 6507 1 1 12 GLU HA H 2.376 11.287 3.531 1.00 . A A . 12 GLU HA 1 1 12 6508 1 1 12 GLU HB2 H 2.212 13.533 1.647 1.00 . A A . 12 GLU HB2 1 1 12 6509 1 1 12 GLU HB3 H 3.023 12.155 0.930 1.00 . A A . 12 GLU HB3 1 1 12 6510 1 1 12 GLU HE2 H -0.883 13.453 0.603 1.00 . A A . 12 GLU HE2 1 1 12 6511 1 1 12 GLU HG2 H 1.119 10.680 1.602 1.00 . A A . 12 GLU HG2 1 1 12 6512 1 1 12 GLU HG3 H 0.310 12.051 2.332 1.00 . A A . 12 GLU HG3 1 1 12 6513 1 1 12 GLU N N 2.824 13.214 4.012 1.00 . A A . 12 GLU N 1 1 12 6514 1 1 12 GLU O O 5.248 12.422 2.413 1.00 . A A . 12 GLU O 1 1 12 6515 1 1 12 GLU OE1 O 0.313 11.267 -0.720 1.00 . A A . 12 GLU OE1 1 1 12 6516 1 1 12 GLU OE2 O -0.043 13.335 0.074 1.00 . A A . 12 GLU OE2 1 1 12 6517 1 1 13 TYR C C 6.194 9.023 2.173 1.00 . A A . 13 TYR C 1 1 12 6518 1 1 13 TYR CA C 6.057 9.950 3.373 1.00 . A A . 13 TYR CA 1 1 12 6519 1 1 13 TYR CB C 6.363 9.206 4.669 1.00 . A A . 13 TYR CB 1 1 12 6520 1 1 13 TYR CD1 C 8.851 9.579 4.823 1.00 . A A . 13 TYR CD1 1 1 12 6521 1 1 13 TYR CD2 C 8.017 7.304 4.739 1.00 . A A . 13 TYR CD2 1 1 12 6522 1 1 13 TYR CE1 C 10.163 9.095 4.893 1.00 . A A . 13 TYR CE1 1 1 12 6523 1 1 13 TYR CE2 C 9.328 6.820 4.809 1.00 . A A . 13 TYR CE2 1 1 12 6524 1 1 13 TYR CG C 7.778 8.684 4.745 1.00 . A A . 13 TYR CG 1 1 12 6525 1 1 13 TYR CZ C 10.402 7.716 4.886 1.00 . A A . 13 TYR CZ 1 1 12 6526 1 1 13 TYR H H 3.989 9.922 3.854 1.00 . A A . 13 TYR H 1 1 12 6527 1 1 13 TYR HA H 6.762 10.774 3.264 1.00 . A A . 13 TYR HA 1 1 12 6528 1 1 13 TYR HB2 H 6.196 9.882 5.507 1.00 . A A . 13 TYR HB2 1 1 12 6529 1 1 13 TYR HB3 H 5.677 8.363 4.758 1.00 . A A . 13 TYR HB3 1 1 12 6530 1 1 13 TYR HD1 H 8.667 10.643 4.829 1.00 . A A . 13 TYR HD1 1 1 12 6531 1 1 13 TYR HD2 H 7.189 6.613 4.680 1.00 . A A . 13 TYR HD2 1 1 12 6532 1 1 13 TYR HE1 H 10.991 9.787 4.952 1.00 . A A . 13 TYR HE1 1 1 12 6533 1 1 13 TYR HE2 H 9.512 5.756 4.804 1.00 . A A . 13 TYR HE2 1 1 12 6534 1 1 13 TYR HH H 12.239 7.761 5.540 1.00 . A A . 13 TYR HH 1 1 12 6535 1 1 13 TYR N N 4.712 10.485 3.429 1.00 . A A . 13 TYR N 1 1 12 6536 1 1 13 TYR O O 5.181 8.507 1.702 1.00 . A A . 13 TYR O 1 1 12 6537 1 1 13 TYR OH O 11.680 7.245 4.955 1.00 . A A . 13 TYR OH 1 1 12 6538 1 1 14 ASP C C 8.844 7.044 0.871 1.00 . A A . 14 ASP C 1 1 12 6539 1 1 14 ASP CA C 7.659 7.964 0.567 1.00 . A A . 14 ASP CA 1 1 12 6540 1 1 14 ASP CB C 8.001 8.778 -0.682 1.00 . A A . 14 ASP CB 1 1 12 6541 1 1 14 ASP CG C 7.686 8.089 -2.011 1.00 . A A . 14 ASP CG 1 1 12 6542 1 1 14 ASP H H 8.237 9.253 2.097 1.00 . A A . 14 ASP H 1 1 12 6543 1 1 14 ASP HA H 6.730 7.413 0.426 1.00 . A A . 14 ASP HA 1 1 12 6544 1 1 14 ASP HB2 H 7.458 9.723 -0.641 1.00 . A A . 14 ASP HB2 1 1 12 6545 1 1 14 ASP HB3 H 9.064 9.022 -0.659 1.00 . A A . 14 ASP HB3 1 1 12 6546 1 1 14 ASP HD2 H 9.527 7.932 -2.370 1.00 . A A . 14 ASP HD2 1 1 12 6547 1 1 14 ASP N N 7.419 8.830 1.708 1.00 . A A . 14 ASP N 1 1 12 6548 1 1 14 ASP O O 10.002 7.366 0.613 1.00 . A A . 14 ASP O 1 1 12 6549 1 1 14 ASP OD1 O 6.565 7.607 -2.230 1.00 . A A . 14 ASP OD1 1 1 12 6550 1 1 14 ASP OD2 O 8.662 8.059 -2.854 1.00 . A A . 14 ASP OD2 1 1 12 6551 1 1 15 PRO C C 10.628 4.849 0.798 1.00 . A A . 15 PRO C 1 1 12 6552 1 1 15 PRO CA C 9.482 4.857 1.800 1.00 . A A . 15 PRO CA 1 1 12 6553 1 1 15 PRO CB C 8.700 3.546 1.749 1.00 . A A . 15 PRO CB 1 1 12 6554 1 1 15 PRO CD C 7.173 5.466 1.748 1.00 . A A . 15 PRO CD 1 1 12 6555 1 1 15 PRO CG C 7.310 4.050 2.302 1.00 . A A . 15 PRO CG 1 1 12 6556 1 1 15 PRO HA H 9.870 5.029 2.804 1.00 . A A . 15 PRO HA 1 1 12 6557 1 1 15 PRO HB2 H 8.655 3.130 0.743 1.00 . A A . 15 PRO HB2 1 1 12 6558 1 1 15 PRO HB3 H 9.150 2.835 2.441 1.00 . A A . 15 PRO HB3 1 1 12 6559 1 1 15 PRO HD2 H 6.533 5.478 0.865 1.00 . A A . 15 PRO HD2 1 1 12 6560 1 1 15 PRO HD3 H 6.770 6.126 2.516 1.00 . A A . 15 PRO HD3 1 1 12 6561 1 1 15 PRO HG2 H 6.604 3.394 1.791 1.00 . A A . 15 PRO HG2 1 1 12 6562 1 1 15 PRO HG3 H 7.161 4.012 3.381 1.00 . A A . 15 PRO HG3 1 1 12 6563 1 1 15 PRO N N 8.523 5.876 1.432 1.00 . A A . 15 PRO N 1 1 12 6564 1 1 15 PRO O O 10.512 4.185 -0.231 1.00 . A A . 15 PRO O 1 1 12 6565 1 1 16 ALA C C 13.833 6.672 0.744 1.00 . A A . 16 ALA C 1 1 12 6566 1 1 16 ALA CA C 12.841 5.633 0.220 1.00 . A A . 16 ALA CA 1 1 12 6567 1 1 16 ALA CB C 12.371 5.942 -1.203 1.00 . A A . 16 ALA CB 1 1 12 6568 1 1 16 ALA H H 11.780 6.109 1.948 1.00 . A A . 16 ALA H 1 1 12 6569 1 1 16 ALA HA H 13.319 4.652 0.226 1.00 . A A . 16 ALA HA 1 1 12 6570 1 1 16 ALA HB1 H 11.282 6.000 -1.220 1.00 . A A . 16 ALA HB1 1 1 12 6571 1 1 16 ALA HB2 H 12.790 6.894 -1.525 1.00 . A A . 16 ALA HB2 1 1 12 6572 1 1 16 ALA HB3 H 12.702 5.151 -1.876 1.00 . A A . 16 ALA HB3 1 1 12 6573 1 1 16 ALA N N 11.694 5.572 1.109 1.00 . A A . 16 ALA N 1 1 12 6574 1 1 16 ALA O O 14.020 7.723 0.131 1.00 . A A . 16 ALA O 1 1 12 6575 1 1 17 PHE C C 16.637 6.464 2.980 1.00 . A A . 17 PHE C 1 1 12 6576 1 1 17 PHE CA C 15.412 7.237 2.489 1.00 . A A . 17 PHE CA 1 1 12 6577 1 1 17 PHE CB C 14.720 7.890 3.688 1.00 . A A . 17 PHE CB 1 1 12 6578 1 1 17 PHE CD1 C 12.725 8.951 2.610 1.00 . A A . 17 PHE CD1 1 1 12 6579 1 1 17 PHE CD2 C 14.256 10.350 3.727 1.00 . A A . 17 PHE CD2 1 1 12 6580 1 1 17 PHE CE1 C 11.935 10.083 2.276 1.00 . A A . 17 PHE CE1 1 1 12 6581 1 1 17 PHE CE2 C 13.466 11.481 3.394 1.00 . A A . 17 PHE CE2 1 1 12 6582 1 1 17 PHE CG C 13.869 9.109 3.329 1.00 . A A . 17 PHE CG 1 1 12 6583 1 1 17 PHE CZ C 12.322 11.325 2.675 1.00 . A A . 17 PHE CZ 1 1 12 6584 1 1 17 PHE H H 14.287 5.489 2.366 1.00 . A A . 17 PHE H 1 1 12 6585 1 1 17 PHE HA H 15.718 7.955 1.728 1.00 . A A . 17 PHE HA 1 1 12 6586 1 1 17 PHE HB2 H 14.088 7.148 4.176 1.00 . A A . 17 PHE HB2 1 1 12 6587 1 1 17 PHE HB3 H 15.478 8.189 4.412 1.00 . A A . 17 PHE HB3 1 1 12 6588 1 1 17 PHE HD1 H 12.414 7.957 2.290 1.00 . A A . 17 PHE HD1 1 1 12 6589 1 1 17 PHE HD2 H 15.173 10.476 4.302 1.00 . A A . 17 PHE HD2 1 1 12 6590 1 1 17 PHE HE1 H 11.018 9.957 1.700 1.00 . A A . 17 PHE HE1 1 1 12 6591 1 1 17 PHE HE2 H 13.776 12.477 3.713 1.00 . A A . 17 PHE HE2 1 1 12 6592 1 1 17 PHE HZ H 11.716 12.193 2.419 1.00 . A A . 17 PHE HZ 1 1 12 6593 1 1 17 PHE N N 14.443 6.345 1.874 1.00 . A A . 17 PHE N 1 1 12 6594 1 1 17 PHE O O 16.770 5.271 2.712 1.00 . A A . 17 PHE O 1 1 12 6595 1 1 18 GLU C C 18.839 6.863 5.715 1.00 . A A . 18 GLU C 1 1 12 6596 1 1 18 GLU CA C 18.711 6.570 4.219 1.00 . A A . 18 GLU CA 1 1 12 6597 1 1 18 GLU CB C 19.946 7.056 3.457 1.00 . A A . 18 GLU CB 1 1 12 6598 1 1 18 GLU CD C 22.424 7.199 3.904 1.00 . A A . 18 GLU CD 1 1 12 6599 1 1 18 GLU CG C 21.195 6.287 3.892 1.00 . A A . 18 GLU CG 1 1 12 6600 1 1 18 GLU H H 17.385 8.145 3.901 1.00 . A A . 18 GLU H 1 1 12 6601 1 1 18 GLU HA H 18.592 5.498 4.061 1.00 . A A . 18 GLU HA 1 1 12 6602 1 1 18 GLU HB2 H 19.791 6.928 2.386 1.00 . A A . 18 GLU HB2 1 1 12 6603 1 1 18 GLU HB3 H 20.091 8.121 3.634 1.00 . A A . 18 GLU HB3 1 1 12 6604 1 1 18 GLU HE2 H 22.586 6.967 2.042 1.00 . A A . 18 GLU HE2 1 1 12 6605 1 1 18 GLU HG2 H 21.040 5.867 4.886 1.00 . A A . 18 GLU HG2 1 1 12 6606 1 1 18 GLU HG3 H 21.365 5.450 3.215 1.00 . A A . 18 GLU HG3 1 1 12 6607 1 1 18 GLU N N 17.501 7.175 3.689 1.00 . A A . 18 GLU N 1 1 12 6608 1 1 18 GLU O O 18.839 8.023 6.126 1.00 . A A . 18 GLU O 1 1 12 6609 1 1 18 GLU OE1 O 22.997 7.454 4.974 1.00 . A A . 18 GLU OE1 1 1 12 6610 1 1 18 GLU OE2 O 22.780 7.648 2.749 1.00 . A A . 18 GLU OE2 1 1 12 6611 1 1 19 ASP C C 17.714 6.294 8.527 1.00 . A A . 19 ASP C 1 1 12 6612 1 1 19 ASP CA C 19.071 5.921 7.930 1.00 . A A . 19 ASP CA 1 1 12 6613 1 1 19 ASP CB C 20.069 7.021 8.299 1.00 . A A . 19 ASP CB 1 1 12 6614 1 1 19 ASP CG C 21.165 6.598 9.280 1.00 . A A . 19 ASP CG 1 1 12 6615 1 1 19 ASP H H 18.943 4.854 6.146 1.00 . A A . 19 ASP H 1 1 12 6616 1 1 19 ASP HA H 19.426 4.948 8.274 1.00 . A A . 19 ASP HA 1 1 12 6617 1 1 19 ASP HB2 H 20.540 7.385 7.386 1.00 . A A . 19 ASP HB2 1 1 12 6618 1 1 19 ASP HB3 H 19.521 7.859 8.729 1.00 . A A . 19 ASP HB3 1 1 12 6619 1 1 19 ASP HD2 H 22.808 7.467 9.580 1.00 . A A . 19 ASP HD2 1 1 12 6620 1 1 19 ASP N N 18.944 5.793 6.489 1.00 . A A . 19 ASP N 1 1 12 6621 1 1 19 ASP O O 17.330 7.462 8.522 1.00 . A A . 19 ASP O 1 1 12 6622 1 1 19 ASP OD1 O 20.883 6.034 10.347 1.00 . A A . 19 ASP OD1 1 1 12 6623 1 1 19 ASP OD2 O 22.368 6.875 8.905 1.00 . A A . 19 ASP OD2 1 1 12 6624 1 1 20 LEU C C 15.739 4.989 11.074 1.00 . A A . 20 LEU C 1 1 12 6625 1 1 20 LEU CA C 15.717 5.486 9.627 1.00 . A A . 20 LEU CA 1 1 12 6626 1 1 20 LEU CB C 14.626 4.839 8.771 1.00 . A A . 20 LEU CB 1 1 12 6627 1 1 20 LEU CD1 C 12.416 5.300 7.647 1.00 . A A . 20 LEU CD1 1 1 12 6628 1 1 20 LEU CD2 C 12.495 4.715 10.114 1.00 . A A . 20 LEU CD2 1 1 12 6629 1 1 20 LEU CG C 13.214 5.399 8.950 1.00 . A A . 20 LEU CG 1 1 12 6630 1 1 20 LEU H H 17.343 4.332 9.028 1.00 . A A . 20 LEU H 1 1 12 6631 1 1 20 LEU HA H 15.527 6.559 9.634 1.00 . A A . 20 LEU HA 1 1 12 6632 1 1 20 LEU HB2 H 14.906 4.941 7.723 1.00 . A A . 20 LEU HB2 1 1 12 6633 1 1 20 LEU HB3 H 14.603 3.773 8.993 1.00 . A A . 20 LEU HB3 1 1 12 6634 1 1 20 LEU HD11 H 11.463 4.808 7.841 1.00 . A A . 20 LEU HD11 1 1 12 6635 1 1 20 LEU HD12 H 12.236 6.302 7.255 1.00 . A A . 20 LEU HD12 1 1 12 6636 1 1 20 LEU HD13 H 12.983 4.722 6.918 1.00 . A A . 20 LEU HD13 1 1 12 6637 1 1 20 LEU HD21 H 11.826 3.947 9.727 1.00 . A A . 20 LEU HD21 1 1 12 6638 1 1 20 LEU HD22 H 13.231 4.256 10.776 1.00 . A A . 20 LEU HD22 1 1 12 6639 1 1 20 LEU HD23 H 11.917 5.454 10.670 1.00 . A A . 20 LEU HD23 1 1 12 6640 1 1 20 LEU HG H 13.293 6.457 9.198 1.00 . A A . 20 LEU HG 1 1 12 6641 1 1 20 LEU N N 17.024 5.279 9.028 1.00 . A A . 20 LEU N 1 1 12 6642 1 1 20 LEU O O 15.345 3.866 11.384 1.00 . A A . 20 LEU O 1 1 12 6643 1 1 21 PRO C C 14.985 5.127 13.921 1.00 . A A . 21 PRO C 1 1 12 6644 1 1 21 PRO CA C 16.327 5.602 13.383 1.00 . A A . 21 PRO CA 1 1 12 6645 1 1 21 PRO CB C 16.718 6.946 13.997 1.00 . A A . 21 PRO CB 1 1 12 6646 1 1 21 PRO CD C 16.689 7.190 11.633 1.00 . A A . 21 PRO CD 1 1 12 6647 1 1 21 PRO CG C 17.506 7.631 12.846 1.00 . A A . 21 PRO CG 1 1 12 6648 1 1 21 PRO HA H 17.094 4.855 13.586 1.00 . A A . 21 PRO HA 1 1 12 6649 1 1 21 PRO HB2 H 15.849 7.535 14.291 1.00 . A A . 21 PRO HB2 1 1 12 6650 1 1 21 PRO HB3 H 17.373 6.772 14.851 1.00 . A A . 21 PRO HB3 1 1 12 6651 1 1 21 PRO HD2 H 15.861 7.875 11.452 1.00 . A A . 21 PRO HD2 1 1 12 6652 1 1 21 PRO HD3 H 17.332 7.131 10.755 1.00 . A A . 21 PRO HD3 1 1 12 6653 1 1 21 PRO HG2 H 17.498 8.719 12.907 1.00 . A A . 21 PRO HG2 1 1 12 6654 1 1 21 PRO HG3 H 18.527 7.253 12.816 1.00 . A A . 21 PRO HG3 1 1 12 6655 1 1 21 PRO N N 16.217 5.862 11.963 1.00 . A A . 21 PRO N 1 1 12 6656 1 1 21 PRO O O 14.002 5.166 13.183 1.00 . A A . 21 PRO O 1 1 12 6657 1 1 22 ASP C C 13.136 5.324 16.644 1.00 . A A . 22 ASP C 1 1 12 6658 1 1 22 ASP CA C 13.738 4.213 15.781 1.00 . A A . 22 ASP CA 1 1 12 6659 1 1 22 ASP CB C 14.004 3.006 16.682 1.00 . A A . 22 ASP CB 1 1 12 6660 1 1 22 ASP CG C 15.274 3.097 17.529 1.00 . A A . 22 ASP CG 1 1 12 6661 1 1 22 ASP H H 15.772 4.662 15.766 1.00 . A A . 22 ASP H 1 1 12 6662 1 1 22 ASP HA H 13.094 3.938 14.946 1.00 . A A . 22 ASP HA 1 1 12 6663 1 1 22 ASP HB2 H 13.149 2.874 17.347 1.00 . A A . 22 ASP HB2 1 1 12 6664 1 1 22 ASP HB3 H 14.063 2.113 16.059 1.00 . A A . 22 ASP HB3 1 1 12 6665 1 1 22 ASP HD2 H 15.382 4.030 19.161 1.00 . A A . 22 ASP HD2 1 1 12 6666 1 1 22 ASP N N 14.968 4.691 15.172 1.00 . A A . 22 ASP N 1 1 12 6667 1 1 22 ASP O O 12.664 5.069 17.751 1.00 . A A . 22 ASP O 1 1 12 6668 1 1 22 ASP OD1 O 16.395 3.118 16.998 1.00 . A A . 22 ASP OD1 1 1 12 6669 1 1 22 ASP OD2 O 15.078 3.147 18.803 1.00 . A A . 22 ASP OD2 1 1 12 6670 1 1 23 ASP C C 12.403 8.825 15.819 1.00 . A A . 23 ASP C 1 1 12 6671 1 1 23 ASP CA C 12.637 7.684 16.812 1.00 . A A . 23 ASP CA 1 1 12 6672 1 1 23 ASP CB C 13.616 8.181 17.879 1.00 . A A . 23 ASP CB 1 1 12 6673 1 1 23 ASP CG C 15.095 8.016 17.525 1.00 . A A . 23 ASP CG 1 1 12 6674 1 1 23 ASP H H 13.560 6.734 15.204 1.00 . A A . 23 ASP H 1 1 12 6675 1 1 23 ASP HA H 11.713 7.334 17.271 1.00 . A A . 23 ASP HA 1 1 12 6676 1 1 23 ASP HB2 H 13.418 9.236 18.069 1.00 . A A . 23 ASP HB2 1 1 12 6677 1 1 23 ASP HB3 H 13.418 7.647 18.809 1.00 . A A . 23 ASP HB3 1 1 12 6678 1 1 23 ASP HD2 H 15.628 6.749 18.814 1.00 . A A . 23 ASP HD2 1 1 12 6679 1 1 23 ASP N N 13.173 6.534 16.105 1.00 . A A . 23 ASP N 1 1 12 6680 1 1 23 ASP O O 12.816 9.958 16.060 1.00 . A A . 23 ASP O 1 1 12 6681 1 1 23 ASP OD1 O 15.500 8.205 16.369 1.00 . A A . 23 ASP OD1 1 1 12 6682 1 1 23 ASP OD2 O 15.856 7.674 18.510 1.00 . A A . 23 ASP OD2 1 1 12 6683 1 1 24 TRP C C 10.154 10.189 14.083 1.00 . A A . 24 TRP C 1 1 12 6684 1 1 24 TRP CA C 11.446 9.465 13.693 1.00 . A A . 24 TRP CA 1 1 12 6685 1 1 24 TRP CB C 11.368 8.806 12.315 1.00 . A A . 24 TRP CB 1 1 12 6686 1 1 24 TRP CD1 C 12.413 10.717 10.930 1.00 . A A . 24 TRP CD1 1 1 12 6687 1 1 24 TRP CD2 C 10.553 9.908 10.039 1.00 . A A . 24 TRP CD2 1 1 12 6688 1 1 24 TRP CE2 C 11.005 10.912 9.208 1.00 . A A . 24 TRP CE2 1 1 12 6689 1 1 24 TRP CE3 C 9.381 9.188 9.748 1.00 . A A . 24 TRP CE3 1 1 12 6690 1 1 24 TRP CG C 11.470 9.790 11.147 1.00 . A A . 24 TRP CG 1 1 12 6691 1 1 24 TRP CH2 C 9.176 10.587 7.722 1.00 . A A . 24 TRP CH2 1 1 12 6692 1 1 24 TRP CZ2 C 10.346 11.290 8.032 1.00 . A A . 24 TRP CZ2 1 1 12 6693 1 1 24 TRP CZ3 C 8.734 9.577 8.569 1.00 . A A . 24 TRP CZ3 1 1 12 6694 1 1 24 TRP H H 11.407 7.561 14.535 1.00 . A A . 24 TRP H 1 1 12 6695 1 1 24 TRP HA H 12.273 10.173 13.660 1.00 . A A . 24 TRP HA 1 1 12 6696 1 1 24 TRP HB2 H 12.170 8.071 12.229 1.00 . A A . 24 TRP HB2 1 1 12 6697 1 1 24 TRP HB3 H 10.427 8.261 12.236 1.00 . A A . 24 TRP HB3 1 1 12 6698 1 1 24 TRP HD1 H 13.264 10.893 11.589 1.00 . A A . 24 TRP HD1 1 1 12 6699 1 1 24 TRP HE1 H 12.784 12.226 9.362 1.00 . A A . 24 TRP HE1 1 1 12 6700 1 1 24 TRP HE3 H 9.003 8.390 10.387 1.00 . A A . 24 TRP HE3 1 1 12 6701 1 1 24 TRP HH2 H 8.613 10.831 6.820 1.00 . A A . 24 TRP HH2 1 1 12 6702 1 1 24 TRP HZ2 H 10.724 12.087 7.392 1.00 . A A . 24 TRP HZ2 1 1 12 6703 1 1 24 TRP HZ3 H 7.819 9.051 8.296 1.00 . A A . 24 TRP HZ3 1 1 12 6704 1 1 24 TRP N N 11.740 8.485 14.723 1.00 . A A . 24 TRP N 1 1 12 6705 1 1 24 TRP NE1 N 12.172 11.420 9.768 1.00 . A A . 24 TRP NE1 1 1 12 6706 1 1 24 TRP O O 9.228 9.572 14.608 1.00 . A A . 24 TRP O 1 1 12 6707 1 1 25 ALA C C 8.595 13.137 12.906 1.00 . A A . 25 ALA C 1 1 12 6708 1 1 25 ALA CA C 8.973 12.298 14.127 1.00 . A A . 25 ALA CA 1 1 12 6709 1 1 25 ALA CB C 9.271 13.160 15.356 1.00 . A A . 25 ALA CB 1 1 12 6710 1 1 25 ALA H H 10.893 11.979 13.384 1.00 . A A . 25 ALA H 1 1 12 6711 1 1 25 ALA HA H 8.150 11.623 14.363 1.00 . A A . 25 ALA HA 1 1 12 6712 1 1 25 ALA HB1 H 10.322 13.055 15.627 1.00 . A A . 25 ALA HB1 1 1 12 6713 1 1 25 ALA HB2 H 9.058 14.204 15.128 1.00 . A A . 25 ALA HB2 1 1 12 6714 1 1 25 ALA HB3 H 8.647 12.834 16.188 1.00 . A A . 25 ALA HB3 1 1 12 6715 1 1 25 ALA N N 10.135 11.485 13.811 1.00 . A A . 25 ALA N 1 1 12 6716 1 1 25 ALA O O 9.461 13.728 12.262 1.00 . A A . 25 ALA O 1 1 12 6717 1 1 26 CYS C C 7.438 15.309 11.515 1.00 . A A . 26 CYS C 1 1 12 6718 1 1 26 CYS CA C 6.798 13.918 11.488 1.00 . A A . 26 CYS CA 1 1 12 6719 1 1 26 CYS CB C 5.271 13.994 11.490 1.00 . A A . 26 CYS CB 1 1 12 6720 1 1 26 CYS H H 6.603 12.678 13.149 1.00 . A A . 26 CYS H 1 1 12 6721 1 1 26 CYS HA H 7.095 13.374 10.591 1.00 . A A . 26 CYS HA 1 1 12 6722 1 1 26 CYS HB2 H 4.875 13.042 11.845 1.00 . A A . 26 CYS HB2 1 1 12 6723 1 1 26 CYS HB3 H 4.959 14.755 12.207 1.00 . A A . 26 CYS HB3 1 1 12 6724 1 1 26 CYS N N 7.302 13.161 12.621 1.00 . A A . 26 CYS N 1 1 12 6725 1 1 26 CYS O O 7.103 16.164 12.330 1.00 . A A . 26 CYS O 1 1 12 6726 1 1 26 CYS SG S 4.517 14.374 9.867 1.00 . A A . 26 CYS SG 1 1 12 6727 1 1 27 PRO C C 8.146 17.925 10.470 1.00 . A A . 27 PRO C 1 1 12 6728 1 1 27 PRO CA C 9.113 16.752 10.436 1.00 . A A . 27 PRO CA 1 1 12 6729 1 1 27 PRO CB C 9.789 16.638 9.071 1.00 . A A . 27 PRO CB 1 1 12 6730 1 1 27 PRO CD C 8.799 14.529 9.619 1.00 . A A . 27 PRO CD 1 1 12 6731 1 1 27 PRO CG C 10.073 15.101 9.001 1.00 . A A . 27 PRO CG 1 1 12 6732 1 1 27 PRO HA H 9.861 16.866 11.221 1.00 . A A . 27 PRO HA 1 1 12 6733 1 1 27 PRO HB2 H 9.147 16.983 8.262 1.00 . A A . 27 PRO HB2 1 1 12 6734 1 1 27 PRO HB3 H 10.725 17.197 9.087 1.00 . A A . 27 PRO HB3 1 1 12 6735 1 1 27 PRO HD2 H 8.036 14.368 8.857 1.00 . A A . 27 PRO HD2 1 1 12 6736 1 1 27 PRO HD3 H 9.025 13.594 10.132 1.00 . A A . 27 PRO HD3 1 1 12 6737 1 1 27 PRO HG2 H 10.112 14.832 7.945 1.00 . A A . 27 PRO HG2 1 1 12 6738 1 1 27 PRO HG3 H 10.972 14.766 9.519 1.00 . A A . 27 PRO HG3 1 1 12 6739 1 1 27 PRO N N 8.381 15.513 10.592 1.00 . A A . 27 PRO N 1 1 12 6740 1 1 27 PRO O O 8.581 19.048 10.724 1.00 . A A . 27 PRO O 1 1 12 6741 1 1 28 VAL C C 5.392 18.940 11.656 1.00 . A A . 28 VAL C 1 1 12 6742 1 1 28 VAL CA C 5.868 18.703 10.222 1.00 . A A . 28 VAL CA 1 1 12 6743 1 1 28 VAL CB C 4.730 18.342 9.266 1.00 . A A . 28 VAL CB 1 1 12 6744 1 1 28 VAL CG1 C 3.613 19.385 9.325 1.00 . A A . 28 VAL CG1 1 1 12 6745 1 1 28 VAL CG2 C 5.248 18.175 7.835 1.00 . A A . 28 VAL CG2 1 1 12 6746 1 1 28 VAL H H 6.527 16.739 10.011 1.00 . A A . 28 VAL H 1 1 12 6747 1 1 28 VAL HA H 6.342 19.614 9.854 1.00 . A A . 28 VAL HA 1 1 12 6748 1 1 28 VAL HB H 4.314 17.387 9.586 1.00 . A A . 28 VAL HB 1 1 12 6749 1 1 28 VAL HG11 H 4.044 20.370 9.507 1.00 . A A . 28 VAL HG11 1 1 12 6750 1 1 28 VAL HG12 H 3.072 19.395 8.378 1.00 . A A . 28 VAL HG12 1 1 12 6751 1 1 28 VAL HG13 H 2.925 19.136 10.134 1.00 . A A . 28 VAL HG13 1 1 12 6752 1 1 28 VAL HG21 H 6.336 18.113 7.848 1.00 . A A . 28 VAL HG21 1 1 12 6753 1 1 28 VAL HG22 H 4.835 17.262 7.405 1.00 . A A . 28 VAL HG22 1 1 12 6754 1 1 28 VAL HG23 H 4.939 19.031 7.234 1.00 . A A . 28 VAL HG23 1 1 12 6755 1 1 28 VAL N N 6.874 17.654 10.217 1.00 . A A . 28 VAL N 1 1 12 6756 1 1 28 VAL O O 5.961 19.760 12.375 1.00 . A A . 28 VAL O 1 1 12 6757 1 1 29 CYS C C 4.884 17.969 14.377 1.00 . A A . 29 CYS C 1 1 12 6758 1 1 29 CYS CA C 3.794 18.327 13.365 1.00 . A A . 29 CYS CA 1 1 12 6759 1 1 29 CYS CB C 2.548 17.456 13.537 1.00 . A A . 29 CYS CB 1 1 12 6760 1 1 29 CYS H H 3.897 17.542 11.438 1.00 . A A . 29 CYS H 1 1 12 6761 1 1 29 CYS HA H 3.483 19.365 13.482 1.00 . A A . 29 CYS HA 1 1 12 6762 1 1 29 CYS HB2 H 2.209 17.532 14.569 1.00 . A A . 29 CYS HB2 1 1 12 6763 1 1 29 CYS HB3 H 1.753 17.858 12.910 1.00 . A A . 29 CYS HB3 1 1 12 6764 1 1 29 CYS N N 4.353 18.207 12.029 1.00 . A A . 29 CYS N 1 1 12 6765 1 1 29 CYS O O 5.086 18.683 15.357 1.00 . A A . 29 CYS O 1 1 12 6766 1 1 29 CYS SG S 2.784 15.688 13.125 1.00 . A A . 29 CYS SG 1 1 12 6767 1 1 30 GLY C C 6.245 15.084 15.657 1.00 . A A . 30 GLY C 1 1 12 6768 1 1 30 GLY CA C 6.625 16.401 14.976 1.00 . A A . 30 GLY CA 1 1 12 6769 1 1 30 GLY H H 5.391 16.287 13.303 1.00 . A A . 30 GLY H 1 1 12 6770 1 1 30 GLY HA2 H 7.540 16.265 14.401 1.00 . A A . 30 GLY HA2 1 1 12 6771 1 1 30 GLY HA3 H 6.835 17.158 15.733 1.00 . A A . 30 GLY HA3 1 1 12 6772 1 1 30 GLY N N 5.560 16.862 14.103 1.00 . A A . 30 GLY N 1 1 12 6773 1 1 30 GLY O O 7.102 14.394 16.205 1.00 . A A . 30 GLY O 1 1 12 6774 1 1 31 ALA C C 5.406 12.402 15.885 1.00 . A A . 31 ALA C 1 1 12 6775 1 1 31 ALA CA C 4.452 13.555 16.204 1.00 . A A . 31 ALA CA 1 1 12 6776 1 1 31 ALA CB C 3.030 13.289 15.706 1.00 . A A . 31 ALA CB 1 1 12 6777 1 1 31 ALA H H 4.265 15.344 15.152 1.00 . A A . 31 ALA H 1 1 12 6778 1 1 31 ALA HA H 4.424 13.706 17.283 1.00 . A A . 31 ALA HA 1 1 12 6779 1 1 31 ALA HB1 H 3.071 12.825 14.721 1.00 . A A . 31 ALA HB1 1 1 12 6780 1 1 31 ALA HB2 H 2.520 12.622 16.401 1.00 . A A . 31 ALA HB2 1 1 12 6781 1 1 31 ALA HB3 H 2.486 14.231 15.641 1.00 . A A . 31 ALA HB3 1 1 12 6782 1 1 31 ALA N N 4.957 14.776 15.600 1.00 . A A . 31 ALA N 1 1 12 6783 1 1 31 ALA O O 6.209 12.494 14.959 1.00 . A A . 31 ALA O 1 1 12 6784 1 1 32 SER C C 5.641 9.365 15.282 1.00 . A A . 32 SER C 1 1 12 6785 1 1 32 SER CA C 6.128 10.173 16.487 1.00 . A A . 32 SER CA 1 1 12 6786 1 1 32 SER CB C 6.141 9.299 17.743 1.00 . A A . 32 SER CB 1 1 12 6787 1 1 32 SER H H 4.631 11.276 17.425 1.00 . A A . 32 SER H 1 1 12 6788 1 1 32 SER HA H 7.129 10.564 16.307 1.00 . A A . 32 SER HA 1 1 12 6789 1 1 32 SER HB2 H 6.599 8.338 17.510 1.00 . A A . 32 SER HB2 1 1 12 6790 1 1 32 SER HB3 H 6.760 9.770 18.507 1.00 . A A . 32 SER HB3 1 1 12 6791 1 1 32 SER HG H 4.708 8.123 18.498 1.00 . A A . 32 SER HG 1 1 12 6792 1 1 32 SER N N 5.286 11.343 16.673 1.00 . A A . 32 SER N 1 1 12 6793 1 1 32 SER O O 4.570 9.634 14.741 1.00 . A A . 32 SER O 1 1 12 6794 1 1 32 SER OG O 4.830 9.087 18.259 1.00 . A A . 32 SER OG 1 1 12 6795 1 1 33 LYS C C 5.230 6.391 14.244 1.00 . A A . 33 LYS C 1 1 12 6796 1 1 33 LYS CA C 6.119 7.541 13.767 1.00 . A A . 33 LYS CA 1 1 12 6797 1 1 33 LYS CB C 7.389 7.080 13.050 1.00 . A A . 33 LYS CB 1 1 12 6798 1 1 33 LYS CD C 8.478 4.857 13.529 1.00 . A A . 33 LYS CD 1 1 12 6799 1 1 33 LYS CE C 8.413 3.884 14.709 1.00 . A A . 33 LYS CE 1 1 12 6800 1 1 33 LYS CG C 8.303 6.301 13.999 1.00 . A A . 33 LYS CG 1 1 12 6801 1 1 33 LYS H H 7.322 8.178 15.345 1.00 . A A . 33 LYS H 1 1 12 6802 1 1 33 LYS HA H 5.551 8.146 13.060 1.00 . A A . 33 LYS HA 1 1 12 6803 1 1 33 LYS HB2 H 7.124 6.453 12.199 1.00 . A A . 33 LYS HB2 1 1 12 6804 1 1 33 LYS HB3 H 7.921 7.945 12.654 1.00 . A A . 33 LYS HB3 1 1 12 6805 1 1 33 LYS HD2 H 7.700 4.609 12.805 1.00 . A A . 33 LYS HD2 1 1 12 6806 1 1 33 LYS HD3 H 9.435 4.749 13.017 1.00 . A A . 33 LYS HD3 1 1 12 6807 1 1 33 LYS HE2 H 9.195 3.132 14.613 1.00 . A A . 33 LYS HE2 1 1 12 6808 1 1 33 LYS HE3 H 8.597 4.421 15.640 1.00 . A A . 33 LYS HE3 1 1 12 6809 1 1 33 LYS HG2 H 9.276 6.790 14.054 1.00 . A A . 33 LYS HG2 1 1 12 6810 1 1 33 LYS HG3 H 7.883 6.313 15.004 1.00 . A A . 33 LYS HG3 1 1 12 6811 1 1 33 LYS HZ1 H 7.167 2.228 14.927 1.00 . A A . 33 LYS HZ1 1 1 12 6812 1 1 33 LYS HZ2 H 6.509 3.599 15.508 1.00 . A A . 33 LYS HZ2 1 1 12 6813 1 1 33 LYS N N 6.453 8.390 14.898 1.00 . A A . 33 LYS N 1 1 12 6814 1 1 33 LYS NZ N 7.088 3.225 14.764 1.00 . A A . 33 LYS NZ 1 1 12 6815 1 1 33 LYS O O 5.477 5.233 13.912 1.00 . A A . 33 LYS O 1 1 12 6816 1 1 34 ASP C C 1.892 6.025 14.971 1.00 . A A . 34 ASP C 1 1 12 6817 1 1 34 ASP CA C 3.287 5.762 15.541 1.00 . A A . 34 ASP CA 1 1 12 6818 1 1 34 ASP CB C 3.198 5.848 17.066 1.00 . A A . 34 ASP CB 1 1 12 6819 1 1 34 ASP CG C 2.317 4.783 17.723 1.00 . A A . 34 ASP CG 1 1 12 6820 1 1 34 ASP H H 4.021 7.695 15.281 1.00 . A A . 34 ASP H 1 1 12 6821 1 1 34 ASP HA H 3.691 4.798 15.232 1.00 . A A . 34 ASP HA 1 1 12 6822 1 1 34 ASP HB2 H 4.204 5.770 17.479 1.00 . A A . 34 ASP HB2 1 1 12 6823 1 1 34 ASP HB3 H 2.818 6.832 17.338 1.00 . A A . 34 ASP HB3 1 1 12 6824 1 1 34 ASP HD2 H 0.900 5.912 18.236 1.00 . A A . 34 ASP HD2 1 1 12 6825 1 1 34 ASP N N 4.214 6.750 15.016 1.00 . A A . 34 ASP N 1 1 12 6826 1 1 34 ASP O O 1.184 5.089 14.600 1.00 . A A . 34 ASP O 1 1 12 6827 1 1 34 ASP OD1 O 2.395 3.592 17.385 1.00 . A A . 34 ASP OD1 1 1 12 6828 1 1 34 ASP OD2 O 1.512 5.225 18.629 1.00 . A A . 34 ASP OD2 1 1 12 6829 1 1 35 ALA C C 0.173 7.370 12.906 1.00 . A A . 35 ALA C 1 1 12 6830 1 1 35 ALA CA C 0.241 7.696 14.399 1.00 . A A . 35 ALA CA 1 1 12 6831 1 1 35 ALA CB C 0.010 9.183 14.682 1.00 . A A . 35 ALA CB 1 1 12 6832 1 1 35 ALA H H 2.121 8.054 15.221 1.00 . A A . 35 ALA H 1 1 12 6833 1 1 35 ALA HA H -0.517 7.117 14.925 1.00 . A A . 35 ALA HA 1 1 12 6834 1 1 35 ALA HB1 H -0.204 9.702 13.748 1.00 . A A . 35 ALA HB1 1 1 12 6835 1 1 35 ALA HB2 H -0.834 9.296 15.362 1.00 . A A . 35 ALA HB2 1 1 12 6836 1 1 35 ALA HB3 H 0.904 9.608 15.138 1.00 . A A . 35 ALA HB3 1 1 12 6837 1 1 35 ALA N N 1.539 7.300 14.918 1.00 . A A . 35 ALA N 1 1 12 6838 1 1 35 ALA O O -0.914 7.235 12.345 1.00 . A A . 35 ALA O 1 1 12 6839 1 1 36 PHE C C 0.839 5.567 10.587 1.00 . A A . 36 PHE C 1 1 12 6840 1 1 36 PHE CA C 1.434 6.944 10.886 1.00 . A A . 36 PHE CA 1 1 12 6841 1 1 36 PHE CB C 2.919 6.934 10.521 1.00 . A A . 36 PHE CB 1 1 12 6842 1 1 36 PHE CD1 C 3.886 9.082 11.372 1.00 . A A . 36 PHE CD1 1 1 12 6843 1 1 36 PHE CD2 C 3.677 8.809 9.041 1.00 . A A . 36 PHE CD2 1 1 12 6844 1 1 36 PHE CE1 C 4.438 10.374 11.170 1.00 . A A . 36 PHE CE1 1 1 12 6845 1 1 36 PHE CE2 C 4.230 10.101 8.840 1.00 . A A . 36 PHE CE2 1 1 12 6846 1 1 36 PHE CG C 3.516 8.327 10.303 1.00 . A A . 36 PHE CG 1 1 12 6847 1 1 36 PHE CZ C 4.599 10.856 9.908 1.00 . A A . 36 PHE CZ 1 1 12 6848 1 1 36 PHE H H 2.226 7.364 12.766 1.00 . A A . 36 PHE H 1 1 12 6849 1 1 36 PHE HA H 0.866 7.708 10.353 1.00 . A A . 36 PHE HA 1 1 12 6850 1 1 36 PHE HB2 H 3.475 6.432 11.313 1.00 . A A . 36 PHE HB2 1 1 12 6851 1 1 36 PHE HB3 H 3.056 6.346 9.613 1.00 . A A . 36 PHE HB3 1 1 12 6852 1 1 36 PHE HD1 H 3.757 8.697 12.383 1.00 . A A . 36 PHE HD1 1 1 12 6853 1 1 36 PHE HD2 H 3.381 8.202 8.185 1.00 . A A . 36 PHE HD2 1 1 12 6854 1 1 36 PHE HE1 H 4.736 10.981 12.026 1.00 . A A . 36 PHE HE1 1 1 12 6855 1 1 36 PHE HE2 H 4.359 10.486 7.829 1.00 . A A . 36 PHE HE2 1 1 12 6856 1 1 36 PHE HZ H 5.025 11.848 9.753 1.00 . A A . 36 PHE HZ 1 1 12 6857 1 1 36 PHE N N 1.347 7.253 12.303 1.00 . A A . 36 PHE N 1 1 12 6858 1 1 36 PHE O O 1.091 4.607 11.313 1.00 . A A . 36 PHE O 1 1 12 6859 1 1 37 GLU C C -0.675 4.198 7.587 1.00 . A A . 37 GLU C 1 1 12 6860 1 1 37 GLU CA C -0.575 4.272 9.113 1.00 . A A . 37 GLU CA 1 1 12 6861 1 1 37 GLU CB C -1.953 4.123 9.760 1.00 . A A . 37 GLU CB 1 1 12 6862 1 1 37 GLU CD C -3.116 1.954 9.207 1.00 . A A . 37 GLU CD 1 1 12 6863 1 1 37 GLU CG C -2.200 2.677 10.197 1.00 . A A . 37 GLU CG 1 1 12 6864 1 1 37 GLU H H -0.141 6.301 8.931 1.00 . A A . 37 GLU H 1 1 12 6865 1 1 37 GLU HA H 0.080 3.481 9.479 1.00 . A A . 37 GLU HA 1 1 12 6866 1 1 37 GLU HB2 H -2.027 4.785 10.622 1.00 . A A . 37 GLU HB2 1 1 12 6867 1 1 37 GLU HB3 H -2.725 4.430 9.055 1.00 . A A . 37 GLU HB3 1 1 12 6868 1 1 37 GLU HE2 H -3.254 0.276 10.049 1.00 . A A . 37 GLU HE2 1 1 12 6869 1 1 37 GLU HG2 H -1.250 2.148 10.271 1.00 . A A . 37 GLU HG2 1 1 12 6870 1 1 37 GLU HG3 H -2.651 2.665 11.190 1.00 . A A . 37 GLU HG3 1 1 12 6871 1 1 37 GLU N N 0.059 5.515 9.517 1.00 . A A . 37 GLU N 1 1 12 6872 1 1 37 GLU O O -0.742 5.226 6.916 1.00 . A A . 37 GLU O 1 1 12 6873 1 1 37 GLU OE1 O -3.122 2.285 8.012 1.00 . A A . 37 GLU OE1 1 1 12 6874 1 1 37 GLU OE2 O -3.839 1.016 9.719 1.00 . A A . 37 GLU OE2 1 1 12 6875 1 1 38 LYS C C -2.043 3.411 5.118 1.00 . A A . 38 LYS C 1 1 12 6876 1 1 38 LYS CA C -0.770 2.750 5.652 1.00 . A A . 38 LYS CA 1 1 12 6877 1 1 38 LYS CB C -0.673 1.257 5.333 1.00 . A A . 38 LYS CB 1 1 12 6878 1 1 38 LYS CD C 0.387 0.639 3.130 1.00 . A A . 38 LYS CD 1 1 12 6879 1 1 38 LYS CE C 0.116 -0.229 1.899 1.00 . A A . 38 LYS CE 1 1 12 6880 1 1 38 LYS CG C -0.917 0.997 3.845 1.00 . A A . 38 LYS CG 1 1 12 6881 1 1 38 LYS H H -0.625 2.141 7.638 1.00 . A A . 38 LYS H 1 1 12 6882 1 1 38 LYS HA H 0.091 3.235 5.191 1.00 . A A . 38 LYS HA 1 1 12 6883 1 1 38 LYS HB2 H 0.313 0.884 5.614 1.00 . A A . 38 LYS HB2 1 1 12 6884 1 1 38 LYS HB3 H -1.402 0.706 5.927 1.00 . A A . 38 LYS HB3 1 1 12 6885 1 1 38 LYS HD2 H 0.903 1.551 2.829 1.00 . A A . 38 LYS HD2 1 1 12 6886 1 1 38 LYS HD3 H 1.048 0.108 3.815 1.00 . A A . 38 LYS HD3 1 1 12 6887 1 1 38 LYS HE2 H 0.242 -1.281 2.154 1.00 . A A . 38 LYS HE2 1 1 12 6888 1 1 38 LYS HE3 H -0.917 -0.101 1.576 1.00 . A A . 38 LYS HE3 1 1 12 6889 1 1 38 LYS HG2 H -1.635 0.185 3.728 1.00 . A A . 38 LYS HG2 1 1 12 6890 1 1 38 LYS HG3 H -1.358 1.881 3.385 1.00 . A A . 38 LYS HG3 1 1 12 6891 1 1 38 LYS HZ1 H 1.987 -0.164 0.982 1.00 . A A . 38 LYS HZ1 1 1 12 6892 1 1 38 LYS HZ2 H 0.761 -0.291 -0.082 1.00 . A A . 38 LYS HZ2 1 1 12 6893 1 1 38 LYS N N -0.680 2.972 7.085 1.00 . A A . 38 LYS N 1 1 12 6894 1 1 38 LYS NZ N 1.036 0.134 0.797 1.00 . A A . 38 LYS NZ 1 1 12 6895 1 1 38 LYS O O -3.135 3.165 5.627 1.00 . A A . 38 LYS O 1 1 12 6896 1 1 39 GLN C C -3.065 4.601 1.998 1.00 . A A . 39 GLN C 1 1 12 6897 1 1 39 GLN CA C -2.978 4.935 3.489 1.00 . A A . 39 GLN CA 1 1 12 6898 1 1 39 GLN CB C -2.867 6.445 3.707 1.00 . A A . 39 GLN CB 1 1 12 6899 1 1 39 GLN CD C -4.878 7.813 3.039 1.00 . A A . 39 GLN CD 1 1 12 6900 1 1 39 GLN CG C -4.203 7.032 4.169 1.00 . A A . 39 GLN CG 1 1 12 6901 1 1 39 GLN H H -0.966 4.431 3.690 1.00 . A A . 39 GLN H 1 1 12 6902 1 1 39 GLN HA H -3.865 4.564 4.003 1.00 . A A . 39 GLN HA 1 1 12 6903 1 1 39 GLN HB2 H -2.098 6.653 4.451 1.00 . A A . 39 GLN HB2 1 1 12 6904 1 1 39 GLN HB3 H -2.553 6.928 2.782 1.00 . A A . 39 GLN HB3 1 1 12 6905 1 1 39 GLN HE21 H -4.560 9.514 4.089 1.00 . A A . 39 GLN HE21 1 1 12 6906 1 1 39 GLN HE22 H -5.362 9.721 2.567 1.00 . A A . 39 GLN HE22 1 1 12 6907 1 1 39 GLN HG2 H -4.859 6.230 4.504 1.00 . A A . 39 GLN HG2 1 1 12 6908 1 1 39 GLN HG3 H -4.040 7.689 5.022 1.00 . A A . 39 GLN HG3 1 1 12 6909 1 1 39 GLN N N -1.859 4.237 4.098 1.00 . A A . 39 GLN N 1 1 12 6910 1 1 39 GLN NE2 N -4.938 9.125 3.249 1.00 . A A . 39 GLN NE2 1 1 12 6911 1 1 39 GLN O O -4.027 4.974 1.329 1.00 . A A . 39 GLN O 1 1 12 6912 1 1 39 GLN OE1 O -5.315 7.261 2.042 1.00 . A A . 39 GLN OE1 1 1 13 6913 1 1 1 MET C C 3.941 2.250 -1.962 1.00 . A A . 1 MET C 1 1 13 6914 1 1 1 MET CA C 3.055 1.852 -3.144 1.00 . A A . 1 MET CA 1 1 13 6915 1 1 1 MET CB C 3.566 2.533 -4.415 1.00 . A A . 1 MET CB 1 1 13 6916 1 1 1 MET CE C 5.866 1.517 -7.170 1.00 . A A . 1 MET CE 1 1 13 6917 1 1 1 MET CG C 3.646 1.539 -5.576 1.00 . A A . 1 MET CG 1 1 13 6918 1 1 1 MET H1 H 1.411 3.123 -3.284 1.00 . A A . 1 MET H1 1 1 13 6919 1 1 1 MET HA H 3.045 0.768 -3.251 1.00 . A A . 1 MET HA 1 1 13 6920 1 1 1 MET HB2 H 2.902 3.356 -4.682 1.00 . A A . 1 MET HB2 1 1 13 6921 1 1 1 MET HB3 H 4.550 2.963 -4.232 1.00 . A A . 1 MET HB3 1 1 13 6922 1 1 1 MET HE1 H 5.253 1.163 -7.999 1.00 . A A . 1 MET HE1 1 1 13 6923 1 1 1 MET HE2 H 5.808 2.604 -7.113 1.00 . A A . 1 MET HE2 1 1 13 6924 1 1 1 MET HE3 H 6.902 1.218 -7.331 1.00 . A A . 1 MET HE3 1 1 13 6925 1 1 1 MET HG2 H 2.893 0.760 -5.450 1.00 . A A . 1 MET HG2 1 1 13 6926 1 1 1 MET HG3 H 3.425 2.046 -6.516 1.00 . A A . 1 MET HG3 1 1 13 6927 1 1 1 MET N N 1.673 2.234 -2.910 1.00 . A A . 1 MET N 1 1 13 6928 1 1 1 MET O O 4.716 3.200 -2.054 1.00 . A A . 1 MET O 1 1 13 6929 1 1 1 MET SD S 5.273 0.809 -5.643 1.00 . A A . 1 MET SD 1 1 13 6930 1 1 2 ASP C C 4.603 3.270 0.587 1.00 . A A . 2 ASP C 1 1 13 6931 1 1 2 ASP CA C 4.575 1.764 0.321 1.00 . A A . 2 ASP CA 1 1 13 6932 1 1 2 ASP CB C 6.019 1.286 0.157 1.00 . A A . 2 ASP CB 1 1 13 6933 1 1 2 ASP CG C 6.175 -0.095 -0.482 1.00 . A A . 2 ASP CG 1 1 13 6934 1 1 2 ASP H H 3.166 0.729 -0.811 1.00 . A A . 2 ASP H 1 1 13 6935 1 1 2 ASP HA H 4.074 1.209 1.115 1.00 . A A . 2 ASP HA 1 1 13 6936 1 1 2 ASP HB2 H 6.560 2.013 -0.449 1.00 . A A . 2 ASP HB2 1 1 13 6937 1 1 2 ASP HB3 H 6.496 1.272 1.137 1.00 . A A . 2 ASP HB3 1 1 13 6938 1 1 2 ASP HD2 H 5.711 -1.910 -0.285 1.00 . A A . 2 ASP HD2 1 1 13 6939 1 1 2 ASP N N 3.798 1.501 -0.878 1.00 . A A . 2 ASP N 1 1 13 6940 1 1 2 ASP O O 5.478 3.977 0.087 1.00 . A A . 2 ASP O 1 1 13 6941 1 1 2 ASP OD1 O 7.007 -0.294 -1.380 1.00 . A A . 2 ASP OD1 1 1 13 6942 1 1 2 ASP OD2 O 5.386 -1.004 -0.016 1.00 . A A . 2 ASP OD2 1 1 13 6943 1 1 3 ILE C C 3.171 5.270 3.189 1.00 . A A . 3 ILE C 1 1 13 6944 1 1 3 ILE CA C 3.537 5.128 1.710 1.00 . A A . 3 ILE CA 1 1 13 6945 1 1 3 ILE CB C 2.565 5.839 0.766 1.00 . A A . 3 ILE CB 1 1 13 6946 1 1 3 ILE CD1 C 1.973 5.882 -1.686 1.00 . A A . 3 ILE CD1 1 1 13 6947 1 1 3 ILE CG1 C 3.112 5.869 -0.663 1.00 . A A . 3 ILE CG1 1 1 13 6948 1 1 3 ILE CG2 C 2.228 7.240 1.279 1.00 . A A . 3 ILE CG2 1 1 13 6949 1 1 3 ILE H H 2.926 3.137 1.774 1.00 . A A . 3 ILE H 1 1 13 6950 1 1 3 ILE HA H 4.520 5.570 1.553 1.00 . A A . 3 ILE HA 1 1 13 6951 1 1 3 ILE HB H 1.635 5.272 0.743 1.00 . A A . 3 ILE HB 1 1 13 6952 1 1 3 ILE HD11 H 2.371 6.138 -2.668 1.00 . A A . 3 ILE HD11 1 1 13 6953 1 1 3 ILE HD12 H 1.510 4.897 -1.726 1.00 . A A . 3 ILE HD12 1 1 13 6954 1 1 3 ILE HD13 H 1.230 6.622 -1.390 1.00 . A A . 3 ILE HD13 1 1 13 6955 1 1 3 ILE HG12 H 3.738 6.750 -0.798 1.00 . A A . 3 ILE HG12 1 1 13 6956 1 1 3 ILE HG13 H 3.746 4.999 -0.831 1.00 . A A . 3 ILE HG13 1 1 13 6957 1 1 3 ILE HG21 H 2.049 7.904 0.434 1.00 . A A . 3 ILE HG21 1 1 13 6958 1 1 3 ILE HG22 H 1.333 7.194 1.900 1.00 . A A . 3 ILE HG22 1 1 13 6959 1 1 3 ILE HG23 H 3.061 7.621 1.870 1.00 . A A . 3 ILE HG23 1 1 13 6960 1 1 3 ILE N N 3.635 3.718 1.372 1.00 . A A . 3 ILE N 1 1 13 6961 1 1 3 ILE O O 2.358 4.528 3.734 1.00 . A A . 3 ILE O 1 1 13 6962 1 1 4 TYR C C 2.942 7.896 5.409 1.00 . A A . 4 TYR C 1 1 13 6963 1 1 4 TYR CA C 3.566 6.518 5.239 1.00 . A A . 4 TYR CA 1 1 13 6964 1 1 4 TYR CB C 4.887 6.426 6.000 1.00 . A A . 4 TYR CB 1 1 13 6965 1 1 4 TYR CD1 C 4.540 4.266 7.253 1.00 . A A . 4 TYR CD1 1 1 13 6966 1 1 4 TYR CD2 C 6.416 4.440 5.727 1.00 . A A . 4 TYR CD2 1 1 13 6967 1 1 4 TYR CE1 C 4.915 2.954 7.564 1.00 . A A . 4 TYR CE1 1 1 13 6968 1 1 4 TYR CE2 C 6.791 3.128 6.036 1.00 . A A . 4 TYR CE2 1 1 13 6969 1 1 4 TYR CG C 5.291 5.010 6.334 1.00 . A A . 4 TYR CG 1 1 13 6970 1 1 4 TYR CZ C 6.040 2.385 6.955 1.00 . A A . 4 TYR CZ 1 1 13 6971 1 1 4 TYR H H 4.462 6.837 3.339 1.00 . A A . 4 TYR H 1 1 13 6972 1 1 4 TYR HA H 2.879 5.767 5.630 1.00 . A A . 4 TYR HA 1 1 13 6973 1 1 4 TYR HB2 H 5.671 6.877 5.392 1.00 . A A . 4 TYR HB2 1 1 13 6974 1 1 4 TYR HB3 H 4.794 6.990 6.927 1.00 . A A . 4 TYR HB3 1 1 13 6975 1 1 4 TYR HD1 H 3.672 4.705 7.722 1.00 . A A . 4 TYR HD1 1 1 13 6976 1 1 4 TYR HD2 H 6.995 5.014 5.018 1.00 . A A . 4 TYR HD2 1 1 13 6977 1 1 4 TYR HE1 H 4.336 2.380 8.272 1.00 . A A . 4 TYR HE1 1 1 13 6978 1 1 4 TYR HE2 H 7.659 2.689 5.567 1.00 . A A . 4 TYR HE2 1 1 13 6979 1 1 4 TYR HH H 7.096 0.766 6.684 1.00 . A A . 4 TYR HH 1 1 13 6980 1 1 4 TYR N N 3.801 6.254 3.834 1.00 . A A . 4 TYR N 1 1 13 6981 1 1 4 TYR O O 3.677 8.863 5.602 1.00 . A A . 4 TYR O 1 1 13 6982 1 1 4 TYR OH O 6.405 1.105 7.258 1.00 . A A . 4 TYR OH 1 1 13 6983 1 1 5 VAL C C 0.547 9.428 6.953 1.00 . A A . 5 VAL C 1 1 13 6984 1 1 5 VAL CA C 0.924 9.228 5.483 1.00 . A A . 5 VAL CA 1 1 13 6985 1 1 5 VAL CB C -0.282 9.275 4.545 1.00 . A A . 5 VAL CB 1 1 13 6986 1 1 5 VAL CG1 C -1.054 10.586 4.707 1.00 . A A . 5 VAL CG1 1 1 13 6987 1 1 5 VAL CG2 C 0.146 9.068 3.090 1.00 . A A . 5 VAL CG2 1 1 13 6988 1 1 5 VAL H H 1.029 7.169 5.178 1.00 . A A . 5 VAL H 1 1 13 6989 1 1 5 VAL HA H 1.613 10.018 5.187 1.00 . A A . 5 VAL HA 1 1 13 6990 1 1 5 VAL HB H -0.951 8.458 4.816 1.00 . A A . 5 VAL HB 1 1 13 6991 1 1 5 VAL HG11 H -0.504 11.393 4.220 1.00 . A A . 5 VAL HG11 1 1 13 6992 1 1 5 VAL HG12 H -2.037 10.489 4.250 1.00 . A A . 5 VAL HG12 1 1 13 6993 1 1 5 VAL HG13 H -1.167 10.812 5.767 1.00 . A A . 5 VAL HG13 1 1 13 6994 1 1 5 VAL HG21 H -0.233 8.111 2.733 1.00 . A A . 5 VAL HG21 1 1 13 6995 1 1 5 VAL HG22 H -0.257 9.872 2.475 1.00 . A A . 5 VAL HG22 1 1 13 6996 1 1 5 VAL HG23 H 1.234 9.073 3.028 1.00 . A A . 5 VAL HG23 1 1 13 6997 1 1 5 VAL N N 1.621 7.961 5.336 1.00 . A A . 5 VAL N 1 1 13 6998 1 1 5 VAL O O -0.137 8.591 7.541 1.00 . A A . 5 VAL O 1 1 13 6999 1 1 6 CYS C C -0.791 10.925 9.073 1.00 . A A . 6 CYS C 1 1 13 7000 1 1 6 CYS CA C 0.727 10.862 8.892 1.00 . A A . 6 CYS CA 1 1 13 7001 1 1 6 CYS CB C 1.407 12.163 9.321 1.00 . A A . 6 CYS CB 1 1 13 7002 1 1 6 CYS H H 1.563 11.216 7.017 1.00 . A A . 6 CYS H 1 1 13 7003 1 1 6 CYS HA H 1.155 10.059 9.492 1.00 . A A . 6 CYS HA 1 1 13 7004 1 1 6 CYS HB2 H 2.438 12.151 8.969 1.00 . A A . 6 CYS HB2 1 1 13 7005 1 1 6 CYS HB3 H 0.911 12.997 8.824 1.00 . A A . 6 CYS HB3 1 1 13 7006 1 1 6 CYS N N 1.008 10.541 7.503 1.00 . A A . 6 CYS N 1 1 13 7007 1 1 6 CYS O O -1.522 11.191 8.121 1.00 . A A . 6 CYS O 1 1 13 7008 1 1 6 CYS SG S 1.405 12.472 11.124 1.00 . A A . 6 CYS SG 1 1 13 7009 1 1 7 THR C C -2.959 11.886 11.529 1.00 . A A . 7 THR C 1 1 13 7010 1 1 7 THR CA C -2.637 10.699 10.619 1.00 . A A . 7 THR CA 1 1 13 7011 1 1 7 THR CB C -3.008 9.347 11.231 1.00 . A A . 7 THR CB 1 1 13 7012 1 1 7 THR CG2 C -2.882 8.197 10.230 1.00 . A A . 7 THR CG2 1 1 13 7013 1 1 7 THR H H -0.617 10.458 11.070 1.00 . A A . 7 THR H 1 1 13 7014 1 1 7 THR HA H -3.194 10.845 9.694 1.00 . A A . 7 THR HA 1 1 13 7015 1 1 7 THR HB H -4.007 9.377 11.666 1.00 . A A . 7 THR HB 1 1 13 7016 1 1 7 THR HG1 H -2.073 9.708 12.963 1.00 . A A . 7 THR HG1 1 1 13 7017 1 1 7 THR HG21 H -3.144 7.258 10.720 1.00 . A A . 7 THR HG21 1 1 13 7018 1 1 7 THR HG22 H -3.557 8.370 9.391 1.00 . A A . 7 THR HG22 1 1 13 7019 1 1 7 THR HG23 H -1.856 8.142 9.867 1.00 . A A . 7 THR HG23 1 1 13 7020 1 1 7 THR N N -1.220 10.675 10.301 1.00 . A A . 7 THR N 1 1 13 7021 1 1 7 THR O O -4.039 11.950 12.114 1.00 . A A . 7 THR O 1 1 13 7022 1 1 7 THR OG1 O -1.972 9.098 12.178 1.00 . A A . 7 THR OG1 1 1 13 7023 1 1 8 VAL C C -2.307 15.211 11.550 1.00 . A A . 8 VAL C 1 1 13 7024 1 1 8 VAL CA C -2.170 13.981 12.448 1.00 . A A . 8 VAL CA 1 1 13 7025 1 1 8 VAL CB C -1.013 14.091 13.442 1.00 . A A . 8 VAL CB 1 1 13 7026 1 1 8 VAL CG1 C -0.981 15.475 14.094 1.00 . A A . 8 VAL CG1 1 1 13 7027 1 1 8 VAL CG2 C -1.093 12.989 14.500 1.00 . A A . 8 VAL CG2 1 1 13 7028 1 1 8 VAL H H -1.127 12.739 11.140 1.00 . A A . 8 VAL H 1 1 13 7029 1 1 8 VAL HA H -3.092 13.855 13.015 1.00 . A A . 8 VAL HA 1 1 13 7030 1 1 8 VAL HB H -0.083 13.959 12.890 1.00 . A A . 8 VAL HB 1 1 13 7031 1 1 8 VAL HG11 H -1.920 15.991 13.897 1.00 . A A . 8 VAL HG11 1 1 13 7032 1 1 8 VAL HG12 H -0.845 15.367 15.170 1.00 . A A . 8 VAL HG12 1 1 13 7033 1 1 8 VAL HG13 H -0.155 16.053 13.679 1.00 . A A . 8 VAL HG13 1 1 13 7034 1 1 8 VAL HG21 H -1.439 12.064 14.037 1.00 . A A . 8 VAL HG21 1 1 13 7035 1 1 8 VAL HG22 H -0.104 12.829 14.934 1.00 . A A . 8 VAL HG22 1 1 13 7036 1 1 8 VAL HG23 H -1.789 13.286 15.284 1.00 . A A . 8 VAL HG23 1 1 13 7037 1 1 8 VAL N N -2.001 12.798 11.619 1.00 . A A . 8 VAL N 1 1 13 7038 1 1 8 VAL O O -3.255 15.983 11.688 1.00 . A A . 8 VAL O 1 1 13 7039 1 1 9 CYS C C -1.674 15.958 8.331 1.00 . A A . 9 CYS C 1 1 13 7040 1 1 9 CYS CA C -1.347 16.482 9.730 1.00 . A A . 9 CYS CA 1 1 13 7041 1 1 9 CYS CB C -0.016 17.238 9.758 1.00 . A A . 9 CYS CB 1 1 13 7042 1 1 9 CYS H H -0.578 14.725 10.544 1.00 . A A . 9 CYS H 1 1 13 7043 1 1 9 CYS HA H -2.118 17.169 10.076 1.00 . A A . 9 CYS HA 1 1 13 7044 1 1 9 CYS HB2 H 0.052 17.858 8.865 1.00 . A A . 9 CYS HB2 1 1 13 7045 1 1 9 CYS HB3 H -0.016 17.912 10.615 1.00 . A A . 9 CYS HB3 1 1 13 7046 1 1 9 CYS N N -1.345 15.358 10.650 1.00 . A A . 9 CYS N 1 1 13 7047 1 1 9 CYS O O -2.079 16.722 7.456 1.00 . A A . 9 CYS O 1 1 13 7048 1 1 9 CYS SG S 1.470 16.174 9.851 1.00 . A A . 9 CYS SG 1 1 13 7049 1 1 10 GLY C C -0.509 14.014 5.999 1.00 . A A . 10 GLY C 1 1 13 7050 1 1 10 GLY CA C -1.759 14.021 6.884 1.00 . A A . 10 GLY CA 1 1 13 7051 1 1 10 GLY H H -1.158 14.042 8.878 1.00 . A A . 10 GLY H 1 1 13 7052 1 1 10 GLY HA2 H -2.098 12.999 7.047 1.00 . A A . 10 GLY HA2 1 1 13 7053 1 1 10 GLY HA3 H -2.565 14.548 6.375 1.00 . A A . 10 GLY HA3 1 1 13 7054 1 1 10 GLY N N -1.488 14.657 8.162 1.00 . A A . 10 GLY N 1 1 13 7055 1 1 10 GLY O O -0.558 13.728 4.805 1.00 . A A . 10 GLY O 1 1 13 7056 1 1 11 TYR C C 1.997 13.199 4.971 1.00 . A A . 11 TYR C 1 1 13 7057 1 1 11 TYR CA C 1.894 14.379 5.925 1.00 . A A . 11 TYR CA 1 1 13 7058 1 1 11 TYR CB C 3.032 14.355 6.941 1.00 . A A . 11 TYR CB 1 1 13 7059 1 1 11 TYR CD1 C 4.568 15.558 5.343 1.00 . A A . 11 TYR CD1 1 1 13 7060 1 1 11 TYR CD2 C 5.482 13.798 6.739 1.00 . A A . 11 TYR CD2 1 1 13 7061 1 1 11 TYR CE1 C 5.830 15.762 4.773 1.00 . A A . 11 TYR CE1 1 1 13 7062 1 1 11 TYR CE2 C 6.745 14.003 6.169 1.00 . A A . 11 TYR CE2 1 1 13 7063 1 1 11 TYR CG C 4.394 14.576 6.326 1.00 . A A . 11 TYR CG 1 1 13 7064 1 1 11 TYR CZ C 6.919 14.984 5.186 1.00 . A A . 11 TYR CZ 1 1 13 7065 1 1 11 TYR H H 0.610 14.565 7.607 1.00 . A A . 11 TYR H 1 1 13 7066 1 1 11 TYR HA H 1.952 15.304 5.351 1.00 . A A . 11 TYR HA 1 1 13 7067 1 1 11 TYR HB2 H 2.855 15.135 7.682 1.00 . A A . 11 TYR HB2 1 1 13 7068 1 1 11 TYR HB3 H 3.031 13.388 7.443 1.00 . A A . 11 TYR HB3 1 1 13 7069 1 1 11 TYR HD1 H 3.728 16.157 5.025 1.00 . A A . 11 TYR HD1 1 1 13 7070 1 1 11 TYR HD2 H 5.349 13.041 7.498 1.00 . A A . 11 TYR HD2 1 1 13 7071 1 1 11 TYR HE1 H 5.963 16.519 4.014 1.00 . A A . 11 TYR HE1 1 1 13 7072 1 1 11 TYR HE2 H 7.585 13.403 6.487 1.00 . A A . 11 TYR HE2 1 1 13 7073 1 1 11 TYR HH H 8.518 14.387 4.242 1.00 . A A . 11 TYR HH 1 1 13 7074 1 1 11 TYR N N 0.625 14.339 6.623 1.00 . A A . 11 TYR N 1 1 13 7075 1 1 11 TYR O O 1.305 12.204 5.180 1.00 . A A . 11 TYR O 1 1 13 7076 1 1 11 TYR OH O 8.148 15.183 4.630 1.00 . A A . 11 TYR OH 1 1 13 7077 1 1 12 GLU C C 4.501 11.922 2.830 1.00 . A A . 12 GLU C 1 1 13 7078 1 1 12 GLU CA C 3.017 12.256 2.991 1.00 . A A . 12 GLU CA 1 1 13 7079 1 1 12 GLU CB C 2.389 12.626 1.646 1.00 . A A . 12 GLU CB 1 1 13 7080 1 1 12 GLU CD C 0.552 12.093 0.002 1.00 . A A . 12 GLU CD 1 1 13 7081 1 1 12 GLU CG C 1.090 11.853 1.415 1.00 . A A . 12 GLU CG 1 1 13 7082 1 1 12 GLU H H 3.402 14.138 3.796 1.00 . A A . 12 GLU H 1 1 13 7083 1 1 12 GLU HA H 2.489 11.399 3.407 1.00 . A A . 12 GLU HA 1 1 13 7084 1 1 12 GLU HB2 H 2.189 13.697 1.617 1.00 . A A . 12 GLU HB2 1 1 13 7085 1 1 12 GLU HB3 H 3.092 12.413 0.841 1.00 . A A . 12 GLU HB3 1 1 13 7086 1 1 12 GLU HE2 H -0.045 11.170 -1.527 1.00 . A A . 12 GLU HE2 1 1 13 7087 1 1 12 GLU HG2 H 1.265 10.787 1.565 1.00 . A A . 12 GLU HG2 1 1 13 7088 1 1 12 GLU HG3 H 0.344 12.160 2.149 1.00 . A A . 12 GLU HG3 1 1 13 7089 1 1 12 GLU N N 2.843 13.325 3.960 1.00 . A A . 12 GLU N 1 1 13 7090 1 1 12 GLU O O 5.301 12.718 2.345 1.00 . A A . 12 GLU O 1 1 13 7091 1 1 12 GLU OE1 O 0.712 13.195 -0.543 1.00 . A A . 12 GLU OE1 1 1 13 7092 1 1 12 GLU OE2 O -0.050 11.084 -0.531 1.00 . A A . 12 GLU OE2 1 1 13 7093 1 1 13 TYR C C 6.375 9.282 1.999 1.00 . A A . 13 TYR C 1 1 13 7094 1 1 13 TYR CA C 6.225 10.239 3.174 1.00 . A A . 13 TYR CA 1 1 13 7095 1 1 13 TYR CB C 6.605 9.552 4.482 1.00 . A A . 13 TYR CB 1 1 13 7096 1 1 13 TYR CD1 C 9.068 10.062 4.636 1.00 . A A . 13 TYR CD1 1 1 13 7097 1 1 13 TYR CD2 C 8.364 7.747 4.480 1.00 . A A . 13 TYR CD2 1 1 13 7098 1 1 13 TYR CE1 C 10.406 9.652 4.683 1.00 . A A . 13 TYR CE1 1 1 13 7099 1 1 13 TYR CE2 C 9.702 7.337 4.527 1.00 . A A . 13 TYR CE2 1 1 13 7100 1 1 13 TYR CG C 8.048 9.110 4.534 1.00 . A A . 13 TYR CG 1 1 13 7101 1 1 13 TYR CZ C 10.723 8.289 4.628 1.00 . A A . 13 TYR CZ 1 1 13 7102 1 1 13 TYR H H 4.159 10.088 3.646 1.00 . A A . 13 TYR H 1 1 13 7103 1 1 13 TYR HA H 6.882 11.094 3.018 1.00 . A A . 13 TYR HA 1 1 13 7104 1 1 13 TYR HB2 H 6.423 10.244 5.304 1.00 . A A . 13 TYR HB2 1 1 13 7105 1 1 13 TYR HB3 H 5.968 8.678 4.615 1.00 . A A . 13 TYR HB3 1 1 13 7106 1 1 13 TYR HD1 H 8.824 11.113 4.679 1.00 . A A . 13 TYR HD1 1 1 13 7107 1 1 13 TYR HD2 H 7.577 7.012 4.401 1.00 . A A . 13 TYR HD2 1 1 13 7108 1 1 13 TYR HE1 H 11.194 10.387 4.762 1.00 . A A . 13 TYR HE1 1 1 13 7109 1 1 13 TYR HE2 H 9.946 6.286 4.485 1.00 . A A . 13 TYR HE2 1 1 13 7110 1 1 13 TYR HH H 12.525 8.316 5.375 1.00 . A A . 13 TYR HH 1 1 13 7111 1 1 13 TYR N N 4.855 10.707 3.254 1.00 . A A . 13 TYR N 1 1 13 7112 1 1 13 TYR O O 5.366 8.770 1.518 1.00 . A A . 13 TYR O 1 1 13 7113 1 1 13 TYR OH O 12.026 7.889 4.674 1.00 . A A . 13 TYR OH 1 1 13 7114 1 1 14 ASP C C 9.072 7.290 0.772 1.00 . A A . 14 ASP C 1 1 13 7115 1 1 14 ASP CA C 7.861 8.168 0.450 1.00 . A A . 14 ASP CA 1 1 13 7116 1 1 14 ASP CB C 8.171 8.952 -0.826 1.00 . A A . 14 ASP CB 1 1 13 7117 1 1 14 ASP CG C 7.851 8.217 -2.129 1.00 . A A . 14 ASP CG 1 1 13 7118 1 1 14 ASP H H 8.423 9.486 1.962 1.00 . A A . 14 ASP H 1 1 13 7119 1 1 14 ASP HA H 6.944 7.589 0.334 1.00 . A A . 14 ASP HA 1 1 13 7120 1 1 14 ASP HB2 H 7.609 9.887 -0.807 1.00 . A A . 14 ASP HB2 1 1 13 7121 1 1 14 ASP HB3 H 9.228 9.215 -0.826 1.00 . A A . 14 ASP HB3 1 1 13 7122 1 1 14 ASP HD2 H 9.620 8.529 -2.694 1.00 . A A . 14 ASP HD2 1 1 13 7123 1 1 14 ASP N N 7.607 9.064 1.565 1.00 . A A . 14 ASP N 1 1 13 7124 1 1 14 ASP O O 10.221 7.651 0.530 1.00 . A A . 14 ASP O 1 1 13 7125 1 1 14 ASP OD1 O 6.836 7.514 -2.235 1.00 . A A . 14 ASP OD1 1 1 13 7126 1 1 14 ASP OD2 O 8.708 8.392 -3.079 1.00 . A A . 14 ASP OD2 1 1 13 7127 1 1 15 PRO C C 10.929 5.153 0.726 1.00 . A A . 15 PRO C 1 1 13 7128 1 1 15 PRO CA C 9.770 5.127 1.714 1.00 . A A . 15 PRO CA 1 1 13 7129 1 1 15 PRO CB C 9.033 3.790 1.657 1.00 . A A . 15 PRO CB 1 1 13 7130 1 1 15 PRO CD C 7.442 5.656 1.628 1.00 . A A . 15 PRO CD 1 1 13 7131 1 1 15 PRO CG C 7.621 4.249 2.191 1.00 . A A . 15 PRO CG 1 1 13 7132 1 1 15 PRO HA H 10.140 5.314 2.722 1.00 . A A . 15 PRO HA 1 1 13 7133 1 1 15 PRO HB2 H 9.013 3.371 0.651 1.00 . A A . 15 PRO HB2 1 1 13 7134 1 1 15 PRO HB3 H 9.499 3.094 2.355 1.00 . A A . 15 PRO HB3 1 1 13 7135 1 1 15 PRO HD2 H 6.817 5.641 0.735 1.00 . A A . 15 PRO HD2 1 1 13 7136 1 1 15 PRO HD3 H 7.006 6.306 2.387 1.00 . A A . 15 PRO HD3 1 1 13 7137 1 1 15 PRO HG2 H 7.032 3.548 1.600 1.00 . A A . 15 PRO HG2 1 1 13 7138 1 1 15 PRO HG3 H 7.349 4.186 3.245 1.00 . A A . 15 PRO HG3 1 1 13 7139 1 1 15 PRO N N 8.783 6.112 1.330 1.00 . A A . 15 PRO N 1 1 13 7140 1 1 15 PRO O O 10.821 4.537 -0.333 1.00 . A A . 15 PRO O 1 1 13 7141 1 1 16 ALA C C 14.255 6.742 0.913 1.00 . A A . 16 ALA C 1 1 13 7142 1 1 16 ALA CA C 13.155 5.946 0.209 1.00 . A A . 16 ALA CA 1 1 13 7143 1 1 16 ALA CB C 12.743 6.574 -1.123 1.00 . A A . 16 ALA CB 1 1 13 7144 1 1 16 ALA H H 12.075 6.353 1.943 1.00 . A A . 16 ALA H 1 1 13 7145 1 1 16 ALA HA H 13.511 4.933 0.023 1.00 . A A . 16 ALA HA 1 1 13 7146 1 1 16 ALA HB1 H 11.897 6.026 -1.539 1.00 . A A . 16 ALA HB1 1 1 13 7147 1 1 16 ALA HB2 H 12.457 7.614 -0.962 1.00 . A A . 16 ALA HB2 1 1 13 7148 1 1 16 ALA HB3 H 13.581 6.532 -1.820 1.00 . A A . 16 ALA HB3 1 1 13 7149 1 1 16 ALA N N 11.996 5.854 1.080 1.00 . A A . 16 ALA N 1 1 13 7150 1 1 16 ALA O O 14.591 7.848 0.494 1.00 . A A . 16 ALA O 1 1 13 7151 1 1 17 PHE C C 16.994 5.812 3.001 1.00 . A A . 17 PHE C 1 1 13 7152 1 1 17 PHE CA C 15.843 6.785 2.737 1.00 . A A . 17 PHE CA 1 1 13 7153 1 1 17 PHE CB C 15.232 7.208 4.074 1.00 . A A . 17 PHE CB 1 1 13 7154 1 1 17 PHE CD1 C 14.824 9.604 3.473 1.00 . A A . 17 PHE CD1 1 1 13 7155 1 1 17 PHE CD2 C 15.937 9.144 5.498 1.00 . A A . 17 PHE CD2 1 1 13 7156 1 1 17 PHE CE1 C 14.920 10.997 3.737 1.00 . A A . 17 PHE CE1 1 1 13 7157 1 1 17 PHE CE2 C 16.032 10.537 5.762 1.00 . A A . 17 PHE CE2 1 1 13 7158 1 1 17 PHE CG C 15.335 8.708 4.358 1.00 . A A . 17 PHE CG 1 1 13 7159 1 1 17 PHE CZ C 15.521 11.433 4.876 1.00 . A A . 17 PHE CZ 1 1 13 7160 1 1 17 PHE H H 14.508 5.246 2.305 1.00 . A A . 17 PHE H 1 1 13 7161 1 1 17 PHE HA H 16.208 7.625 2.147 1.00 . A A . 17 PHE HA 1 1 13 7162 1 1 17 PHE HB2 H 14.182 6.916 4.091 1.00 . A A . 17 PHE HB2 1 1 13 7163 1 1 17 PHE HB3 H 15.728 6.662 4.878 1.00 . A A . 17 PHE HB3 1 1 13 7164 1 1 17 PHE HD1 H 14.342 9.255 2.560 1.00 . A A . 17 PHE HD1 1 1 13 7165 1 1 17 PHE HD2 H 16.346 8.426 6.208 1.00 . A A . 17 PHE HD2 1 1 13 7166 1 1 17 PHE HE1 H 14.509 11.715 3.027 1.00 . A A . 17 PHE HE1 1 1 13 7167 1 1 17 PHE HE2 H 16.514 10.886 6.674 1.00 . A A . 17 PHE HE2 1 1 13 7168 1 1 17 PHE HZ H 15.594 12.501 5.079 1.00 . A A . 17 PHE HZ 1 1 13 7169 1 1 17 PHE N N 14.787 6.145 1.971 1.00 . A A . 17 PHE N 1 1 13 7170 1 1 17 PHE O O 17.097 4.776 2.348 1.00 . A A . 17 PHE O 1 1 13 7171 1 1 18 GLU C C 19.046 5.183 5.835 1.00 . A A . 18 GLU C 1 1 13 7172 1 1 18 GLU CA C 18.971 5.356 4.317 1.00 . A A . 18 GLU CA 1 1 13 7173 1 1 18 GLU CB C 20.271 5.947 3.768 1.00 . A A . 18 GLU CB 1 1 13 7174 1 1 18 GLU CD C 21.878 5.001 2.070 1.00 . A A . 18 GLU CD 1 1 13 7175 1 1 18 GLU CG C 21.293 4.845 3.476 1.00 . A A . 18 GLU CG 1 1 13 7176 1 1 18 GLU H H 17.740 7.027 4.486 1.00 . A A . 18 GLU H 1 1 13 7177 1 1 18 GLU HA H 18.789 4.391 3.844 1.00 . A A . 18 GLU HA 1 1 13 7178 1 1 18 GLU HB2 H 20.063 6.506 2.856 1.00 . A A . 18 GLU HB2 1 1 13 7179 1 1 18 GLU HB3 H 20.687 6.652 4.487 1.00 . A A . 18 GLU HB3 1 1 13 7180 1 1 18 GLU HE2 H 23.460 5.612 1.252 1.00 . A A . 18 GLU HE2 1 1 13 7181 1 1 18 GLU HG2 H 22.095 4.883 4.213 1.00 . A A . 18 GLU HG2 1 1 13 7182 1 1 18 GLU HG3 H 20.818 3.869 3.569 1.00 . A A . 18 GLU HG3 1 1 13 7183 1 1 18 GLU N N 17.831 6.182 3.959 1.00 . A A . 18 GLU N 1 1 13 7184 1 1 18 GLU O O 18.948 4.067 6.343 1.00 . A A . 18 GLU O 1 1 13 7185 1 1 18 GLU OE1 O 21.123 5.080 1.089 1.00 . A A . 18 GLU OE1 1 1 13 7186 1 1 18 GLU OE2 O 23.166 5.039 2.017 1.00 . A A . 18 GLU OE2 1 1 13 7187 1 1 19 ASP C C 17.924 6.557 8.563 1.00 . A A . 19 ASP C 1 1 13 7188 1 1 19 ASP CA C 19.309 6.293 7.969 1.00 . A A . 19 ASP CA 1 1 13 7189 1 1 19 ASP CB C 20.254 7.385 8.472 1.00 . A A . 19 ASP CB 1 1 13 7190 1 1 19 ASP CG C 21.526 6.875 9.153 1.00 . A A . 19 ASP CG 1 1 13 7191 1 1 19 ASP H H 19.299 7.209 6.098 1.00 . A A . 19 ASP H 1 1 13 7192 1 1 19 ASP HA H 19.691 5.305 8.224 1.00 . A A . 19 ASP HA 1 1 13 7193 1 1 19 ASP HB2 H 20.540 8.015 7.629 1.00 . A A . 19 ASP HB2 1 1 13 7194 1 1 19 ASP HB3 H 19.713 8.019 9.174 1.00 . A A . 19 ASP HB3 1 1 13 7195 1 1 19 ASP HD2 H 21.255 8.123 10.538 1.00 . A A . 19 ASP HD2 1 1 13 7196 1 1 19 ASP N N 19.220 6.305 6.519 1.00 . A A . 19 ASP N 1 1 13 7197 1 1 19 ASP O O 17.447 7.691 8.558 1.00 . A A . 19 ASP O 1 1 13 7198 1 1 19 ASP OD1 O 22.350 6.185 8.535 1.00 . A A . 19 ASP OD1 1 1 13 7199 1 1 19 ASP OD2 O 21.658 7.220 10.390 1.00 . A A . 19 ASP OD2 1 1 13 7200 1 1 20 LEU C C 16.052 5.091 11.102 1.00 . A A . 20 LEU C 1 1 13 7201 1 1 20 LEU CA C 15.995 5.593 9.658 1.00 . A A . 20 LEU CA 1 1 13 7202 1 1 20 LEU CB C 14.960 4.867 8.796 1.00 . A A . 20 LEU CB 1 1 13 7203 1 1 20 LEU CD1 C 12.619 5.448 8.059 1.00 . A A . 20 LEU CD1 1 1 13 7204 1 1 20 LEU CD2 C 12.992 3.730 9.888 1.00 . A A . 20 LEU CD2 1 1 13 7205 1 1 20 LEU CG C 13.501 5.015 9.233 1.00 . A A . 20 LEU CG 1 1 13 7206 1 1 20 LEU H H 17.710 4.572 9.062 1.00 . A A . 20 LEU H 1 1 13 7207 1 1 20 LEU HA H 15.722 6.648 9.669 1.00 . A A . 20 LEU HA 1 1 13 7208 1 1 20 LEU HB2 H 15.050 5.230 7.771 1.00 . A A . 20 LEU HB2 1 1 13 7209 1 1 20 LEU HB3 H 15.208 3.806 8.781 1.00 . A A . 20 LEU HB3 1 1 13 7210 1 1 20 LEU HD11 H 11.787 6.045 8.432 1.00 . A A . 20 LEU HD11 1 1 13 7211 1 1 20 LEU HD12 H 13.209 6.041 7.360 1.00 . A A . 20 LEU HD12 1 1 13 7212 1 1 20 LEU HD13 H 12.233 4.565 7.549 1.00 . A A . 20 LEU HD13 1 1 13 7213 1 1 20 LEU HD21 H 12.452 3.979 10.802 1.00 . A A . 20 LEU HD21 1 1 13 7214 1 1 20 LEU HD22 H 12.323 3.211 9.202 1.00 . A A . 20 LEU HD22 1 1 13 7215 1 1 20 LEU HD23 H 13.837 3.086 10.130 1.00 . A A . 20 LEU HD23 1 1 13 7216 1 1 20 LEU HG H 13.447 5.804 9.984 1.00 . A A . 20 LEU HG 1 1 13 7217 1 1 20 LEU N N 17.316 5.490 9.062 1.00 . A A . 20 LEU N 1 1 13 7218 1 1 20 LEU O O 15.743 3.941 11.406 1.00 . A A . 20 LEU O 1 1 13 7219 1 1 21 PRO C C 15.284 5.160 13.949 1.00 . A A . 21 PRO C 1 1 13 7220 1 1 21 PRO CA C 16.588 5.736 13.415 1.00 . A A . 21 PRO CA 1 1 13 7221 1 1 21 PRO CB C 16.878 7.100 14.037 1.00 . A A . 21 PRO CB 1 1 13 7222 1 1 21 PRO CD C 16.832 7.354 11.674 1.00 . A A . 21 PRO CD 1 1 13 7223 1 1 21 PRO CG C 17.573 7.864 12.908 1.00 . A A . 21 PRO CG 1 1 13 7224 1 1 21 PRO HA H 17.406 5.045 13.617 1.00 . A A . 21 PRO HA 1 1 13 7225 1 1 21 PRO HB2 H 15.968 7.625 14.328 1.00 . A A . 21 PRO HB2 1 1 13 7226 1 1 21 PRO HB3 H 17.540 6.971 14.893 1.00 . A A . 21 PRO HB3 1 1 13 7227 1 1 21 PRO HD2 H 15.956 7.969 11.465 1.00 . A A . 21 PRO HD2 1 1 13 7228 1 1 21 PRO HD3 H 17.504 7.346 10.816 1.00 . A A . 21 PRO HD3 1 1 13 7229 1 1 21 PRO HG2 H 17.482 8.949 12.958 1.00 . A A . 21 PRO HG2 1 1 13 7230 1 1 21 PRO HG3 H 18.620 7.563 12.916 1.00 . A A . 21 PRO HG3 1 1 13 7231 1 1 21 PRO N N 16.460 5.993 11.998 1.00 . A A . 21 PRO N 1 1 13 7232 1 1 21 PRO O O 14.367 4.935 13.159 1.00 . A A . 21 PRO O 1 1 13 7233 1 1 22 ASP C C 13.355 5.461 16.723 1.00 . A A . 22 ASP C 1 1 13 7234 1 1 22 ASP CA C 14.024 4.386 15.863 1.00 . A A . 22 ASP CA 1 1 13 7235 1 1 22 ASP CB C 14.360 3.199 16.767 1.00 . A A . 22 ASP CB 1 1 13 7236 1 1 22 ASP CG C 15.491 3.447 17.768 1.00 . A A . 22 ASP CG 1 1 13 7237 1 1 22 ASP H H 15.972 5.121 15.889 1.00 . A A . 22 ASP H 1 1 13 7238 1 1 22 ASP HA H 13.397 4.070 15.029 1.00 . A A . 22 ASP HA 1 1 13 7239 1 1 22 ASP HB2 H 13.463 2.916 17.319 1.00 . A A . 22 ASP HB2 1 1 13 7240 1 1 22 ASP HB3 H 14.630 2.349 16.140 1.00 . A A . 22 ASP HB3 1 1 13 7241 1 1 22 ASP HD2 H 14.991 2.839 19.478 1.00 . A A . 22 ASP HD2 1 1 13 7242 1 1 22 ASP N N 15.223 4.935 15.253 1.00 . A A . 22 ASP N 1 1 13 7243 1 1 22 ASP O O 12.997 5.208 17.871 1.00 . A A . 22 ASP O 1 1 13 7244 1 1 22 ASP OD1 O 16.679 3.408 17.412 1.00 . A A . 22 ASP OD1 1 1 13 7245 1 1 22 ASP OD2 O 15.107 3.694 18.974 1.00 . A A . 22 ASP OD2 1 1 13 7246 1 1 23 ASP C C 12.367 8.904 15.848 1.00 . A A . 23 ASP C 1 1 13 7247 1 1 23 ASP CA C 12.590 7.753 16.831 1.00 . A A . 23 ASP CA 1 1 13 7248 1 1 23 ASP CB C 13.489 8.263 17.959 1.00 . A A . 23 ASP CB 1 1 13 7249 1 1 23 ASP CG C 14.991 8.147 17.692 1.00 . A A . 23 ASP CG 1 1 13 7250 1 1 23 ASP H H 13.503 6.836 15.198 1.00 . A A . 23 ASP H 1 1 13 7251 1 1 23 ASP HA H 11.657 7.358 17.230 1.00 . A A . 23 ASP HA 1 1 13 7252 1 1 23 ASP HB2 H 13.248 9.309 18.151 1.00 . A A . 23 ASP HB2 1 1 13 7253 1 1 23 ASP HB3 H 13.253 7.711 18.869 1.00 . A A . 23 ASP HB3 1 1 13 7254 1 1 23 ASP HD2 H 16.527 8.257 18.776 1.00 . A A . 23 ASP HD2 1 1 13 7255 1 1 23 ASP N N 13.209 6.639 16.133 1.00 . A A . 23 ASP N 1 1 13 7256 1 1 23 ASP O O 12.824 10.021 16.081 1.00 . A A . 23 ASP O 1 1 13 7257 1 1 23 ASP OD1 O 15.468 8.453 16.590 1.00 . A A . 23 ASP OD1 1 1 13 7258 1 1 23 ASP OD2 O 15.690 7.717 18.688 1.00 . A A . 23 ASP OD2 1 1 13 7259 1 1 24 TRP C C 10.065 10.281 14.128 1.00 . A A . 24 TRP C 1 1 13 7260 1 1 24 TRP CA C 11.373 9.584 13.750 1.00 . A A . 24 TRP CA 1 1 13 7261 1 1 24 TRP CB C 11.332 8.947 12.359 1.00 . A A . 24 TRP CB 1 1 13 7262 1 1 24 TRP CD1 C 12.437 10.875 11.046 1.00 . A A . 24 TRP CD1 1 1 13 7263 1 1 24 TRP CD2 C 10.613 10.086 10.070 1.00 . A A . 24 TRP CD2 1 1 13 7264 1 1 24 TRP CE2 C 11.100 11.101 9.274 1.00 . A A . 24 TRP CE2 1 1 13 7265 1 1 24 TRP CE3 C 9.450 9.374 9.723 1.00 . A A . 24 TRP CE3 1 1 13 7266 1 1 24 TRP CG C 11.484 9.948 11.213 1.00 . A A . 24 TRP CG 1 1 13 7267 1 1 24 TRP CH2 C 9.329 10.805 7.711 1.00 . A A . 24 TRP CH2 1 1 13 7268 1 1 24 TRP CZ2 C 10.489 11.498 8.078 1.00 . A A . 24 TRP CZ2 1 1 13 7269 1 1 24 TRP CZ3 C 8.851 9.784 8.525 1.00 . A A . 24 TRP CZ3 1 1 13 7270 1 1 24 TRP H H 11.295 7.679 14.588 1.00 . A A . 24 TRP H 1 1 13 7271 1 1 24 TRP HA H 12.191 10.304 13.746 1.00 . A A . 24 TRP HA 1 1 13 7272 1 1 24 TRP HB2 H 12.126 8.205 12.287 1.00 . A A . 24 TRP HB2 1 1 13 7273 1 1 24 TRP HB3 H 10.387 8.417 12.243 1.00 . A A . 24 TRP HB3 1 1 13 7274 1 1 24 TRP HD1 H 13.262 11.038 11.740 1.00 . A A . 24 TRP HD1 1 1 13 7275 1 1 24 TRP HE1 H 12.875 12.406 9.518 1.00 . A A . 24 TRP HE1 1 1 13 7276 1 1 24 TRP HE3 H 9.044 8.569 10.334 1.00 . A A . 24 TRP HE3 1 1 13 7277 1 1 24 TRP HH2 H 8.804 11.063 6.792 1.00 . A A . 24 TRP HH2 1 1 13 7278 1 1 24 TRP HZ2 H 10.895 12.304 7.466 1.00 . A A . 24 TRP HZ2 1 1 13 7279 1 1 24 TRP HZ3 H 7.946 9.265 8.207 1.00 . A A . 24 TRP HZ3 1 1 13 7280 1 1 24 TRP N N 11.664 8.590 14.770 1.00 . A A . 24 TRP N 1 1 13 7281 1 1 24 TRP NE1 N 12.245 11.597 9.885 1.00 . A A . 24 TRP NE1 1 1 13 7282 1 1 24 TRP O O 9.119 9.633 14.575 1.00 . A A . 24 TRP O 1 1 13 7283 1 1 25 ALA C C 8.495 13.230 13.033 1.00 . A A . 25 ALA C 1 1 13 7284 1 1 25 ALA CA C 8.875 12.383 14.249 1.00 . A A . 25 ALA CA 1 1 13 7285 1 1 25 ALA CB C 9.150 13.236 15.489 1.00 . A A . 25 ALA CB 1 1 13 7286 1 1 25 ALA H H 10.825 12.110 13.571 1.00 . A A . 25 ALA H 1 1 13 7287 1 1 25 ALA HA H 8.060 11.693 14.471 1.00 . A A . 25 ALA HA 1 1 13 7288 1 1 25 ALA HB1 H 8.916 14.279 15.273 1.00 . A A . 25 ALA HB1 1 1 13 7289 1 1 25 ALA HB2 H 8.527 12.888 16.314 1.00 . A A . 25 ALA HB2 1 1 13 7290 1 1 25 ALA HB3 H 10.200 13.148 15.765 1.00 . A A . 25 ALA HB3 1 1 13 7291 1 1 25 ALA N N 10.052 11.591 13.935 1.00 . A A . 25 ALA N 1 1 13 7292 1 1 25 ALA O O 9.355 13.846 12.407 1.00 . A A . 25 ALA O 1 1 13 7293 1 1 26 CYS C C 7.296 15.399 11.666 1.00 . A A . 26 CYS C 1 1 13 7294 1 1 26 CYS CA C 6.698 13.992 11.603 1.00 . A A . 26 CYS CA 1 1 13 7295 1 1 26 CYS CB C 5.168 14.021 11.579 1.00 . A A . 26 CYS CB 1 1 13 7296 1 1 26 CYS H H 6.509 12.727 13.248 1.00 . A A . 26 CYS H 1 1 13 7297 1 1 26 CYS HA H 7.027 13.471 10.704 1.00 . A A . 26 CYS HA 1 1 13 7298 1 1 26 CYS HB2 H 4.795 13.066 11.946 1.00 . A A . 26 CYS HB2 1 1 13 7299 1 1 26 CYS HB3 H 4.823 14.787 12.274 1.00 . A A . 26 CYS HB3 1 1 13 7300 1 1 26 CYS N N 7.204 13.232 12.734 1.00 . A A . 26 CYS N 1 1 13 7301 1 1 26 CYS O O 6.928 16.228 12.495 1.00 . A A . 26 CYS O 1 1 13 7302 1 1 26 CYS SG S 4.433 14.346 9.935 1.00 . A A . 26 CYS SG 1 1 13 7303 1 1 27 PRO C C 7.929 18.057 10.658 1.00 . A A . 27 PRO C 1 1 13 7304 1 1 27 PRO CA C 8.935 16.915 10.633 1.00 . A A . 27 PRO CA 1 1 13 7305 1 1 27 PRO CB C 9.645 16.841 9.282 1.00 . A A . 27 PRO CB 1 1 13 7306 1 1 27 PRO CD C 8.696 14.702 9.766 1.00 . A A . 27 PRO CD 1 1 13 7307 1 1 27 PRO CG C 9.951 15.331 9.165 1.00 . A A . 27 PRO CG 1 1 13 7308 1 1 27 PRO HA H 9.661 17.043 11.436 1.00 . A A . 27 PRO HA 1 1 13 7309 1 1 27 PRO HB2 H 9.038 17.247 8.473 1.00 . A A . 27 PRO HB2 1 1 13 7310 1 1 27 PRO HB3 H 10.598 17.365 9.349 1.00 . A A . 27 PRO HB3 1 1 13 7311 1 1 27 PRO HD2 H 7.942 14.529 8.998 1.00 . A A . 27 PRO HD2 1 1 13 7312 1 1 27 PRO HD3 H 8.953 13.766 10.263 1.00 . A A . 27 PRO HD3 1 1 13 7313 1 1 27 PRO HG2 H 10.032 15.041 8.118 1.00 . A A . 27 PRO HG2 1 1 13 7314 1 1 27 PRO HG3 H 10.854 15.056 9.712 1.00 . A A . 27 PRO HG3 1 1 13 7315 1 1 27 PRO N N 8.240 15.653 10.756 1.00 . A A . 27 PRO N 1 1 13 7316 1 1 27 PRO O O 8.323 19.190 10.936 1.00 . A A . 27 PRO O 1 1 13 7317 1 1 28 VAL C C 5.130 18.979 11.797 1.00 . A A . 28 VAL C 1 1 13 7318 1 1 28 VAL CA C 5.635 18.766 10.369 1.00 . A A . 28 VAL CA 1 1 13 7319 1 1 28 VAL CB C 4.523 18.373 9.394 1.00 . A A . 28 VAL CB 1 1 13 7320 1 1 28 VAL CG1 C 3.370 19.379 9.444 1.00 . A A . 28 VAL CG1 1 1 13 7321 1 1 28 VAL CG2 C 5.066 18.233 7.971 1.00 . A A . 28 VAL CG2 1 1 13 7322 1 1 28 VAL H H 6.361 16.826 10.149 1.00 . A A . 28 VAL H 1 1 13 7323 1 1 28 VAL HA H 6.084 19.692 10.014 1.00 . A A . 28 VAL HA 1 1 13 7324 1 1 28 VAL HB H 4.134 17.402 9.702 1.00 . A A . 28 VAL HB 1 1 13 7325 1 1 28 VAL HG11 H 2.781 19.210 10.346 1.00 . A A . 28 VAL HG11 1 1 13 7326 1 1 28 VAL HG12 H 3.772 20.392 9.458 1.00 . A A . 28 VAL HG12 1 1 13 7327 1 1 28 VAL HG13 H 2.738 19.251 8.566 1.00 . A A . 28 VAL HG13 1 1 13 7328 1 1 28 VAL HG21 H 5.956 17.604 7.982 1.00 . A A . 28 VAL HG21 1 1 13 7329 1 1 28 VAL HG22 H 4.307 17.776 7.336 1.00 . A A . 28 VAL HG22 1 1 13 7330 1 1 28 VAL HG23 H 5.322 19.218 7.580 1.00 . A A . 28 VAL HG23 1 1 13 7331 1 1 28 VAL N N 6.673 17.748 10.374 1.00 . A A . 28 VAL N 1 1 13 7332 1 1 28 VAL O O 5.653 19.822 12.525 1.00 . A A . 28 VAL O 1 1 13 7333 1 1 29 CYS C C 4.623 17.956 14.508 1.00 . A A . 29 CYS C 1 1 13 7334 1 1 29 CYS CA C 3.537 18.296 13.485 1.00 . A A . 29 CYS CA 1 1 13 7335 1 1 29 CYS CB C 2.313 17.391 13.631 1.00 . A A . 29 CYS CB 1 1 13 7336 1 1 29 CYS H H 3.700 17.519 11.558 1.00 . A A . 29 CYS H 1 1 13 7337 1 1 29 CYS HA H 3.199 19.324 13.606 1.00 . A A . 29 CYS HA 1 1 13 7338 1 1 29 CYS HB2 H 1.987 17.408 14.671 1.00 . A A . 29 CYS HB2 1 1 13 7339 1 1 29 CYS HB3 H 1.499 17.805 13.036 1.00 . A A . 29 CYS HB3 1 1 13 7340 1 1 29 CYS N N 4.119 18.202 12.156 1.00 . A A . 29 CYS N 1 1 13 7341 1 1 29 CYS O O 4.813 18.685 15.481 1.00 . A A . 29 CYS O 1 1 13 7342 1 1 29 CYS SG S 2.579 15.651 13.128 1.00 . A A . 29 CYS SG 1 1 13 7343 1 1 30 GLY C C 6.023 15.056 15.776 1.00 . A A . 30 GLY C 1 1 13 7344 1 1 30 GLY CA C 6.367 16.406 15.143 1.00 . A A . 30 GLY CA 1 1 13 7345 1 1 30 GLY H H 5.146 16.263 13.461 1.00 . A A . 30 GLY H 1 1 13 7346 1 1 30 GLY HA2 H 7.301 16.323 14.587 1.00 . A A . 30 GLY HA2 1 1 13 7347 1 1 30 GLY HA3 H 6.527 17.149 15.924 1.00 . A A . 30 GLY HA3 1 1 13 7348 1 1 30 GLY N N 5.307 16.850 14.255 1.00 . A A . 30 GLY N 1 1 13 7349 1 1 30 GLY O O 6.902 14.365 16.290 1.00 . A A . 30 GLY O 1 1 13 7350 1 1 31 ALA C C 5.227 12.341 15.874 1.00 . A A . 31 ALA C 1 1 13 7351 1 1 31 ALA CA C 4.272 13.467 16.280 1.00 . A A . 31 ALA CA 1 1 13 7352 1 1 31 ALA CB C 2.836 13.208 15.819 1.00 . A A . 31 ALA CB 1 1 13 7353 1 1 31 ALA H H 4.035 15.289 15.300 1.00 . A A . 31 ALA H 1 1 13 7354 1 1 31 ALA HA H 4.280 13.565 17.366 1.00 . A A . 31 ALA HA 1 1 13 7355 1 1 31 ALA HB1 H 2.730 12.162 15.531 1.00 . A A . 31 ALA HB1 1 1 13 7356 1 1 31 ALA HB2 H 2.147 13.433 16.633 1.00 . A A . 31 ALA HB2 1 1 13 7357 1 1 31 ALA HB3 H 2.608 13.845 14.964 1.00 . A A . 31 ALA HB3 1 1 13 7358 1 1 31 ALA N N 4.743 14.721 15.718 1.00 . A A . 31 ALA N 1 1 13 7359 1 1 31 ALA O O 5.926 12.449 14.869 1.00 . A A . 31 ALA O 1 1 13 7360 1 1 32 SER C C 5.604 9.411 15.159 1.00 . A A . 32 SER C 1 1 13 7361 1 1 32 SER CA C 6.080 10.144 16.415 1.00 . A A . 32 SER CA 1 1 13 7362 1 1 32 SER CB C 6.104 9.189 17.610 1.00 . A A . 32 SER CB 1 1 13 7363 1 1 32 SER H H 4.651 11.208 17.494 1.00 . A A . 32 SER H 1 1 13 7364 1 1 32 SER HA H 7.076 10.559 16.263 1.00 . A A . 32 SER HA 1 1 13 7365 1 1 32 SER HB2 H 6.492 8.220 17.293 1.00 . A A . 32 SER HB2 1 1 13 7366 1 1 32 SER HB3 H 6.789 9.572 18.367 1.00 . A A . 32 SER HB3 1 1 13 7367 1 1 32 SER HG H 4.891 8.597 19.087 1.00 . A A . 32 SER HG 1 1 13 7368 1 1 32 SER N N 5.223 11.288 16.678 1.00 . A A . 32 SER N 1 1 13 7369 1 1 32 SER O O 4.592 9.780 14.567 1.00 . A A . 32 SER O 1 1 13 7370 1 1 32 SER OG O 4.811 9.017 18.183 1.00 . A A . 32 SER OG 1 1 13 7371 1 1 33 LYS C C 5.121 6.434 14.026 1.00 . A A . 33 LYS C 1 1 13 7372 1 1 33 LYS CA C 6.026 7.598 13.615 1.00 . A A . 33 LYS CA 1 1 13 7373 1 1 33 LYS CB C 7.299 7.161 12.886 1.00 . A A . 33 LYS CB 1 1 13 7374 1 1 33 LYS CD C 8.450 4.943 13.221 1.00 . A A . 33 LYS CD 1 1 13 7375 1 1 33 LYS CE C 8.333 3.866 14.302 1.00 . A A . 33 LYS CE 1 1 13 7376 1 1 33 LYS CG C 8.200 6.334 13.806 1.00 . A A . 33 LYS CG 1 1 13 7377 1 1 33 LYS H H 7.180 8.092 15.277 1.00 . A A . 33 LYS H 1 1 13 7378 1 1 33 LYS HA H 5.470 8.244 12.935 1.00 . A A . 33 LYS HA 1 1 13 7379 1 1 33 LYS HB2 H 7.035 6.574 12.006 1.00 . A A . 33 LYS HB2 1 1 13 7380 1 1 33 LYS HB3 H 7.839 8.038 12.534 1.00 . A A . 33 LYS HB3 1 1 13 7381 1 1 33 LYS HD2 H 7.732 4.743 12.426 1.00 . A A . 33 LYS HD2 1 1 13 7382 1 1 33 LYS HD3 H 9.442 4.906 12.772 1.00 . A A . 33 LYS HD3 1 1 13 7383 1 1 33 LYS HE2 H 9.291 3.744 14.808 1.00 . A A . 33 LYS HE2 1 1 13 7384 1 1 33 LYS HE3 H 7.612 4.177 15.058 1.00 . A A . 33 LYS HE3 1 1 13 7385 1 1 33 LYS HG2 H 9.150 6.850 13.947 1.00 . A A . 33 LYS HG2 1 1 13 7386 1 1 33 LYS HG3 H 7.738 6.243 14.788 1.00 . A A . 33 LYS HG3 1 1 13 7387 1 1 33 LYS HZ1 H 7.231 2.098 14.283 1.00 . A A . 33 LYS HZ1 1 1 13 7388 1 1 33 LYS HZ2 H 7.490 2.702 12.794 1.00 . A A . 33 LYS HZ2 1 1 13 7389 1 1 33 LYS N N 6.358 8.386 14.790 1.00 . A A . 33 LYS N 1 1 13 7390 1 1 33 LYS NZ N 7.913 2.578 13.707 1.00 . A A . 33 LYS NZ 1 1 13 7391 1 1 33 LYS O O 5.252 5.328 13.504 1.00 . A A . 33 LYS O 1 1 13 7392 1 1 34 ASP C C 1.934 5.920 14.780 1.00 . A A . 34 ASP C 1 1 13 7393 1 1 34 ASP CA C 3.298 5.715 15.443 1.00 . A A . 34 ASP CA 1 1 13 7394 1 1 34 ASP CB C 3.110 5.825 16.957 1.00 . A A . 34 ASP CB 1 1 13 7395 1 1 34 ASP CG C 2.742 7.222 17.463 1.00 . A A . 34 ASP CG 1 1 13 7396 1 1 34 ASP H H 4.124 7.626 15.375 1.00 . A A . 34 ASP H 1 1 13 7397 1 1 34 ASP HA H 3.751 4.760 15.179 1.00 . A A . 34 ASP HA 1 1 13 7398 1 1 34 ASP HB2 H 2.329 5.128 17.263 1.00 . A A . 34 ASP HB2 1 1 13 7399 1 1 34 ASP HB3 H 4.030 5.508 17.446 1.00 . A A . 34 ASP HB3 1 1 13 7400 1 1 34 ASP HD2 H 1.817 8.160 18.808 1.00 . A A . 34 ASP HD2 1 1 13 7401 1 1 34 ASP N N 4.224 6.724 14.956 1.00 . A A . 34 ASP N 1 1 13 7402 1 1 34 ASP O O 1.382 4.993 14.190 1.00 . A A . 34 ASP O 1 1 13 7403 1 1 34 ASP OD1 O 2.967 8.230 16.777 1.00 . A A . 34 ASP OD1 1 1 13 7404 1 1 34 ASP OD2 O 2.195 7.251 18.631 1.00 . A A . 34 ASP OD2 1 1 13 7405 1 1 35 ALA C C 0.167 7.177 12.822 1.00 . A A . 35 ALA C 1 1 13 7406 1 1 35 ALA CA C 0.141 7.477 14.321 1.00 . A A . 35 ALA CA 1 1 13 7407 1 1 35 ALA CB C -0.183 8.943 14.617 1.00 . A A . 35 ALA CB 1 1 13 7408 1 1 35 ALA H H 1.886 7.888 15.383 1.00 . A A . 35 ALA H 1 1 13 7409 1 1 35 ALA HA H -0.612 6.848 14.796 1.00 . A A . 35 ALA HA 1 1 13 7410 1 1 35 ALA HB1 H -1.251 9.046 14.812 1.00 . A A . 35 ALA HB1 1 1 13 7411 1 1 35 ALA HB2 H 0.377 9.269 15.494 1.00 . A A . 35 ALA HB2 1 1 13 7412 1 1 35 ALA HB3 H 0.092 9.556 13.761 1.00 . A A . 35 ALA HB3 1 1 13 7413 1 1 35 ALA N N 1.430 7.139 14.901 1.00 . A A . 35 ALA N 1 1 13 7414 1 1 35 ALA O O -0.881 6.987 12.204 1.00 . A A . 35 ALA O 1 1 13 7415 1 1 36 PHE C C 1.001 5.491 10.497 1.00 . A A . 36 PHE C 1 1 13 7416 1 1 36 PHE CA C 1.551 6.871 10.861 1.00 . A A . 36 PHE CA 1 1 13 7417 1 1 36 PHE CB C 3.056 6.898 10.585 1.00 . A A . 36 PHE CB 1 1 13 7418 1 1 36 PHE CD1 C 3.846 9.127 11.408 1.00 . A A . 36 PHE CD1 1 1 13 7419 1 1 36 PHE CD2 C 3.897 8.720 9.088 1.00 . A A . 36 PHE CD2 1 1 13 7420 1 1 36 PHE CE1 C 4.370 10.428 11.191 1.00 . A A . 36 PHE CE1 1 1 13 7421 1 1 36 PHE CE2 C 4.422 10.022 8.871 1.00 . A A . 36 PHE CE2 1 1 13 7422 1 1 36 PHE CG C 3.621 8.300 10.352 1.00 . A A . 36 PHE CG 1 1 13 7423 1 1 36 PHE CZ C 4.648 10.849 9.928 1.00 . A A . 36 PHE CZ 1 1 13 7424 1 1 36 PHE H H 2.221 7.300 12.786 1.00 . A A . 36 PHE H 1 1 13 7425 1 1 36 PHE HA H 1.000 7.636 10.314 1.00 . A A . 36 PHE HA 1 1 13 7426 1 1 36 PHE HB2 H 3.578 6.442 11.426 1.00 . A A . 36 PHE HB2 1 1 13 7427 1 1 36 PHE HB3 H 3.264 6.283 9.709 1.00 . A A . 36 PHE HB3 1 1 13 7428 1 1 36 PHE HD1 H 3.624 8.790 12.420 1.00 . A A . 36 PHE HD1 1 1 13 7429 1 1 36 PHE HD2 H 3.717 8.058 8.242 1.00 . A A . 36 PHE HD2 1 1 13 7430 1 1 36 PHE HE1 H 4.551 11.091 12.037 1.00 . A A . 36 PHE HE1 1 1 13 7431 1 1 36 PHE HE2 H 4.645 10.358 7.859 1.00 . A A . 36 PHE HE2 1 1 13 7432 1 1 36 PHE HZ H 5.051 11.848 9.761 1.00 . A A . 36 PHE HZ 1 1 13 7433 1 1 36 PHE N N 1.375 7.144 12.278 1.00 . A A . 36 PHE N 1 1 13 7434 1 1 36 PHE O O 1.250 4.514 11.202 1.00 . A A . 36 PHE O 1 1 13 7435 1 1 37 GLU C C -0.387 4.194 7.401 1.00 . A A . 37 GLU C 1 1 13 7436 1 1 37 GLU CA C -0.322 4.209 8.930 1.00 . A A . 37 GLU CA 1 1 13 7437 1 1 37 GLU CB C -1.708 3.994 9.540 1.00 . A A . 37 GLU CB 1 1 13 7438 1 1 37 GLU CD C -0.718 2.270 11.091 1.00 . A A . 37 GLU CD 1 1 13 7439 1 1 37 GLU CG C -1.845 2.578 10.103 1.00 . A A . 37 GLU CG 1 1 13 7440 1 1 37 GLU H H 0.067 6.253 8.828 1.00 . A A . 37 GLU H 1 1 13 7441 1 1 37 GLU HA H 0.348 3.424 9.280 1.00 . A A . 37 GLU HA 1 1 13 7442 1 1 37 GLU HB2 H -1.878 4.723 10.333 1.00 . A A . 37 GLU HB2 1 1 13 7443 1 1 37 GLU HB3 H -2.474 4.163 8.782 1.00 . A A . 37 GLU HB3 1 1 13 7444 1 1 37 GLU HE2 H 1.080 1.722 11.199 1.00 . A A . 37 GLU HE2 1 1 13 7445 1 1 37 GLU HG2 H -2.810 2.473 10.601 1.00 . A A . 37 GLU HG2 1 1 13 7446 1 1 37 GLU HG3 H -1.827 1.855 9.288 1.00 . A A . 37 GLU HG3 1 1 13 7447 1 1 37 GLU N N 0.265 5.454 9.396 1.00 . A A . 37 GLU N 1 1 13 7448 1 1 37 GLU O O -0.591 5.232 6.775 1.00 . A A . 37 GLU O 1 1 13 7449 1 1 37 GLU OE1 O -0.822 2.615 12.278 1.00 . A A . 37 GLU OE1 1 1 13 7450 1 1 37 GLU OE2 O 0.292 1.646 10.588 1.00 . A A . 37 GLU OE2 1 1 13 7451 1 1 38 LYS C C -1.626 3.248 4.881 1.00 . A A . 38 LYS C 1 1 13 7452 1 1 38 LYS CA C -0.246 2.839 5.403 1.00 . A A . 38 LYS CA 1 1 13 7453 1 1 38 LYS CB C 0.160 1.415 5.015 1.00 . A A . 38 LYS CB 1 1 13 7454 1 1 38 LYS CD C 1.337 0.489 2.986 1.00 . A A . 38 LYS CD 1 1 13 7455 1 1 38 LYS CE C 1.140 -1.028 3.037 1.00 . A A . 38 LYS CE 1 1 13 7456 1 1 38 LYS CG C 0.094 1.219 3.499 1.00 . A A . 38 LYS CG 1 1 13 7457 1 1 38 LYS H H -0.045 2.163 7.363 1.00 . A A . 38 LYS H 1 1 13 7458 1 1 38 LYS HA H 0.498 3.513 4.978 1.00 . A A . 38 LYS HA 1 1 13 7459 1 1 38 LYS HB2 H 1.171 1.213 5.368 1.00 . A A . 38 LYS HB2 1 1 13 7460 1 1 38 LYS HB3 H -0.497 0.700 5.508 1.00 . A A . 38 LYS HB3 1 1 13 7461 1 1 38 LYS HD2 H 1.548 0.798 1.962 1.00 . A A . 38 LYS HD2 1 1 13 7462 1 1 38 LYS HD3 H 2.201 0.768 3.588 1.00 . A A . 38 LYS HD3 1 1 13 7463 1 1 38 LYS HE2 H 2.088 -1.529 2.842 1.00 . A A . 38 LYS HE2 1 1 13 7464 1 1 38 LYS HE3 H 0.821 -1.326 4.035 1.00 . A A . 38 LYS HE3 1 1 13 7465 1 1 38 LYS HG2 H -0.800 0.651 3.242 1.00 . A A . 38 LYS HG2 1 1 13 7466 1 1 38 LYS HG3 H 0.008 2.188 3.007 1.00 . A A . 38 LYS HG3 1 1 13 7467 1 1 38 LYS HZ1 H 0.007 -0.761 1.309 1.00 . A A . 38 LYS HZ1 1 1 13 7468 1 1 38 LYS HZ2 H 0.396 -2.319 1.581 1.00 . A A . 38 LYS HZ2 1 1 13 7469 1 1 38 LYS N N -0.210 3.003 6.846 1.00 . A A . 38 LYS N 1 1 13 7470 1 1 38 LYS NZ N 0.134 -1.454 2.039 1.00 . A A . 38 LYS NZ 1 1 13 7471 1 1 38 LYS O O -2.636 2.656 5.259 1.00 . A A . 38 LYS O 1 1 13 7472 1 1 39 GLN C C -2.671 5.053 1.958 1.00 . A A . 39 GLN C 1 1 13 7473 1 1 39 GLN CA C -2.862 4.751 3.445 1.00 . A A . 39 GLN CA 1 1 13 7474 1 1 39 GLN CB C -3.361 5.987 4.197 1.00 . A A . 39 GLN CB 1 1 13 7475 1 1 39 GLN CD C -5.414 5.751 5.641 1.00 . A A . 39 GLN CD 1 1 13 7476 1 1 39 GLN CG C -3.892 5.611 5.581 1.00 . A A . 39 GLN CG 1 1 13 7477 1 1 39 GLN H H -0.797 4.732 3.721 1.00 . A A . 39 GLN H 1 1 13 7478 1 1 39 GLN HA H -3.583 3.943 3.570 1.00 . A A . 39 GLN HA 1 1 13 7479 1 1 39 GLN HB2 H -2.549 6.707 4.298 1.00 . A A . 39 GLN HB2 1 1 13 7480 1 1 39 GLN HB3 H -4.148 6.474 3.621 1.00 . A A . 39 GLN HB3 1 1 13 7481 1 1 39 GLN HE21 H -5.562 4.167 4.389 1.00 . A A . 39 GLN HE21 1 1 13 7482 1 1 39 GLN HE22 H -7.069 4.862 4.885 1.00 . A A . 39 GLN HE22 1 1 13 7483 1 1 39 GLN HG2 H -3.609 4.585 5.817 1.00 . A A . 39 GLN HG2 1 1 13 7484 1 1 39 GLN HG3 H -3.435 6.250 6.336 1.00 . A A . 39 GLN HG3 1 1 13 7485 1 1 39 GLN N N -1.624 4.257 4.022 1.00 . A A . 39 GLN N 1 1 13 7486 1 1 39 GLN NE2 N -6.069 4.852 4.911 1.00 . A A . 39 GLN NE2 1 1 13 7487 1 1 39 GLN O O -2.415 6.195 1.580 1.00 . A A . 39 GLN O 1 1 13 7488 1 1 39 GLN OE1 O -5.959 6.618 6.305 1.00 . A A . 39 GLN OE1 1 1 14 7489 1 1 1 MET C C 4.091 2.098 -2.145 1.00 . A A . 1 MET C 1 1 14 7490 1 1 1 MET CA C 4.830 1.684 -3.420 1.00 . A A . 1 MET CA 1 1 14 7491 1 1 1 MET CB C 4.387 0.278 -3.833 1.00 . A A . 1 MET CB 1 1 14 7492 1 1 1 MET CE C 3.571 -1.054 -7.640 1.00 . A A . 1 MET CE 1 1 14 7493 1 1 1 MET CG C 4.527 0.082 -5.343 1.00 . A A . 1 MET CG 1 1 14 7494 1 1 1 MET H1 H 6.662 0.830 -2.918 1.00 . A A . 1 MET H1 1 1 14 7495 1 1 1 MET HA H 4.638 2.408 -4.211 1.00 . A A . 1 MET HA 1 1 14 7496 1 1 1 MET HB2 H 4.989 -0.464 -3.308 1.00 . A A . 1 MET HB2 1 1 14 7497 1 1 1 MET HB3 H 3.351 0.117 -3.536 1.00 . A A . 1 MET HB3 1 1 14 7498 1 1 1 MET HE1 H 2.568 -1.182 -8.046 1.00 . A A . 1 MET HE1 1 1 14 7499 1 1 1 MET HE2 H 3.924 -0.046 -7.857 1.00 . A A . 1 MET HE2 1 1 14 7500 1 1 1 MET HE3 H 4.243 -1.781 -8.096 1.00 . A A . 1 MET HE3 1 1 14 7501 1 1 1 MET HG2 H 4.215 0.985 -5.867 1.00 . A A . 1 MET HG2 1 1 14 7502 1 1 1 MET HG3 H 5.573 -0.091 -5.601 1.00 . A A . 1 MET HG3 1 1 14 7503 1 1 1 MET N N 6.268 1.699 -3.216 1.00 . A A . 1 MET N 1 1 14 7504 1 1 1 MET O O 3.336 3.069 -2.149 1.00 . A A . 1 MET O 1 1 14 7505 1 1 1 MET SD S 3.534 -1.304 -5.873 1.00 . A A . 1 MET SD 1 1 14 7506 1 1 2 ASP C C 3.782 3.117 0.483 1.00 . A A . 2 ASP C 1 1 14 7507 1 1 2 ASP CA C 3.703 1.617 0.193 1.00 . A A . 2 ASP CA 1 1 14 7508 1 1 2 ASP CB C 4.411 0.878 1.329 1.00 . A A . 2 ASP CB 1 1 14 7509 1 1 2 ASP CG C 5.927 0.747 1.168 1.00 . A A . 2 ASP CG 1 1 14 7510 1 1 2 ASP H H 4.950 0.553 -1.091 1.00 . A A . 2 ASP H 1 1 14 7511 1 1 2 ASP HA H 2.676 1.266 0.086 1.00 . A A . 2 ASP HA 1 1 14 7512 1 1 2 ASP HB2 H 4.204 1.396 2.265 1.00 . A A . 2 ASP HB2 1 1 14 7513 1 1 2 ASP HB3 H 3.982 -0.121 1.416 1.00 . A A . 2 ASP HB3 1 1 14 7514 1 1 2 ASP HD2 H 7.110 -0.716 1.273 1.00 . A A . 2 ASP HD2 1 1 14 7515 1 1 2 ASP N N 4.335 1.340 -1.086 1.00 . A A . 2 ASP N 1 1 14 7516 1 1 2 ASP O O 4.636 3.815 -0.063 1.00 . A A . 2 ASP O 1 1 14 7517 1 1 2 ASP OD1 O 6.561 1.518 0.433 1.00 . A A . 2 ASP OD1 1 1 14 7518 1 1 2 ASP OD2 O 6.467 -0.209 1.848 1.00 . A A . 2 ASP OD2 1 1 14 7519 1 1 3 ILE C C 2.622 5.094 3.221 1.00 . A A . 3 ILE C 1 1 14 7520 1 1 3 ILE CA C 2.838 4.975 1.712 1.00 . A A . 3 ILE CA 1 1 14 7521 1 1 3 ILE CB C 1.790 5.715 0.880 1.00 . A A . 3 ILE CB 1 1 14 7522 1 1 3 ILE CD1 C 1.034 6.250 -1.467 1.00 . A A . 3 ILE CD1 1 1 14 7523 1 1 3 ILE CG1 C 2.194 5.766 -0.595 1.00 . A A . 3 ILE CG1 1 1 14 7524 1 1 3 ILE CG2 C 1.524 7.111 1.449 1.00 . A A . 3 ILE CG2 1 1 14 7525 1 1 3 ILE H H 2.190 2.996 1.782 1.00 . A A . 3 ILE H 1 1 14 7526 1 1 3 ILE HA H 3.809 5.406 1.466 1.00 . A A . 3 ILE HA 1 1 14 7527 1 1 3 ILE HB H 0.853 5.160 0.938 1.00 . A A . 3 ILE HB 1 1 14 7528 1 1 3 ILE HD11 H 0.363 6.866 -0.868 1.00 . A A . 3 ILE HD11 1 1 14 7529 1 1 3 ILE HD12 H 1.424 6.838 -2.297 1.00 . A A . 3 ILE HD12 1 1 14 7530 1 1 3 ILE HD13 H 0.488 5.389 -1.854 1.00 . A A . 3 ILE HD13 1 1 14 7531 1 1 3 ILE HG12 H 3.049 6.431 -0.719 1.00 . A A . 3 ILE HG12 1 1 14 7532 1 1 3 ILE HG13 H 2.512 4.775 -0.922 1.00 . A A . 3 ILE HG13 1 1 14 7533 1 1 3 ILE HG21 H 1.406 7.045 2.530 1.00 . A A . 3 ILE HG21 1 1 14 7534 1 1 3 ILE HG22 H 2.364 7.765 1.215 1.00 . A A . 3 ILE HG22 1 1 14 7535 1 1 3 ILE HG23 H 0.614 7.516 1.007 1.00 . A A . 3 ILE HG23 1 1 14 7536 1 1 3 ILE N N 2.881 3.570 1.343 1.00 . A A . 3 ILE N 1 1 14 7537 1 1 3 ILE O O 1.893 4.322 3.840 1.00 . A A . 3 ILE O 1 1 14 7538 1 1 4 TYR C C 2.741 7.778 5.479 1.00 . A A . 4 TYR C 1 1 14 7539 1 1 4 TYR CA C 3.184 6.341 5.232 1.00 . A A . 4 TYR CA 1 1 14 7540 1 1 4 TYR CB C 4.536 6.073 5.888 1.00 . A A . 4 TYR CB 1 1 14 7541 1 1 4 TYR CD1 C 4.255 3.621 6.398 1.00 . A A . 4 TYR CD1 1 1 14 7542 1 1 4 TYR CD2 C 6.139 4.321 5.041 1.00 . A A . 4 TYR CD2 1 1 14 7543 1 1 4 TYR CE1 C 4.672 2.290 6.291 1.00 . A A . 4 TYR CE1 1 1 14 7544 1 1 4 TYR CE2 C 6.556 2.988 4.934 1.00 . A A . 4 TYR CE2 1 1 14 7545 1 1 4 TYR CG C 4.987 4.637 5.772 1.00 . A A . 4 TYR CG 1 1 14 7546 1 1 4 TYR CZ C 5.823 1.973 5.559 1.00 . A A . 4 TYR CZ 1 1 14 7547 1 1 4 TYR H H 3.869 6.702 3.254 1.00 . A A . 4 TYR H 1 1 14 7548 1 1 4 TYR HA H 2.444 5.665 5.660 1.00 . A A . 4 TYR HA 1 1 14 7549 1 1 4 TYR HB2 H 5.285 6.711 5.417 1.00 . A A . 4 TYR HB2 1 1 14 7550 1 1 4 TYR HB3 H 4.470 6.334 6.944 1.00 . A A . 4 TYR HB3 1 1 14 7551 1 1 4 TYR HD1 H 3.367 3.865 6.962 1.00 . A A . 4 TYR HD1 1 1 14 7552 1 1 4 TYR HD2 H 6.704 5.104 4.559 1.00 . A A . 4 TYR HD2 1 1 14 7553 1 1 4 TYR HE1 H 4.107 1.505 6.773 1.00 . A A . 4 TYR HE1 1 1 14 7554 1 1 4 TYR HE2 H 7.443 2.745 4.368 1.00 . A A . 4 TYR HE2 1 1 14 7555 1 1 4 TYR HH H 5.634 0.136 4.928 1.00 . A A . 4 TYR HH 1 1 14 7556 1 1 4 TYR N N 3.282 6.096 3.808 1.00 . A A . 4 TYR N 1 1 14 7557 1 1 4 TYR O O 3.598 8.644 5.640 1.00 . A A . 4 TYR O 1 1 14 7558 1 1 4 TYR OH O 6.229 0.675 5.453 1.00 . A A . 4 TYR OH 1 1 14 7559 1 1 5 VAL C C 0.505 9.474 7.201 1.00 . A A . 5 VAL C 1 1 14 7560 1 1 5 VAL CA C 0.907 9.332 5.732 1.00 . A A . 5 VAL CA 1 1 14 7561 1 1 5 VAL CB C -0.248 9.610 4.767 1.00 . A A . 5 VAL CB 1 1 14 7562 1 1 5 VAL CG1 C -0.943 10.930 5.109 1.00 . A A . 5 VAL CG1 1 1 14 7563 1 1 5 VAL CG2 C 0.236 9.605 3.317 1.00 . A A . 5 VAL CG2 1 1 14 7564 1 1 5 VAL H H 0.745 7.288 5.371 1.00 . A A . 5 VAL H 1 1 14 7565 1 1 5 VAL HA H 1.704 10.044 5.516 1.00 . A A . 5 VAL HA 1 1 14 7566 1 1 5 VAL HB H -0.978 8.808 4.880 1.00 . A A . 5 VAL HB 1 1 14 7567 1 1 5 VAL HG11 H -0.947 11.576 4.231 1.00 . A A . 5 VAL HG11 1 1 14 7568 1 1 5 VAL HG12 H -1.968 10.732 5.419 1.00 . A A . 5 VAL HG12 1 1 14 7569 1 1 5 VAL HG13 H -0.407 11.423 5.919 1.00 . A A . 5 VAL HG13 1 1 14 7570 1 1 5 VAL HG21 H 1.248 9.202 3.273 1.00 . A A . 5 VAL HG21 1 1 14 7571 1 1 5 VAL HG22 H -0.428 8.984 2.714 1.00 . A A . 5 VAL HG22 1 1 14 7572 1 1 5 VAL HG23 H 0.232 10.623 2.928 1.00 . A A . 5 VAL HG23 1 1 14 7573 1 1 5 VAL N N 1.435 7.999 5.504 1.00 . A A . 5 VAL N 1 1 14 7574 1 1 5 VAL O O -0.342 8.728 7.691 1.00 . A A . 5 VAL O 1 1 14 7575 1 1 6 CYS C C -0.662 10.812 9.439 1.00 . A A . 6 CYS C 1 1 14 7576 1 1 6 CYS CA C 0.853 10.680 9.268 1.00 . A A . 6 CYS CA 1 1 14 7577 1 1 6 CYS CB C 1.595 11.914 9.784 1.00 . A A . 6 CYS CB 1 1 14 7578 1 1 6 CYS H H 1.822 11.034 7.459 1.00 . A A . 6 CYS H 1 1 14 7579 1 1 6 CYS HA H 1.231 9.820 9.820 1.00 . A A . 6 CYS HA 1 1 14 7580 1 1 6 CYS HB2 H 2.645 11.832 9.507 1.00 . A A . 6 CYS HB2 1 1 14 7581 1 1 6 CYS HB3 H 1.200 12.797 9.280 1.00 . A A . 6 CYS HB3 1 1 14 7582 1 1 6 CYS N N 1.134 10.434 7.864 1.00 . A A . 6 CYS N 1 1 14 7583 1 1 6 CYS O O -1.358 11.246 8.522 1.00 . A A . 6 CYS O 1 1 14 7584 1 1 6 CYS SG S 1.484 12.176 11.592 1.00 . A A . 6 CYS SG 1 1 14 7585 1 1 7 THR C C -2.828 11.639 11.903 1.00 . A A . 7 THR C 1 1 14 7586 1 1 7 THR CA C -2.548 10.499 10.921 1.00 . A A . 7 THR CA 1 1 14 7587 1 1 7 THR CB C -2.988 9.130 11.439 1.00 . A A . 7 THR CB 1 1 14 7588 1 1 7 THR CG2 C -2.690 8.004 10.446 1.00 . A A . 7 THR CG2 1 1 14 7589 1 1 7 THR H H -0.556 10.078 11.358 1.00 . A A . 7 THR H 1 1 14 7590 1 1 7 THR HA H -3.084 10.730 10.001 1.00 . A A . 7 THR HA 1 1 14 7591 1 1 7 THR HB H -4.044 9.137 11.712 1.00 . A A . 7 THR HB 1 1 14 7592 1 1 7 THR HG1 H -2.231 9.568 13.239 1.00 . A A . 7 THR HG1 1 1 14 7593 1 1 7 THR HG21 H -3.618 7.506 10.170 1.00 . A A . 7 THR HG21 1 1 14 7594 1 1 7 THR HG22 H -2.222 8.421 9.554 1.00 . A A . 7 THR HG22 1 1 14 7595 1 1 7 THR HG23 H -2.013 7.283 10.907 1.00 . A A . 7 THR HG23 1 1 14 7596 1 1 7 THR N N -1.128 10.430 10.618 1.00 . A A . 7 THR N 1 1 14 7597 1 1 7 THR O O -3.850 11.636 12.587 1.00 . A A . 7 THR O 1 1 14 7598 1 1 7 THR OG1 O -2.110 8.872 12.531 1.00 . A A . 7 THR OG1 1 1 14 7599 1 1 8 VAL C C -2.115 15.010 11.991 1.00 . A A . 8 VAL C 1 1 14 7600 1 1 8 VAL CA C -2.038 13.730 12.826 1.00 . A A . 8 VAL CA 1 1 14 7601 1 1 8 VAL CB C -0.893 13.745 13.839 1.00 . A A . 8 VAL CB 1 1 14 7602 1 1 8 VAL CG1 C -0.656 15.157 14.379 1.00 . A A . 8 VAL CG1 1 1 14 7603 1 1 8 VAL CG2 C -1.156 12.758 14.978 1.00 . A A . 8 VAL CG2 1 1 14 7604 1 1 8 VAL H H -1.075 12.582 11.379 1.00 . A A . 8 VAL H 1 1 14 7605 1 1 8 VAL HA H -2.973 13.612 13.375 1.00 . A A . 8 VAL HA 1 1 14 7606 1 1 8 VAL HB H 0.014 13.428 13.324 1.00 . A A . 8 VAL HB 1 1 14 7607 1 1 8 VAL HG11 H -1.607 15.589 14.695 1.00 . A A . 8 VAL HG11 1 1 14 7608 1 1 8 VAL HG12 H 0.022 15.112 15.232 1.00 . A A . 8 VAL HG12 1 1 14 7609 1 1 8 VAL HG13 H -0.217 15.777 13.598 1.00 . A A . 8 VAL HG13 1 1 14 7610 1 1 8 VAL HG21 H -1.307 11.760 14.567 1.00 . A A . 8 VAL HG21 1 1 14 7611 1 1 8 VAL HG22 H -0.299 12.747 15.653 1.00 . A A . 8 VAL HG22 1 1 14 7612 1 1 8 VAL HG23 H -2.046 13.064 15.527 1.00 . A A . 8 VAL HG23 1 1 14 7613 1 1 8 VAL N N -1.904 12.587 11.939 1.00 . A A . 8 VAL N 1 1 14 7614 1 1 8 VAL O O -3.032 15.813 12.161 1.00 . A A . 8 VAL O 1 1 14 7615 1 1 9 CYS C C -1.433 15.894 8.821 1.00 . A A . 9 CYS C 1 1 14 7616 1 1 9 CYS CA C -1.086 16.331 10.245 1.00 . A A . 9 CYS CA 1 1 14 7617 1 1 9 CYS CB C 0.277 17.022 10.315 1.00 . A A . 9 CYS CB 1 1 14 7618 1 1 9 CYS H H -0.398 14.505 10.975 1.00 . A A . 9 CYS H 1 1 14 7619 1 1 9 CYS HA H -1.826 17.035 10.627 1.00 . A A . 9 CYS HA 1 1 14 7620 1 1 9 CYS HB2 H 0.376 17.687 9.457 1.00 . A A . 9 CYS HB2 1 1 14 7621 1 1 9 CYS HB3 H 0.308 17.647 11.208 1.00 . A A . 9 CYS HB3 1 1 14 7622 1 1 9 CYS N N -1.140 15.162 11.107 1.00 . A A . 9 CYS N 1 1 14 7623 1 1 9 CYS O O -1.885 16.704 8.013 1.00 . A A . 9 CYS O 1 1 14 7624 1 1 9 CYS SG S 1.713 15.886 10.346 1.00 . A A . 9 CYS SG 1 1 14 7625 1 1 10 GLY C C -0.259 14.133 6.341 1.00 . A A . 10 GLY C 1 1 14 7626 1 1 10 GLY CA C -1.492 14.062 7.244 1.00 . A A . 10 GLY CA 1 1 14 7627 1 1 10 GLY H H -0.841 13.964 9.220 1.00 . A A . 10 GLY H 1 1 14 7628 1 1 10 GLY HA2 H -1.815 13.026 7.344 1.00 . A A . 10 GLY HA2 1 1 14 7629 1 1 10 GLY HA3 H -2.316 14.610 6.785 1.00 . A A . 10 GLY HA3 1 1 14 7630 1 1 10 GLY N N -1.208 14.616 8.556 1.00 . A A . 10 GLY N 1 1 14 7631 1 1 10 GLY O O -0.338 14.035 5.118 1.00 . A A . 10 GLY O 1 1 14 7632 1 1 11 TYR C C 2.283 13.238 5.293 1.00 . A A . 11 TYR C 1 1 14 7633 1 1 11 TYR CA C 2.158 14.399 6.269 1.00 . A A . 11 TYR CA 1 1 14 7634 1 1 11 TYR CB C 3.309 14.391 7.271 1.00 . A A . 11 TYR CB 1 1 14 7635 1 1 11 TYR CD1 C 4.868 15.534 5.653 1.00 . A A . 11 TYR CD1 1 1 14 7636 1 1 11 TYR CD2 C 5.725 13.720 7.013 1.00 . A A . 11 TYR CD2 1 1 14 7637 1 1 11 TYR CE1 C 6.126 15.683 5.059 1.00 . A A . 11 TYR CE1 1 1 14 7638 1 1 11 TYR CE2 C 6.983 13.869 6.419 1.00 . A A . 11 TYR CE2 1 1 14 7639 1 1 11 TYR CG C 4.667 14.552 6.630 1.00 . A A . 11 TYR CG 1 1 14 7640 1 1 11 TYR CZ C 7.184 14.850 5.441 1.00 . A A . 11 TYR CZ 1 1 14 7641 1 1 11 TYR H H 0.910 14.384 7.988 1.00 . A A . 11 TYR H 1 1 14 7642 1 1 11 TYR HA H 2.183 15.335 5.709 1.00 . A A . 11 TYR HA 1 1 14 7643 1 1 11 TYR HB2 H 3.160 15.204 7.979 1.00 . A A . 11 TYR HB2 1 1 14 7644 1 1 11 TYR HB3 H 3.291 13.446 7.814 1.00 . A A . 11 TYR HB3 1 1 14 7645 1 1 11 TYR HD1 H 4.052 16.177 5.358 1.00 . A A . 11 TYR HD1 1 1 14 7646 1 1 11 TYR HD2 H 5.571 12.961 7.767 1.00 . A A . 11 TYR HD2 1 1 14 7647 1 1 11 TYR HE1 H 6.281 16.441 4.304 1.00 . A A . 11 TYR HE1 1 1 14 7648 1 1 11 TYR HE2 H 7.800 13.226 6.715 1.00 . A A . 11 TYR HE2 1 1 14 7649 1 1 11 TYR HH H 8.387 14.912 3.907 1.00 . A A . 11 TYR HH 1 1 14 7650 1 1 11 TYR N N 0.899 14.309 6.981 1.00 . A A . 11 TYR N 1 1 14 7651 1 1 11 TYR O O 1.583 12.241 5.463 1.00 . A A . 11 TYR O 1 1 14 7652 1 1 11 TYR OH O 8.411 14.996 4.863 1.00 . A A . 11 TYR OH 1 1 14 7653 1 1 12 GLU C C 4.816 11.884 3.309 1.00 . A A . 12 GLU C 1 1 14 7654 1 1 12 GLU CA C 3.353 12.333 3.321 1.00 . A A . 12 GLU CA 1 1 14 7655 1 1 12 GLU CB C 2.910 12.796 1.931 1.00 . A A . 12 GLU CB 1 1 14 7656 1 1 12 GLU CD C 0.803 13.470 0.721 1.00 . A A . 12 GLU CD 1 1 14 7657 1 1 12 GLU CG C 1.436 12.468 1.689 1.00 . A A . 12 GLU CG 1 1 14 7658 1 1 12 GLU H H 3.722 14.197 4.176 1.00 . A A . 12 GLU H 1 1 14 7659 1 1 12 GLU HA H 2.716 11.510 3.644 1.00 . A A . 12 GLU HA 1 1 14 7660 1 1 12 GLU HB2 H 3.069 13.870 1.835 1.00 . A A . 12 GLU HB2 1 1 14 7661 1 1 12 GLU HB3 H 3.524 12.314 1.171 1.00 . A A . 12 GLU HB3 1 1 14 7662 1 1 12 GLU HE2 H 1.051 12.415 -0.819 1.00 . A A . 12 GLU HE2 1 1 14 7663 1 1 12 GLU HG2 H 1.346 11.459 1.283 1.00 . A A . 12 GLU HG2 1 1 14 7664 1 1 12 GLU HG3 H 0.895 12.481 2.636 1.00 . A A . 12 GLU HG3 1 1 14 7665 1 1 12 GLU N N 3.156 13.383 4.307 1.00 . A A . 12 GLU N 1 1 14 7666 1 1 12 GLU O O 5.745 12.687 3.285 1.00 . A A . 12 GLU O 1 1 14 7667 1 1 12 GLU OE1 O 0.764 14.674 1.015 1.00 . A A . 12 GLU OE1 1 1 14 7668 1 1 12 GLU OE2 O 0.342 12.959 -0.370 1.00 . A A . 12 GLU OE2 1 1 14 7669 1 1 13 TYR C C 6.506 9.122 2.075 1.00 . A A . 13 TYR C 1 1 14 7670 1 1 13 TYR CA C 6.325 9.976 3.320 1.00 . A A . 13 TYR CA 1 1 14 7671 1 1 13 TYR CB C 6.516 9.139 4.583 1.00 . A A . 13 TYR CB 1 1 14 7672 1 1 13 TYR CD1 C 7.618 7.063 3.672 1.00 . A A . 13 TYR CD1 1 1 14 7673 1 1 13 TYR CD2 C 8.838 8.429 5.261 1.00 . A A . 13 TYR CD2 1 1 14 7674 1 1 13 TYR CE1 C 8.702 6.181 3.598 1.00 . A A . 13 TYR CE1 1 1 14 7675 1 1 13 TYR CE2 C 9.922 7.547 5.187 1.00 . A A . 13 TYR CE2 1 1 14 7676 1 1 13 TYR CG C 7.685 8.187 4.503 1.00 . A A . 13 TYR CG 1 1 14 7677 1 1 13 TYR CZ C 9.854 6.423 4.356 1.00 . A A . 13 TYR CZ 1 1 14 7678 1 1 13 TYR H H 4.201 9.944 3.347 1.00 . A A . 13 TYR H 1 1 14 7679 1 1 13 TYR HA H 7.066 10.776 3.312 1.00 . A A . 13 TYR HA 1 1 14 7680 1 1 13 TYR HB2 H 6.671 9.811 5.427 1.00 . A A . 13 TYR HB2 1 1 14 7681 1 1 13 TYR HB3 H 5.608 8.561 4.758 1.00 . A A . 13 TYR HB3 1 1 14 7682 1 1 13 TYR HD1 H 6.729 6.876 3.087 1.00 . A A . 13 TYR HD1 1 1 14 7683 1 1 13 TYR HD2 H 8.890 9.296 5.903 1.00 . A A . 13 TYR HD2 1 1 14 7684 1 1 13 TYR HE1 H 8.650 5.313 2.957 1.00 . A A . 13 TYR HE1 1 1 14 7685 1 1 13 TYR HE2 H 10.811 7.733 5.772 1.00 . A A . 13 TYR HE2 1 1 14 7686 1 1 13 TYR HH H 11.163 5.206 5.138 1.00 . A A . 13 TYR HH 1 1 14 7687 1 1 13 TYR N N 5.000 10.562 3.327 1.00 . A A . 13 TYR N 1 1 14 7688 1 1 13 TYR O O 5.521 8.576 1.579 1.00 . A A . 13 TYR O 1 1 14 7689 1 1 13 TYR OH O 10.911 5.563 4.284 1.00 . A A . 13 TYR OH 1 1 14 7690 1 1 14 ASP C C 8.969 7.088 0.780 1.00 . A A . 14 ASP C 1 1 14 7691 1 1 14 ASP CA C 8.020 8.230 0.412 1.00 . A A . 14 ASP CA 1 1 14 7692 1 1 14 ASP CB C 8.697 9.077 -0.668 1.00 . A A . 14 ASP CB 1 1 14 7693 1 1 14 ASP CG C 8.319 8.714 -2.106 1.00 . A A . 14 ASP CG 1 1 14 7694 1 1 14 ASP H H 8.534 9.469 2.006 1.00 . A A . 14 ASP H 1 1 14 7695 1 1 14 ASP HA H 7.048 7.872 0.070 1.00 . A A . 14 ASP HA 1 1 14 7696 1 1 14 ASP HB2 H 8.447 10.124 -0.496 1.00 . A A . 14 ASP HB2 1 1 14 7697 1 1 14 ASP HB3 H 9.777 8.985 -0.558 1.00 . A A . 14 ASP HB3 1 1 14 7698 1 1 14 ASP HD2 H 6.725 8.041 -2.848 1.00 . A A . 14 ASP HD2 1 1 14 7699 1 1 14 ASP N N 7.738 9.022 1.597 1.00 . A A . 14 ASP N 1 1 14 7700 1 1 14 ASP O O 9.876 7.231 1.596 1.00 . A A . 14 ASP O 1 1 14 7701 1 1 14 ASP OD1 O 9.174 8.309 -2.907 1.00 . A A . 14 ASP OD1 1 1 14 7702 1 1 14 ASP OD2 O 7.071 8.863 -2.396 1.00 . A A . 14 ASP OD2 1 1 14 7703 1 1 15 PRO C C 10.782 4.798 -0.485 1.00 . A A . 15 PRO C 1 1 14 7704 1 1 15 PRO CA C 9.508 4.726 0.344 1.00 . A A . 15 PRO CA 1 1 14 7705 1 1 15 PRO CB C 8.600 3.598 -0.142 1.00 . A A . 15 PRO CB 1 1 14 7706 1 1 15 PRO CD C 7.676 5.731 -0.816 1.00 . A A . 15 PRO CD 1 1 14 7707 1 1 15 PRO CG C 7.823 4.279 -1.262 1.00 . A A . 15 PRO CG 1 1 14 7708 1 1 15 PRO HA H 9.758 4.587 1.396 1.00 . A A . 15 PRO HA 1 1 14 7709 1 1 15 PRO HB2 H 9.165 2.758 -0.545 1.00 . A A . 15 PRO HB2 1 1 14 7710 1 1 15 PRO HB3 H 7.960 3.275 0.679 1.00 . A A . 15 PRO HB3 1 1 14 7711 1 1 15 PRO HD2 H 7.771 6.411 -1.663 1.00 . A A . 15 PRO HD2 1 1 14 7712 1 1 15 PRO HD3 H 6.713 5.871 -0.324 1.00 . A A . 15 PRO HD3 1 1 14 7713 1 1 15 PRO HG2 H 8.000 4.250 -2.337 1.00 . A A . 15 PRO HG2 1 1 14 7714 1 1 15 PRO HG3 H 6.954 3.675 -0.998 1.00 . A A . 15 PRO HG3 1 1 14 7715 1 1 15 PRO N N 8.734 5.935 0.150 1.00 . A A . 15 PRO N 1 1 14 7716 1 1 15 PRO O O 10.893 4.066 -1.467 1.00 . A A . 15 PRO O 1 1 14 7717 1 1 16 ALA C C 13.903 6.699 -0.001 1.00 . A A . 16 ALA C 1 1 14 7718 1 1 16 ALA CA C 12.955 5.809 -0.808 1.00 . A A . 16 ALA CA 1 1 14 7719 1 1 16 ALA CB C 12.676 6.370 -2.204 1.00 . A A . 16 ALA CB 1 1 14 7720 1 1 16 ALA H H 11.604 6.254 0.714 1.00 . A A . 16 ALA H 1 1 14 7721 1 1 16 ALA HA H 13.398 4.819 -0.909 1.00 . A A . 16 ALA HA 1 1 14 7722 1 1 16 ALA HB1 H 12.838 7.448 -2.202 1.00 . A A . 16 ALA HB1 1 1 14 7723 1 1 16 ALA HB2 H 13.348 5.904 -2.924 1.00 . A A . 16 ALA HB2 1 1 14 7724 1 1 16 ALA HB3 H 11.643 6.159 -2.481 1.00 . A A . 16 ALA HB3 1 1 14 7725 1 1 16 ALA N N 11.703 5.663 -0.086 1.00 . A A . 16 ALA N 1 1 14 7726 1 1 16 ALA O O 14.182 7.831 -0.393 1.00 . A A . 16 ALA O 1 1 14 7727 1 1 17 PHE C C 16.408 5.975 2.478 1.00 . A A . 17 PHE C 1 1 14 7728 1 1 17 PHE CA C 15.283 6.883 1.977 1.00 . A A . 17 PHE CA 1 1 14 7729 1 1 17 PHE CB C 14.466 7.373 3.174 1.00 . A A . 17 PHE CB 1 1 14 7730 1 1 17 PHE CD1 C 12.554 8.689 2.236 1.00 . A A . 17 PHE CD1 1 1 14 7731 1 1 17 PHE CD2 C 14.238 9.856 3.398 1.00 . A A . 17 PHE CD2 1 1 14 7732 1 1 17 PHE CE1 C 11.867 9.910 2.005 1.00 . A A . 17 PHE CE1 1 1 14 7733 1 1 17 PHE CE2 C 13.550 11.077 3.169 1.00 . A A . 17 PHE CE2 1 1 14 7734 1 1 17 PHE CG C 13.726 8.688 2.927 1.00 . A A . 17 PHE CG 1 1 14 7735 1 1 17 PHE CZ C 12.380 11.079 2.477 1.00 . A A . 17 PHE CZ 1 1 14 7736 1 1 17 PHE H H 14.139 5.232 1.424 1.00 . A A . 17 PHE H 1 1 14 7737 1 1 17 PHE HA H 15.709 7.695 1.387 1.00 . A A . 17 PHE HA 1 1 14 7738 1 1 17 PHE HB2 H 13.742 6.604 3.446 1.00 . A A . 17 PHE HB2 1 1 14 7739 1 1 17 PHE HB3 H 15.132 7.498 4.028 1.00 . A A . 17 PHE HB3 1 1 14 7740 1 1 17 PHE HD1 H 12.144 7.753 1.857 1.00 . A A . 17 PHE HD1 1 1 14 7741 1 1 17 PHE HD2 H 15.177 9.855 3.953 1.00 . A A . 17 PHE HD2 1 1 14 7742 1 1 17 PHE HE1 H 10.929 9.912 1.450 1.00 . A A . 17 PHE HE1 1 1 14 7743 1 1 17 PHE HE2 H 13.961 12.013 3.546 1.00 . A A . 17 PHE HE2 1 1 14 7744 1 1 17 PHE HZ H 11.852 12.016 2.300 1.00 . A A . 17 PHE HZ 1 1 14 7745 1 1 17 PHE N N 14.372 6.153 1.111 1.00 . A A . 17 PHE N 1 1 14 7746 1 1 17 PHE O O 16.341 4.757 2.326 1.00 . A A . 17 PHE O 1 1 14 7747 1 1 18 GLU C C 18.898 6.360 4.999 1.00 . A A . 18 GLU C 1 1 14 7748 1 1 18 GLU CA C 18.553 5.869 3.592 1.00 . A A . 18 GLU CA 1 1 14 7749 1 1 18 GLU CB C 19.759 5.988 2.658 1.00 . A A . 18 GLU CB 1 1 14 7750 1 1 18 GLU CD C 21.116 4.588 1.058 1.00 . A A . 18 GLU CD 1 1 14 7751 1 1 18 GLU CG C 20.394 4.617 2.407 1.00 . A A . 18 GLU CG 1 1 14 7752 1 1 18 GLU H H 17.461 7.596 3.187 1.00 . A A . 18 GLU H 1 1 14 7753 1 1 18 GLU HA H 18.232 4.828 3.631 1.00 . A A . 18 GLU HA 1 1 14 7754 1 1 18 GLU HB2 H 19.449 6.427 1.710 1.00 . A A . 18 GLU HB2 1 1 14 7755 1 1 18 GLU HB3 H 20.497 6.659 3.095 1.00 . A A . 18 GLU HB3 1 1 14 7756 1 1 18 GLU HE2 H 19.920 3.326 0.334 1.00 . A A . 18 GLU HE2 1 1 14 7757 1 1 18 GLU HG2 H 21.099 4.388 3.206 1.00 . A A . 18 GLU HG2 1 1 14 7758 1 1 18 GLU HG3 H 19.625 3.847 2.430 1.00 . A A . 18 GLU HG3 1 1 14 7759 1 1 18 GLU N N 17.414 6.605 3.066 1.00 . A A . 18 GLU N 1 1 14 7760 1 1 18 GLU O O 20.026 6.778 5.255 1.00 . A A . 18 GLU O 1 1 14 7761 1 1 18 GLU OE1 O 22.298 4.957 0.979 1.00 . A A . 18 GLU OE1 1 1 14 7762 1 1 18 GLU OE2 O 20.406 4.160 0.070 1.00 . A A . 18 GLU OE2 1 1 14 7763 1 1 19 ASP C C 16.750 6.662 7.983 1.00 . A A . 19 ASP C 1 1 14 7764 1 1 19 ASP CA C 18.091 6.722 7.250 1.00 . A A . 19 ASP CA 1 1 14 7765 1 1 19 ASP CB C 18.598 8.165 7.311 1.00 . A A . 19 ASP CB 1 1 14 7766 1 1 19 ASP CG C 19.692 8.422 8.350 1.00 . A A . 19 ASP CG 1 1 14 7767 1 1 19 ASP H H 16.992 5.949 5.658 1.00 . A A . 19 ASP H 1 1 14 7768 1 1 19 ASP HA H 18.826 6.036 7.669 1.00 . A A . 19 ASP HA 1 1 14 7769 1 1 19 ASP HB2 H 18.980 8.442 6.328 1.00 . A A . 19 ASP HB2 1 1 14 7770 1 1 19 ASP HB3 H 17.755 8.822 7.523 1.00 . A A . 19 ASP HB3 1 1 14 7771 1 1 19 ASP HD2 H 19.091 7.599 9.934 1.00 . A A . 19 ASP HD2 1 1 14 7772 1 1 19 ASP N N 17.906 6.291 5.875 1.00 . A A . 19 ASP N 1 1 14 7773 1 1 19 ASP O O 15.968 7.610 7.934 1.00 . A A . 19 ASP O 1 1 14 7774 1 1 19 ASP OD1 O 20.880 8.531 8.013 1.00 . A A . 19 ASP OD1 1 1 14 7775 1 1 19 ASP OD2 O 19.276 8.511 9.568 1.00 . A A . 19 ASP OD2 1 1 14 7776 1 1 20 LEU C C 15.626 4.913 10.821 1.00 . A A . 20 LEU C 1 1 14 7777 1 1 20 LEU CA C 15.291 5.341 9.390 1.00 . A A . 20 LEU CA 1 1 14 7778 1 1 20 LEU CB C 14.373 4.363 8.655 1.00 . A A . 20 LEU CB 1 1 14 7779 1 1 20 LEU CD1 C 12.649 5.982 7.780 1.00 . A A . 20 LEU CD1 1 1 14 7780 1 1 20 LEU CD2 C 12.040 3.547 8.152 1.00 . A A . 20 LEU CD2 1 1 14 7781 1 1 20 LEU CG C 12.888 4.730 8.626 1.00 . A A . 20 LEU CG 1 1 14 7782 1 1 20 LEU H H 17.166 4.771 8.683 1.00 . A A . 20 LEU H 1 1 14 7783 1 1 20 LEU HA H 14.776 6.300 9.428 1.00 . A A . 20 LEU HA 1 1 14 7784 1 1 20 LEU HB2 H 14.724 4.269 7.628 1.00 . A A . 20 LEU HB2 1 1 14 7785 1 1 20 LEU HB3 H 14.476 3.381 9.117 1.00 . A A . 20 LEU HB3 1 1 14 7786 1 1 20 LEU HD11 H 12.532 6.846 8.435 1.00 . A A . 20 LEU HD11 1 1 14 7787 1 1 20 LEU HD12 H 13.500 6.141 7.117 1.00 . A A . 20 LEU HD12 1 1 14 7788 1 1 20 LEU HD13 H 11.744 5.852 7.187 1.00 . A A . 20 LEU HD13 1 1 14 7789 1 1 20 LEU HD21 H 11.628 3.026 9.016 1.00 . A A . 20 LEU HD21 1 1 14 7790 1 1 20 LEU HD22 H 11.226 3.912 7.526 1.00 . A A . 20 LEU HD22 1 1 14 7791 1 1 20 LEU HD23 H 12.662 2.862 7.577 1.00 . A A . 20 LEU HD23 1 1 14 7792 1 1 20 LEU HG H 12.575 4.964 9.644 1.00 . A A . 20 LEU HG 1 1 14 7793 1 1 20 LEU N N 16.525 5.538 8.648 1.00 . A A . 20 LEU N 1 1 14 7794 1 1 20 LEU O O 15.595 3.736 11.174 1.00 . A A . 20 LEU O 1 1 14 7795 1 1 21 PRO C C 15.092 5.218 13.808 1.00 . A A . 21 PRO C 1 1 14 7796 1 1 21 PRO CA C 16.300 5.736 13.039 1.00 . A A . 21 PRO CA 1 1 14 7797 1 1 21 PRO CB C 16.699 7.129 13.522 1.00 . A A . 21 PRO CB 1 1 14 7798 1 1 21 PRO CD C 15.997 7.305 11.265 1.00 . A A . 21 PRO CD 1 1 14 7799 1 1 21 PRO CG C 16.993 7.946 12.228 1.00 . A A . 21 PRO CG 1 1 14 7800 1 1 21 PRO HA H 17.133 5.042 13.151 1.00 . A A . 21 PRO HA 1 1 14 7801 1 1 21 PRO HB2 H 15.914 7.603 14.110 1.00 . A A . 21 PRO HB2 1 1 14 7802 1 1 21 PRO HB3 H 17.623 7.058 14.096 1.00 . A A . 21 PRO HB3 1 1 14 7803 1 1 21 PRO HD2 H 15.018 7.777 11.346 1.00 . A A . 21 PRO HD2 1 1 14 7804 1 1 21 PRO HD3 H 16.370 7.383 10.243 1.00 . A A . 21 PRO HD3 1 1 14 7805 1 1 21 PRO HG2 H 16.720 8.989 12.386 1.00 . A A . 21 PRO HG2 1 1 14 7806 1 1 21 PRO HG3 H 18.021 7.865 11.877 1.00 . A A . 21 PRO HG3 1 1 14 7807 1 1 21 PRO N N 15.951 5.910 11.647 1.00 . A A . 21 PRO N 1 1 14 7808 1 1 21 PRO O O 14.027 5.072 13.210 1.00 . A A . 21 PRO O 1 1 14 7809 1 1 22 ASP C C 13.651 5.588 16.792 1.00 . A A . 22 ASP C 1 1 14 7810 1 1 22 ASP CA C 14.186 4.453 15.916 1.00 . A A . 22 ASP CA 1 1 14 7811 1 1 22 ASP CB C 14.664 3.330 16.838 1.00 . A A . 22 ASP CB 1 1 14 7812 1 1 22 ASP CG C 16.015 3.577 17.512 1.00 . A A . 22 ASP CG 1 1 14 7813 1 1 22 ASP H H 16.144 5.075 15.571 1.00 . A A . 22 ASP H 1 1 14 7814 1 1 22 ASP HA H 13.441 4.084 15.211 1.00 . A A . 22 ASP HA 1 1 14 7815 1 1 22 ASP HB2 H 13.913 3.170 17.612 1.00 . A A . 22 ASP HB2 1 1 14 7816 1 1 22 ASP HB3 H 14.726 2.408 16.260 1.00 . A A . 22 ASP HB3 1 1 14 7817 1 1 22 ASP HD2 H 15.328 4.134 19.174 1.00 . A A . 22 ASP HD2 1 1 14 7818 1 1 22 ASP N N 15.274 4.954 15.093 1.00 . A A . 22 ASP N 1 1 14 7819 1 1 22 ASP O O 13.369 5.387 17.972 1.00 . A A . 22 ASP O 1 1 14 7820 1 1 22 ASP OD1 O 17.026 3.831 16.840 1.00 . A A . 22 ASP OD1 1 1 14 7821 1 1 22 ASP OD2 O 16.005 3.499 18.799 1.00 . A A . 22 ASP OD2 1 1 14 7822 1 1 23 ASP C C 12.754 9.046 15.885 1.00 . A A . 23 ASP C 1 1 14 7823 1 1 23 ASP CA C 13.032 7.924 16.889 1.00 . A A . 23 ASP CA 1 1 14 7824 1 1 23 ASP CB C 14.063 8.436 17.896 1.00 . A A . 23 ASP CB 1 1 14 7825 1 1 23 ASP CG C 15.517 8.368 17.424 1.00 . A A . 23 ASP CG 1 1 14 7826 1 1 23 ASP H H 13.760 6.912 15.219 1.00 . A A . 23 ASP H 1 1 14 7827 1 1 23 ASP HA H 12.129 7.587 17.399 1.00 . A A . 23 ASP HA 1 1 14 7828 1 1 23 ASP HB2 H 13.825 9.471 18.142 1.00 . A A . 23 ASP HB2 1 1 14 7829 1 1 23 ASP HB3 H 13.969 7.859 18.816 1.00 . A A . 23 ASP HB3 1 1 14 7830 1 1 23 ASP HD2 H 15.775 6.634 18.111 1.00 . A A . 23 ASP HD2 1 1 14 7831 1 1 23 ASP N N 13.528 6.757 16.180 1.00 . A A . 23 ASP N 1 1 14 7832 1 1 23 ASP O O 13.204 10.175 16.070 1.00 . A A . 23 ASP O 1 1 14 7833 1 1 23 ASP OD1 O 15.927 9.098 16.508 1.00 . A A . 23 ASP OD1 1 1 14 7834 1 1 23 ASP OD2 O 16.253 7.510 18.045 1.00 . A A . 23 ASP OD2 1 1 14 7835 1 1 24 TRP C C 10.348 10.320 14.204 1.00 . A A . 24 TRP C 1 1 14 7836 1 1 24 TRP CA C 11.670 9.656 13.811 1.00 . A A . 24 TRP CA 1 1 14 7837 1 1 24 TRP CB C 11.619 8.990 12.435 1.00 . A A . 24 TRP CB 1 1 14 7838 1 1 24 TRP CD1 C 12.681 10.885 11.043 1.00 . A A . 24 TRP CD1 1 1 14 7839 1 1 24 TRP CD2 C 10.814 10.089 10.156 1.00 . A A . 24 TRP CD2 1 1 14 7840 1 1 24 TRP CE2 C 11.275 11.088 9.321 1.00 . A A . 24 TRP CE2 1 1 14 7841 1 1 24 TRP CE3 C 9.635 9.380 9.868 1.00 . A A . 24 TRP CE3 1 1 14 7842 1 1 24 TRP CG C 11.730 9.968 11.265 1.00 . A A . 24 TRP CG 1 1 14 7843 1 1 24 TRP CH2 C 9.442 10.773 7.837 1.00 . A A . 24 TRP CH2 1 1 14 7844 1 1 24 TRP CZ2 C 10.619 11.467 8.144 1.00 . A A . 24 TRP CZ2 1 1 14 7845 1 1 24 TRP CZ3 C 8.991 9.771 8.688 1.00 . A A . 24 TRP CZ3 1 1 14 7846 1 1 24 TRP H H 11.651 7.773 14.701 1.00 . A A . 24 TRP H 1 1 14 7847 1 1 24 TRP HA H 12.464 10.401 13.774 1.00 . A A . 24 TRP HA 1 1 14 7848 1 1 24 TRP HB2 H 12.427 8.262 12.365 1.00 . A A . 24 TRP HB2 1 1 14 7849 1 1 24 TRP HB3 H 10.684 8.436 12.346 1.00 . A A . 24 TRP HB3 1 1 14 7850 1 1 24 TRP HD1 H 13.533 11.057 11.702 1.00 . A A . 24 TRP HD1 1 1 14 7851 1 1 24 TRP HE1 H 13.066 12.386 9.471 1.00 . A A . 24 TRP HE1 1 1 14 7852 1 1 24 TRP HE3 H 9.250 8.588 10.510 1.00 . A A . 24 TRP HE3 1 1 14 7853 1 1 24 TRP HH2 H 8.882 11.019 6.935 1.00 . A A . 24 TRP HH2 1 1 14 7854 1 1 24 TRP HZ2 H 11.004 12.259 7.502 1.00 . A A . 24 TRP HZ2 1 1 14 7855 1 1 24 TRP HZ3 H 8.072 9.252 8.417 1.00 . A A . 24 TRP HZ3 1 1 14 7856 1 1 24 TRP N N 12.014 8.694 14.844 1.00 . A A . 24 TRP N 1 1 14 7857 1 1 24 TRP NE1 N 12.447 11.587 9.879 1.00 . A A . 24 TRP NE1 1 1 14 7858 1 1 24 TRP O O 9.431 9.651 14.676 1.00 . A A . 24 TRP O 1 1 14 7859 1 1 25 ALA C C 8.672 13.204 13.100 1.00 . A A . 25 ALA C 1 1 14 7860 1 1 25 ALA CA C 9.100 12.388 14.320 1.00 . A A . 25 ALA CA 1 1 14 7861 1 1 25 ALA CB C 9.372 13.267 15.543 1.00 . A A . 25 ALA CB 1 1 14 7862 1 1 25 ALA H H 11.046 12.163 13.611 1.00 . A A . 25 ALA H 1 1 14 7863 1 1 25 ALA HA H 8.312 11.678 14.567 1.00 . A A . 25 ALA HA 1 1 14 7864 1 1 25 ALA HB1 H 9.081 14.294 15.324 1.00 . A A . 25 ALA HB1 1 1 14 7865 1 1 25 ALA HB2 H 8.796 12.899 16.391 1.00 . A A . 25 ALA HB2 1 1 14 7866 1 1 25 ALA HB3 H 10.435 13.234 15.784 1.00 . A A . 25 ALA HB3 1 1 14 7867 1 1 25 ALA N N 10.294 11.627 13.994 1.00 . A A . 25 ALA N 1 1 14 7868 1 1 25 ALA O O 9.506 13.809 12.427 1.00 . A A . 25 ALA O 1 1 14 7869 1 1 26 CYS C C 7.503 15.295 11.657 1.00 . A A . 26 CYS C 1 1 14 7870 1 1 26 CYS CA C 6.821 13.927 11.719 1.00 . A A . 26 CYS CA 1 1 14 7871 1 1 26 CYS CB C 5.299 14.052 11.814 1.00 . A A . 26 CYS CB 1 1 14 7872 1 1 26 CYS H H 6.698 12.701 13.399 1.00 . A A . 26 CYS H 1 1 14 7873 1 1 26 CYS HA H 7.045 13.342 10.828 1.00 . A A . 26 CYS HA 1 1 14 7874 1 1 26 CYS HB2 H 4.937 13.356 12.570 1.00 . A A . 26 CYS HB2 1 1 14 7875 1 1 26 CYS HB3 H 5.052 15.055 12.159 1.00 . A A . 26 CYS HB3 1 1 14 7876 1 1 26 CYS N N 7.371 13.195 12.848 1.00 . A A . 26 CYS N 1 1 14 7877 1 1 26 CYS O O 7.702 15.972 12.663 1.00 . A A . 26 CYS O 1 1 14 7878 1 1 26 CYS SG S 4.406 13.733 10.248 1.00 . A A . 26 CYS SG 1 1 14 7879 1 1 27 PRO C C 7.543 18.096 10.370 1.00 . A A . 27 PRO C 1 1 14 7880 1 1 27 PRO CA C 8.516 16.948 10.141 1.00 . A A . 27 PRO CA 1 1 14 7881 1 1 27 PRO CB C 8.912 16.851 8.670 1.00 . A A . 27 PRO CB 1 1 14 7882 1 1 27 PRO CD C 7.643 14.920 9.228 1.00 . A A . 27 PRO CD 1 1 14 7883 1 1 27 PRO CG C 7.777 15.926 8.087 1.00 . A A . 27 PRO CG 1 1 14 7884 1 1 27 PRO HA H 9.400 17.083 10.765 1.00 . A A . 27 PRO HA 1 1 14 7885 1 1 27 PRO HB2 H 8.907 17.822 8.174 1.00 . A A . 27 PRO HB2 1 1 14 7886 1 1 27 PRO HB3 H 9.895 16.384 8.593 1.00 . A A . 27 PRO HB3 1 1 14 7887 1 1 27 PRO HD2 H 6.655 14.456 9.223 1.00 . A A . 27 PRO HD2 1 1 14 7888 1 1 27 PRO HD3 H 8.419 14.160 9.145 1.00 . A A . 27 PRO HD3 1 1 14 7889 1 1 27 PRO HG2 H 6.797 16.096 7.641 1.00 . A A . 27 PRO HG2 1 1 14 7890 1 1 27 PRO HG3 H 8.493 15.602 7.332 1.00 . A A . 27 PRO HG3 1 1 14 7891 1 1 27 PRO N N 7.861 15.692 10.432 1.00 . A A . 27 PRO N 1 1 14 7892 1 1 27 PRO O O 7.952 19.251 10.264 1.00 . A A . 27 PRO O 1 1 14 7893 1 1 28 VAL C C 4.863 18.747 12.376 1.00 . A A . 28 VAL C 1 1 14 7894 1 1 28 VAL CA C 5.288 18.786 10.907 1.00 . A A . 28 VAL CA 1 1 14 7895 1 1 28 VAL CB C 4.118 18.599 9.940 1.00 . A A . 28 VAL CB 1 1 14 7896 1 1 28 VAL CG1 C 3.069 19.696 10.129 1.00 . A A . 28 VAL CG1 1 1 14 7897 1 1 28 VAL CG2 C 4.605 18.551 8.491 1.00 . A A . 28 VAL CG2 1 1 14 7898 1 1 28 VAL H H 5.971 16.825 10.756 1.00 . A A . 28 VAL H 1 1 14 7899 1 1 28 VAL HA H 5.746 19.754 10.699 1.00 . A A . 28 VAL HA 1 1 14 7900 1 1 28 VAL HB H 3.647 17.642 10.166 1.00 . A A . 28 VAL HB 1 1 14 7901 1 1 28 VAL HG11 H 2.328 19.369 10.860 1.00 . A A . 28 VAL HG11 1 1 14 7902 1 1 28 VAL HG12 H 3.554 20.605 10.485 1.00 . A A . 28 VAL HG12 1 1 14 7903 1 1 28 VAL HG13 H 2.576 19.896 9.178 1.00 . A A . 28 VAL HG13 1 1 14 7904 1 1 28 VAL HG21 H 5.695 18.587 8.473 1.00 . A A . 28 VAL HG21 1 1 14 7905 1 1 28 VAL HG22 H 4.265 17.627 8.023 1.00 . A A . 28 VAL HG22 1 1 14 7906 1 1 28 VAL HG23 H 4.204 19.404 7.944 1.00 . A A . 28 VAL HG23 1 1 14 7907 1 1 28 VAL N N 6.296 17.767 10.671 1.00 . A A . 28 VAL N 1 1 14 7908 1 1 28 VAL O O 5.488 19.381 13.224 1.00 . A A . 28 VAL O 1 1 14 7909 1 1 29 CYS C C 4.467 17.652 14.930 1.00 . A A . 29 CYS C 1 1 14 7910 1 1 29 CYS CA C 3.285 17.866 13.983 1.00 . A A . 29 CYS CA 1 1 14 7911 1 1 29 CYS CB C 2.257 16.737 14.089 1.00 . A A . 29 CYS CB 1 1 14 7912 1 1 29 CYS H H 3.298 17.484 11.935 1.00 . A A . 29 CYS H 1 1 14 7913 1 1 29 CYS HA H 2.768 18.798 14.212 1.00 . A A . 29 CYS HA 1 1 14 7914 1 1 29 CYS HB2 H 1.926 16.662 15.126 1.00 . A A . 29 CYS HB2 1 1 14 7915 1 1 29 CYS HB3 H 1.384 17.003 13.494 1.00 . A A . 29 CYS HB3 1 1 14 7916 1 1 29 CYS N N 3.801 17.996 12.631 1.00 . A A . 29 CYS N 1 1 14 7917 1 1 29 CYS O O 4.598 18.354 15.933 1.00 . A A . 29 CYS O 1 1 14 7918 1 1 29 CYS SG S 2.860 15.097 13.547 1.00 . A A . 29 CYS SG 1 1 14 7919 1 1 30 GLY C C 6.274 15.048 16.137 1.00 . A A . 30 GLY C 1 1 14 7920 1 1 30 GLY CA C 6.465 16.368 15.386 1.00 . A A . 30 GLY CA 1 1 14 7921 1 1 30 GLY H H 5.184 16.117 13.763 1.00 . A A . 30 GLY H 1 1 14 7922 1 1 30 GLY HA2 H 7.346 16.303 14.749 1.00 . A A . 30 GLY HA2 1 1 14 7923 1 1 30 GLY HA3 H 6.646 17.173 16.099 1.00 . A A . 30 GLY HA3 1 1 14 7924 1 1 30 GLY N N 5.297 16.682 14.581 1.00 . A A . 30 GLY N 1 1 14 7925 1 1 30 GLY O O 7.224 14.506 16.700 1.00 . A A . 30 GLY O 1 1 14 7926 1 1 31 ALA C C 5.682 12.231 16.337 1.00 . A A . 31 ALA C 1 1 14 7927 1 1 31 ALA CA C 4.710 13.322 16.792 1.00 . A A . 31 ALA CA 1 1 14 7928 1 1 31 ALA CB C 3.252 12.959 16.510 1.00 . A A . 31 ALA CB 1 1 14 7929 1 1 31 ALA H H 4.271 15.016 15.660 1.00 . A A . 31 ALA H 1 1 14 7930 1 1 31 ALA HA H 4.832 13.481 17.863 1.00 . A A . 31 ALA HA 1 1 14 7931 1 1 31 ALA HB1 H 2.698 12.924 17.449 1.00 . A A . 31 ALA HB1 1 1 14 7932 1 1 31 ALA HB2 H 2.809 13.711 15.856 1.00 . A A . 31 ALA HB2 1 1 14 7933 1 1 31 ALA HB3 H 3.207 11.984 16.026 1.00 . A A . 31 ALA HB3 1 1 14 7934 1 1 31 ALA N N 5.038 14.568 16.120 1.00 . A A . 31 ALA N 1 1 14 7935 1 1 31 ALA O O 6.373 12.391 15.331 1.00 . A A . 31 ALA O 1 1 14 7936 1 1 32 SER C C 6.028 9.255 15.586 1.00 . A A . 32 SER C 1 1 14 7937 1 1 32 SER CA C 6.578 10.030 16.785 1.00 . A A . 32 SER CA 1 1 14 7938 1 1 32 SER CB C 6.737 9.101 17.989 1.00 . A A . 32 SER CB 1 1 14 7939 1 1 32 SER H H 5.138 11.026 17.913 1.00 . A A . 32 SER H 1 1 14 7940 1 1 32 SER HA H 7.542 10.478 16.541 1.00 . A A . 32 SER HA 1 1 14 7941 1 1 32 SER HB2 H 7.461 8.321 17.752 1.00 . A A . 32 SER HB2 1 1 14 7942 1 1 32 SER HB3 H 7.140 9.665 18.830 1.00 . A A . 32 SER HB3 1 1 14 7943 1 1 32 SER HG H 5.645 7.878 19.137 1.00 . A A . 32 SER HG 1 1 14 7944 1 1 32 SER N N 5.703 11.147 17.097 1.00 . A A . 32 SER N 1 1 14 7945 1 1 32 SER O O 4.944 9.559 15.089 1.00 . A A . 32 SER O 1 1 14 7946 1 1 32 SER OG O 5.502 8.502 18.369 1.00 . A A . 32 SER OG 1 1 14 7947 1 1 33 LYS C C 5.485 6.325 14.510 1.00 . A A . 33 LYS C 1 1 14 7948 1 1 33 LYS CA C 6.404 7.447 14.023 1.00 . A A . 33 LYS CA 1 1 14 7949 1 1 33 LYS CB C 7.635 6.947 13.266 1.00 . A A . 33 LYS CB 1 1 14 7950 1 1 33 LYS CD C 9.688 6.400 14.626 1.00 . A A . 33 LYS CD 1 1 14 7951 1 1 33 LYS CE C 9.832 6.055 16.108 1.00 . A A . 33 LYS CE 1 1 14 7952 1 1 33 LYS CG C 8.369 5.867 14.064 1.00 . A A . 33 LYS CG 1 1 14 7953 1 1 33 LYS H H 7.680 8.026 15.564 1.00 . A A . 33 LYS H 1 1 14 7954 1 1 33 LYS HA H 5.841 8.083 13.339 1.00 . A A . 33 LYS HA 1 1 14 7955 1 1 33 LYS HB2 H 7.335 6.549 12.298 1.00 . A A . 33 LYS HB2 1 1 14 7956 1 1 33 LYS HB3 H 8.310 7.781 13.072 1.00 . A A . 33 LYS HB3 1 1 14 7957 1 1 33 LYS HD2 H 10.523 5.976 14.068 1.00 . A A . 33 LYS HD2 1 1 14 7958 1 1 33 LYS HD3 H 9.733 7.481 14.494 1.00 . A A . 33 LYS HD3 1 1 14 7959 1 1 33 LYS HE2 H 10.434 6.814 16.609 1.00 . A A . 33 LYS HE2 1 1 14 7960 1 1 33 LYS HE3 H 8.852 6.059 16.587 1.00 . A A . 33 LYS HE3 1 1 14 7961 1 1 33 LYS HG2 H 7.735 5.520 14.881 1.00 . A A . 33 LYS HG2 1 1 14 7962 1 1 33 LYS HG3 H 8.563 5.006 13.424 1.00 . A A . 33 LYS HG3 1 1 14 7963 1 1 33 LYS HZ1 H 10.342 4.144 15.451 1.00 . A A . 33 LYS HZ1 1 1 14 7964 1 1 33 LYS HZ2 H 11.462 4.798 16.437 1.00 . A A . 33 LYS HZ2 1 1 14 7965 1 1 33 LYS N N 6.800 8.268 15.155 1.00 . A A . 33 LYS N 1 1 14 7966 1 1 33 LYS NZ N 10.464 4.726 16.272 1.00 . A A . 33 LYS NZ 1 1 14 7967 1 1 33 LYS O O 5.689 5.160 14.174 1.00 . A A . 33 LYS O 1 1 14 7968 1 1 34 ASP C C 2.161 6.019 15.224 1.00 . A A . 34 ASP C 1 1 14 7969 1 1 34 ASP CA C 3.540 5.757 15.833 1.00 . A A . 34 ASP CA 1 1 14 7970 1 1 34 ASP CB C 3.421 5.891 17.352 1.00 . A A . 34 ASP CB 1 1 14 7971 1 1 34 ASP CG C 2.493 4.875 18.019 1.00 . A A . 34 ASP CG 1 1 14 7972 1 1 34 ASP H H 4.332 7.666 15.565 1.00 . A A . 34 ASP H 1 1 14 7973 1 1 34 ASP HA H 3.936 4.778 15.561 1.00 . A A . 34 ASP HA 1 1 14 7974 1 1 34 ASP HB2 H 4.415 5.795 17.788 1.00 . A A . 34 ASP HB2 1 1 14 7975 1 1 34 ASP HB3 H 3.065 6.895 17.586 1.00 . A A . 34 ASP HB3 1 1 14 7976 1 1 34 ASP HD2 H 1.811 4.285 19.673 1.00 . A A . 34 ASP HD2 1 1 14 7977 1 1 34 ASP N N 4.491 6.716 15.296 1.00 . A A . 34 ASP N 1 1 14 7978 1 1 34 ASP O O 1.387 5.089 15.006 1.00 . A A . 34 ASP O 1 1 14 7979 1 1 34 ASP OD1 O 1.999 3.938 17.372 1.00 . A A . 34 ASP OD1 1 1 14 7980 1 1 34 ASP OD2 O 2.279 5.074 19.276 1.00 . A A . 34 ASP OD2 1 1 14 7981 1 1 35 ALA C C 0.732 7.672 12.866 1.00 . A A . 35 ALA C 1 1 14 7982 1 1 35 ALA CA C 0.621 7.689 14.392 1.00 . A A . 35 ALA CA 1 1 14 7983 1 1 35 ALA CB C 0.221 9.063 14.932 1.00 . A A . 35 ALA CB 1 1 14 7984 1 1 35 ALA H H 2.528 8.044 15.150 1.00 . A A . 35 ALA H 1 1 14 7985 1 1 35 ALA HA H -0.126 6.959 14.702 1.00 . A A . 35 ALA HA 1 1 14 7986 1 1 35 ALA HB1 H 0.862 9.323 15.774 1.00 . A A . 35 ALA HB1 1 1 14 7987 1 1 35 ALA HB2 H 0.334 9.810 14.146 1.00 . A A . 35 ALA HB2 1 1 14 7988 1 1 35 ALA HB3 H -0.817 9.035 15.262 1.00 . A A . 35 ALA HB3 1 1 14 7989 1 1 35 ALA N N 1.894 7.292 14.969 1.00 . A A . 35 ALA N 1 1 14 7990 1 1 35 ALA O O 0.235 8.575 12.194 1.00 . A A . 35 ALA O 1 1 14 7991 1 1 36 PHE C C 0.948 5.182 10.428 1.00 . A A . 36 PHE C 1 1 14 7992 1 1 36 PHE CA C 1.566 6.489 10.928 1.00 . A A . 36 PHE CA 1 1 14 7993 1 1 36 PHE CB C 3.075 6.458 10.670 1.00 . A A . 36 PHE CB 1 1 14 7994 1 1 36 PHE CD1 C 3.506 8.793 11.464 1.00 . A A . 36 PHE CD1 1 1 14 7995 1 1 36 PHE CD2 C 4.470 8.122 9.423 1.00 . A A . 36 PHE CD2 1 1 14 7996 1 1 36 PHE CE1 C 4.094 10.078 11.319 1.00 . A A . 36 PHE CE1 1 1 14 7997 1 1 36 PHE CE2 C 5.058 9.407 9.277 1.00 . A A . 36 PHE CE2 1 1 14 7998 1 1 36 PHE CG C 3.707 7.843 10.513 1.00 . A A . 36 PHE CG 1 1 14 7999 1 1 36 PHE CZ C 4.857 10.357 10.228 1.00 . A A . 36 PHE CZ 1 1 14 8000 1 1 36 PHE H H 1.786 5.905 12.916 1.00 . A A . 36 PHE H 1 1 14 8001 1 1 36 PHE HA H 1.067 7.332 10.451 1.00 . A A . 36 PHE HA 1 1 14 8002 1 1 36 PHE HB2 H 3.564 5.937 11.493 1.00 . A A . 36 PHE HB2 1 1 14 8003 1 1 36 PHE HB3 H 3.266 5.879 9.766 1.00 . A A . 36 PHE HB3 1 1 14 8004 1 1 36 PHE HD1 H 2.895 8.570 12.338 1.00 . A A . 36 PHE HD1 1 1 14 8005 1 1 36 PHE HD2 H 4.631 7.359 8.660 1.00 . A A . 36 PHE HD2 1 1 14 8006 1 1 36 PHE HE1 H 3.933 10.841 12.082 1.00 . A A . 36 PHE HE1 1 1 14 8007 1 1 36 PHE HE2 H 5.669 9.630 8.403 1.00 . A A . 36 PHE HE2 1 1 14 8008 1 1 36 PHE HZ H 5.308 11.344 10.117 1.00 . A A . 36 PHE HZ 1 1 14 8009 1 1 36 PHE N N 1.385 6.635 12.362 1.00 . A A . 36 PHE N 1 1 14 8010 1 1 36 PHE O O 1.069 4.145 11.078 1.00 . A A . 36 PHE O 1 1 14 8011 1 1 37 GLU C C -0.660 4.379 7.209 1.00 . A A . 37 GLU C 1 1 14 8012 1 1 37 GLU CA C -0.338 4.113 8.681 1.00 . A A . 37 GLU CA 1 1 14 8013 1 1 37 GLU CB C -1.599 3.722 9.456 1.00 . A A . 37 GLU CB 1 1 14 8014 1 1 37 GLU CD C -2.469 1.728 10.732 1.00 . A A . 37 GLU CD 1 1 14 8015 1 1 37 GLU CG C -1.805 2.206 9.438 1.00 . A A . 37 GLU CG 1 1 14 8016 1 1 37 GLU H H 0.206 6.122 8.754 1.00 . A A . 37 GLU H 1 1 14 8017 1 1 37 GLU HA H 0.393 3.308 8.760 1.00 . A A . 37 GLU HA 1 1 14 8018 1 1 37 GLU HB2 H -1.520 4.071 10.485 1.00 . A A . 37 GLU HB2 1 1 14 8019 1 1 37 GLU HB3 H -2.467 4.216 9.017 1.00 . A A . 37 GLU HB3 1 1 14 8020 1 1 37 GLU HE2 H -1.968 1.138 12.448 1.00 . A A . 37 GLU HE2 1 1 14 8021 1 1 37 GLU HG2 H -2.423 1.929 8.585 1.00 . A A . 37 GLU HG2 1 1 14 8022 1 1 37 GLU HG3 H -0.844 1.707 9.312 1.00 . A A . 37 GLU HG3 1 1 14 8023 1 1 37 GLU N N 0.299 5.275 9.277 1.00 . A A . 37 GLU N 1 1 14 8024 1 1 37 GLU O O -0.851 5.527 6.810 1.00 . A A . 37 GLU O 1 1 14 8025 1 1 37 GLU OE1 O -3.614 1.254 10.702 1.00 . A A . 37 GLU OE1 1 1 14 8026 1 1 37 GLU OE2 O -1.751 1.864 11.795 1.00 . A A . 37 GLU OE2 1 1 14 8027 1 1 38 LYS C C -2.269 4.240 4.829 1.00 . A A . 38 LYS C 1 1 14 8028 1 1 38 LYS CA C -1.003 3.403 5.024 1.00 . A A . 38 LYS CA 1 1 14 8029 1 1 38 LYS CB C -1.081 2.013 4.390 1.00 . A A . 38 LYS CB 1 1 14 8030 1 1 38 LYS CD C -0.115 1.164 2.221 1.00 . A A . 38 LYS CD 1 1 14 8031 1 1 38 LYS CE C -0.634 -0.275 2.202 1.00 . A A . 38 LYS CE 1 1 14 8032 1 1 38 LYS CG C -1.134 2.107 2.864 1.00 . A A . 38 LYS CG 1 1 14 8033 1 1 38 LYS H H -0.550 2.370 6.775 1.00 . A A . 38 LYS H 1 1 14 8034 1 1 38 LYS HA H -0.168 3.924 4.553 1.00 . A A . 38 LYS HA 1 1 14 8035 1 1 38 LYS HB2 H -0.217 1.421 4.692 1.00 . A A . 38 LYS HB2 1 1 14 8036 1 1 38 LYS HB3 H -1.967 1.492 4.756 1.00 . A A . 38 LYS HB3 1 1 14 8037 1 1 38 LYS HD2 H 0.097 1.492 1.203 1.00 . A A . 38 LYS HD2 1 1 14 8038 1 1 38 LYS HD3 H 0.825 1.208 2.773 1.00 . A A . 38 LYS HD3 1 1 14 8039 1 1 38 LYS HE2 H -1.713 -0.276 2.052 1.00 . A A . 38 LYS HE2 1 1 14 8040 1 1 38 LYS HE3 H -0.195 -0.815 1.363 1.00 . A A . 38 LYS HE3 1 1 14 8041 1 1 38 LYS HG2 H -2.135 1.858 2.515 1.00 . A A . 38 LYS HG2 1 1 14 8042 1 1 38 LYS HG3 H -0.933 3.132 2.552 1.00 . A A . 38 LYS HG3 1 1 14 8043 1 1 38 LYS HZ1 H 0.294 -0.397 4.064 1.00 . A A . 38 LYS HZ1 1 1 14 8044 1 1 38 LYS HZ2 H -1.132 -1.182 4.010 1.00 . A A . 38 LYS HZ2 1 1 14 8045 1 1 38 LYS N N -0.708 3.300 6.442 1.00 . A A . 38 LYS N 1 1 14 8046 1 1 38 LYS NZ N -0.303 -0.962 3.470 1.00 . A A . 38 LYS NZ 1 1 14 8047 1 1 38 LYS O O -3.255 4.054 5.539 1.00 . A A . 38 LYS O 1 1 14 8048 1 1 39 GLN C C -3.158 6.651 2.187 1.00 . A A . 39 GLN C 1 1 14 8049 1 1 39 GLN CA C -3.328 6.011 3.567 1.00 . A A . 39 GLN CA 1 1 14 8050 1 1 39 GLN CB C -3.499 7.077 4.649 1.00 . A A . 39 GLN CB 1 1 14 8051 1 1 39 GLN CD C -5.299 7.911 6.206 1.00 . A A . 39 GLN CD 1 1 14 8052 1 1 39 GLN CG C -4.588 6.677 5.646 1.00 . A A . 39 GLN CG 1 1 14 8053 1 1 39 GLN H H -1.393 5.289 3.290 1.00 . A A . 39 GLN H 1 1 14 8054 1 1 39 GLN HA H -4.201 5.358 3.567 1.00 . A A . 39 GLN HA 1 1 14 8055 1 1 39 GLN HB2 H -2.555 7.223 5.175 1.00 . A A . 39 GLN HB2 1 1 14 8056 1 1 39 GLN HB3 H -3.756 8.031 4.188 1.00 . A A . 39 GLN HB3 1 1 14 8057 1 1 39 GLN HE21 H -3.895 8.002 7.661 1.00 . A A . 39 GLN HE21 1 1 14 8058 1 1 39 GLN HE22 H -5.112 9.233 7.728 1.00 . A A . 39 GLN HE22 1 1 14 8059 1 1 39 GLN HG2 H -5.312 6.027 5.157 1.00 . A A . 39 GLN HG2 1 1 14 8060 1 1 39 GLN HG3 H -4.146 6.106 6.463 1.00 . A A . 39 GLN HG3 1 1 14 8061 1 1 39 GLN N N -2.199 5.145 3.863 1.00 . A A . 39 GLN N 1 1 14 8062 1 1 39 GLN NE2 N -4.721 8.424 7.289 1.00 . A A . 39 GLN NE2 1 1 14 8063 1 1 39 GLN O O -3.024 5.949 1.185 1.00 . A A . 39 GLN O 1 1 14 8064 1 1 39 GLN OE1 O -6.306 8.366 5.691 1.00 . A A . 39 GLN OE1 1 1 15 8065 1 1 1 MET C C 3.869 0.326 -0.628 1.00 . A A . 1 MET C 1 1 15 8066 1 1 1 MET CA C 2.494 -0.175 -1.073 1.00 . A A . 1 MET CA 1 1 15 8067 1 1 1 MET CB C 2.100 0.509 -2.384 1.00 . A A . 1 MET CB 1 1 15 8068 1 1 1 MET CE C 0.359 -1.277 -5.675 1.00 . A A . 1 MET CE 1 1 15 8069 1 1 1 MET CG C 1.788 -0.524 -3.469 1.00 . A A . 1 MET CG 1 1 15 8070 1 1 1 MET H1 H 1.835 0.168 0.873 1.00 . A A . 1 MET H1 1 1 15 8071 1 1 1 MET HA H 2.513 -1.260 -1.182 1.00 . A A . 1 MET HA 1 1 15 8072 1 1 1 MET HB2 H 1.230 1.143 -2.219 1.00 . A A . 1 MET HB2 1 1 15 8073 1 1 1 MET HB3 H 2.910 1.159 -2.716 1.00 . A A . 1 MET HB3 1 1 15 8074 1 1 1 MET HE1 H -0.430 -1.071 -6.398 1.00 . A A . 1 MET HE1 1 1 15 8075 1 1 1 MET HE2 H 1.317 -1.340 -6.191 1.00 . A A . 1 MET HE2 1 1 15 8076 1 1 1 MET HE3 H 0.154 -2.224 -5.175 1.00 . A A . 1 MET HE3 1 1 15 8077 1 1 1 MET HG2 H 2.666 -0.679 -4.097 1.00 . A A . 1 MET HG2 1 1 15 8078 1 1 1 MET HG3 H 1.549 -1.484 -3.012 1.00 . A A . 1 MET HG3 1 1 15 8079 1 1 1 MET N N 1.487 0.097 -0.062 1.00 . A A . 1 MET N 1 1 15 8080 1 1 1 MET O O 4.825 -0.445 -0.561 1.00 . A A . 1 MET O 1 1 15 8081 1 1 1 MET SD S 0.418 0.035 -4.466 1.00 . A A . 1 MET SD 1 1 15 8082 1 1 2 ASP C C 4.951 3.735 0.287 1.00 . A A . 2 ASP C 1 1 15 8083 1 1 2 ASP CA C 5.167 2.232 0.103 1.00 . A A . 2 ASP CA 1 1 15 8084 1 1 2 ASP CB C 6.274 2.037 -0.935 1.00 . A A . 2 ASP CB 1 1 15 8085 1 1 2 ASP CG C 5.979 2.631 -2.313 1.00 . A A . 2 ASP CG 1 1 15 8086 1 1 2 ASP H H 3.143 2.239 -0.390 1.00 . A A . 2 ASP H 1 1 15 8087 1 1 2 ASP HA H 5.422 1.730 1.037 1.00 . A A . 2 ASP HA 1 1 15 8088 1 1 2 ASP HB2 H 7.193 2.482 -0.552 1.00 . A A . 2 ASP HB2 1 1 15 8089 1 1 2 ASP HB3 H 6.460 0.969 -1.049 1.00 . A A . 2 ASP HB3 1 1 15 8090 1 1 2 ASP HD2 H 7.474 2.789 -3.447 1.00 . A A . 2 ASP HD2 1 1 15 8091 1 1 2 ASP N N 3.925 1.618 -0.334 1.00 . A A . 2 ASP N 1 1 15 8092 1 1 2 ASP O O 5.476 4.540 -0.480 1.00 . A A . 2 ASP O 1 1 15 8093 1 1 2 ASP OD1 O 4.895 2.425 -2.879 1.00 . A A . 2 ASP OD1 1 1 15 8094 1 1 2 ASP OD2 O 6.931 3.343 -2.816 1.00 . A A . 2 ASP OD2 1 1 15 8095 1 1 3 ILE C C 3.542 5.604 3.088 1.00 . A A . 3 ILE C 1 1 15 8096 1 1 3 ILE CA C 3.883 5.461 1.603 1.00 . A A . 3 ILE CA 1 1 15 8097 1 1 3 ILE CB C 2.792 5.988 0.668 1.00 . A A . 3 ILE CB 1 1 15 8098 1 1 3 ILE CD1 C 3.036 5.343 -1.757 1.00 . A A . 3 ILE CD1 1 1 15 8099 1 1 3 ILE CG1 C 3.377 6.384 -0.690 1.00 . A A . 3 ILE CG1 1 1 15 8100 1 1 3 ILE CG2 C 2.022 7.140 1.318 1.00 . A A . 3 ILE CG2 1 1 15 8101 1 1 3 ILE H H 3.752 3.408 1.928 1.00 . A A . 3 ILE H 1 1 15 8102 1 1 3 ILE HA H 4.786 6.036 1.399 1.00 . A A . 3 ILE HA 1 1 15 8103 1 1 3 ILE HB H 2.078 5.184 0.489 1.00 . A A . 3 ILE HB 1 1 15 8104 1 1 3 ILE HD11 H 1.954 5.277 -1.869 1.00 . A A . 3 ILE HD11 1 1 15 8105 1 1 3 ILE HD12 H 3.483 5.638 -2.707 1.00 . A A . 3 ILE HD12 1 1 15 8106 1 1 3 ILE HD13 H 3.431 4.373 -1.457 1.00 . A A . 3 ILE HD13 1 1 15 8107 1 1 3 ILE HG12 H 2.987 7.357 -0.987 1.00 . A A . 3 ILE HG12 1 1 15 8108 1 1 3 ILE HG13 H 4.459 6.486 -0.607 1.00 . A A . 3 ILE HG13 1 1 15 8109 1 1 3 ILE HG21 H 1.138 6.748 1.821 1.00 . A A . 3 ILE HG21 1 1 15 8110 1 1 3 ILE HG22 H 2.663 7.641 2.044 1.00 . A A . 3 ILE HG22 1 1 15 8111 1 1 3 ILE HG23 H 1.717 7.852 0.551 1.00 . A A . 3 ILE HG23 1 1 15 8112 1 1 3 ILE N N 4.176 4.070 1.309 1.00 . A A . 3 ILE N 1 1 15 8113 1 1 3 ILE O O 2.892 4.756 3.693 1.00 . A A . 3 ILE O 1 1 15 8114 1 1 4 TYR C C 3.179 8.392 5.223 1.00 . A A . 4 TYR C 1 1 15 8115 1 1 4 TYR CA C 3.768 6.997 5.069 1.00 . A A . 4 TYR CA 1 1 15 8116 1 1 4 TYR CB C 5.080 6.876 5.839 1.00 . A A . 4 TYR CB 1 1 15 8117 1 1 4 TYR CD1 C 4.877 4.689 7.076 1.00 . A A . 4 TYR CD1 1 1 15 8118 1 1 4 TYR CD2 C 6.532 4.883 5.314 1.00 . A A . 4 TYR CD2 1 1 15 8119 1 1 4 TYR CE1 C 5.272 3.365 7.302 1.00 . A A . 4 TYR CE1 1 1 15 8120 1 1 4 TYR CE2 C 6.927 3.559 5.540 1.00 . A A . 4 TYR CE2 1 1 15 8121 1 1 4 TYR CG C 5.506 5.448 6.082 1.00 . A A . 4 TYR CG 1 1 15 8122 1 1 4 TYR CZ C 6.297 2.800 6.533 1.00 . A A . 4 TYR CZ 1 1 15 8123 1 1 4 TYR H H 4.534 7.381 3.125 1.00 . A A . 4 TYR H 1 1 15 8124 1 1 4 TYR HA H 3.058 6.270 5.463 1.00 . A A . 4 TYR HA 1 1 15 8125 1 1 4 TYR HB2 H 5.863 7.381 5.273 1.00 . A A . 4 TYR HB2 1 1 15 8126 1 1 4 TYR HB3 H 4.967 7.374 6.802 1.00 . A A . 4 TYR HB3 1 1 15 8127 1 1 4 TYR HD1 H 4.086 5.125 7.669 1.00 . A A . 4 TYR HD1 1 1 15 8128 1 1 4 TYR HD2 H 7.018 5.469 4.548 1.00 . A A . 4 TYR HD2 1 1 15 8129 1 1 4 TYR HE1 H 4.785 2.779 8.068 1.00 . A A . 4 TYR HE1 1 1 15 8130 1 1 4 TYR HE2 H 7.718 3.123 4.947 1.00 . A A . 4 TYR HE2 1 1 15 8131 1 1 4 TYR HH H 7.163 1.131 6.015 1.00 . A A . 4 TYR HH 1 1 15 8132 1 1 4 TYR N N 4.003 6.714 3.668 1.00 . A A . 4 TYR N 1 1 15 8133 1 1 4 TYR O O 3.942 9.348 5.356 1.00 . A A . 4 TYR O 1 1 15 8134 1 1 4 TYR OH O 6.681 1.510 6.753 1.00 . A A . 4 TYR OH 1 1 15 8135 1 1 5 VAL C C 0.649 9.907 6.762 1.00 . A A . 5 VAL C 1 1 15 8136 1 1 5 VAL CA C 1.194 9.770 5.340 1.00 . A A . 5 VAL CA 1 1 15 8137 1 1 5 VAL CB C 0.113 9.919 4.268 1.00 . A A . 5 VAL CB 1 1 15 8138 1 1 5 VAL CG1 C -0.592 11.271 4.386 1.00 . A A . 5 VAL CG1 1 1 15 8139 1 1 5 VAL CG2 C 0.699 9.725 2.868 1.00 . A A . 5 VAL CG2 1 1 15 8140 1 1 5 VAL H H 1.244 7.702 5.093 1.00 . A A . 5 VAL H 1 1 15 8141 1 1 5 VAL HA H 1.942 10.546 5.175 1.00 . A A . 5 VAL HA 1 1 15 8142 1 1 5 VAL HB H -0.630 9.138 4.431 1.00 . A A . 5 VAL HB 1 1 15 8143 1 1 5 VAL HG11 H -1.653 11.148 4.169 1.00 . A A . 5 VAL HG11 1 1 15 8144 1 1 5 VAL HG12 H -0.471 11.658 5.397 1.00 . A A . 5 VAL HG12 1 1 15 8145 1 1 5 VAL HG13 H -0.155 11.972 3.674 1.00 . A A . 5 VAL HG13 1 1 15 8146 1 1 5 VAL HG21 H 1.734 10.067 2.857 1.00 . A A . 5 VAL HG21 1 1 15 8147 1 1 5 VAL HG22 H 0.662 8.669 2.602 1.00 . A A . 5 VAL HG22 1 1 15 8148 1 1 5 VAL HG23 H 0.118 10.302 2.148 1.00 . A A . 5 VAL HG23 1 1 15 8149 1 1 5 VAL N N 1.857 8.484 5.202 1.00 . A A . 5 VAL N 1 1 15 8150 1 1 5 VAL O O -0.167 9.096 7.199 1.00 . A A . 5 VAL O 1 1 15 8151 1 1 6 CYS C C -0.833 11.322 8.818 1.00 . A A . 6 CYS C 1 1 15 8152 1 1 6 CYS CA C 0.691 11.191 8.811 1.00 . A A . 6 CYS CA 1 1 15 8153 1 1 6 CYS CB C 1.373 12.429 9.400 1.00 . A A . 6 CYS CB 1 1 15 8154 1 1 6 CYS H H 1.785 11.593 7.085 1.00 . A A . 6 CYS H 1 1 15 8155 1 1 6 CYS HA H 1.009 10.334 9.405 1.00 . A A . 6 CYS HA 1 1 15 8156 1 1 6 CYS HB2 H 2.420 12.427 9.099 1.00 . A A . 6 CYS HB2 1 1 15 8157 1 1 6 CYS HB3 H 0.917 13.319 8.963 1.00 . A A . 6 CYS HB3 1 1 15 8158 1 1 6 CYS N N 1.121 10.938 7.447 1.00 . A A . 6 CYS N 1 1 15 8159 1 1 6 CYS O O -1.438 11.628 7.792 1.00 . A A . 6 CYS O 1 1 15 8160 1 1 6 CYS SG S 1.286 12.560 11.222 1.00 . A A . 6 CYS SG 1 1 15 8161 1 1 7 THR C C -3.221 12.317 11.084 1.00 . A A . 7 THR C 1 1 15 8162 1 1 7 THR CA C -2.853 11.171 10.140 1.00 . A A . 7 THR CA 1 1 15 8163 1 1 7 THR CB C -3.361 9.807 10.612 1.00 . A A . 7 THR CB 1 1 15 8164 1 1 7 THR CG2 C -3.261 8.735 9.524 1.00 . A A . 7 THR CG2 1 1 15 8165 1 1 7 THR H H -0.911 10.835 10.817 1.00 . A A . 7 THR H 1 1 15 8166 1 1 7 THR HA H -3.289 11.405 9.169 1.00 . A A . 7 THR HA 1 1 15 8167 1 1 7 THR HB H -4.381 9.882 10.992 1.00 . A A . 7 THR HB 1 1 15 8168 1 1 7 THR HG1 H -2.537 9.924 12.432 1.00 . A A . 7 THR HG1 1 1 15 8169 1 1 7 THR HG21 H -3.041 7.772 9.983 1.00 . A A . 7 THR HG21 1 1 15 8170 1 1 7 THR HG22 H -4.205 8.675 8.985 1.00 . A A . 7 THR HG22 1 1 15 8171 1 1 7 THR HG23 H -2.461 8.997 8.831 1.00 . A A . 7 THR HG23 1 1 15 8172 1 1 7 THR N N -1.411 11.083 9.987 1.00 . A A . 7 THR N 1 1 15 8173 1 1 7 THR O O -4.394 12.526 11.386 1.00 . A A . 7 THR O 1 1 15 8174 1 1 7 THR OG1 O -2.408 9.401 11.590 1.00 . A A . 7 THR OG1 1 1 15 8175 1 1 8 VAL C C -2.442 15.448 11.625 1.00 . A A . 8 VAL C 1 1 15 8176 1 1 8 VAL CA C -2.395 14.148 12.431 1.00 . A A . 8 VAL CA 1 1 15 8177 1 1 8 VAL CB C -1.307 14.153 13.508 1.00 . A A . 8 VAL CB 1 1 15 8178 1 1 8 VAL CG1 C -1.272 15.492 14.245 1.00 . A A . 8 VAL CG1 1 1 15 8179 1 1 8 VAL CG2 C -1.500 12.992 14.486 1.00 . A A . 8 VAL CG2 1 1 15 8180 1 1 8 VAL H H -1.242 12.852 11.277 1.00 . A A . 8 VAL H 1 1 15 8181 1 1 8 VAL HA H -3.356 14.005 12.924 1.00 . A A . 8 VAL HA 1 1 15 8182 1 1 8 VAL HB H -0.345 14.017 13.012 1.00 . A A . 8 VAL HB 1 1 15 8183 1 1 8 VAL HG11 H -2.215 15.643 14.770 1.00 . A A . 8 VAL HG11 1 1 15 8184 1 1 8 VAL HG12 H -0.453 15.488 14.965 1.00 . A A . 8 VAL HG12 1 1 15 8185 1 1 8 VAL HG13 H -1.121 16.299 13.528 1.00 . A A . 8 VAL HG13 1 1 15 8186 1 1 8 VAL HG21 H -2.547 12.692 14.491 1.00 . A A . 8 VAL HG21 1 1 15 8187 1 1 8 VAL HG22 H -0.882 12.149 14.175 1.00 . A A . 8 VAL HG22 1 1 15 8188 1 1 8 VAL HG23 H -1.207 13.308 15.486 1.00 . A A . 8 VAL HG23 1 1 15 8189 1 1 8 VAL N N -2.195 13.029 11.526 1.00 . A A . 8 VAL N 1 1 15 8190 1 1 8 VAL O O -3.370 16.242 11.776 1.00 . A A . 8 VAL O 1 1 15 8191 1 1 9 CYS C C -1.642 16.410 8.508 1.00 . A A . 9 CYS C 1 1 15 8192 1 1 9 CYS CA C -1.348 16.813 9.955 1.00 . A A . 9 CYS CA 1 1 15 8193 1 1 9 CYS CB C 0.011 17.502 10.090 1.00 . A A . 9 CYS CB 1 1 15 8194 1 1 9 CYS H H -0.683 14.971 10.668 1.00 . A A . 9 CYS H 1 1 15 8195 1 1 9 CYS HA H -2.103 17.507 10.324 1.00 . A A . 9 CYS HA 1 1 15 8196 1 1 9 CYS HB2 H 0.188 18.104 9.200 1.00 . A A . 9 CYS HB2 1 1 15 8197 1 1 9 CYS HB3 H -0.029 18.189 10.936 1.00 . A A . 9 CYS HB3 1 1 15 8198 1 1 9 CYS N N -1.433 15.623 10.786 1.00 . A A . 9 CYS N 1 1 15 8199 1 1 9 CYS O O -2.041 17.244 7.697 1.00 . A A . 9 CYS O 1 1 15 8200 1 1 9 CYS SG S 1.427 16.367 10.323 1.00 . A A . 9 CYS SG 1 1 15 8201 1 1 10 GLY C C -0.406 14.701 6.037 1.00 . A A . 10 GLY C 1 1 15 8202 1 1 10 GLY CA C -1.669 14.609 6.895 1.00 . A A . 10 GLY CA 1 1 15 8203 1 1 10 GLY H H -1.108 14.460 8.894 1.00 . A A . 10 GLY H 1 1 15 8204 1 1 10 GLY HA2 H -1.994 13.571 6.959 1.00 . A A . 10 GLY HA2 1 1 15 8205 1 1 10 GLY HA3 H -2.478 15.166 6.420 1.00 . A A . 10 GLY HA3 1 1 15 8206 1 1 10 GLY N N -1.433 15.132 8.229 1.00 . A A . 10 GLY N 1 1 15 8207 1 1 10 GLY O O -0.445 14.650 4.809 1.00 . A A . 10 GLY O 1 1 15 8208 1 1 11 TYR C C 2.171 13.810 5.055 1.00 . A A . 11 TYR C 1 1 15 8209 1 1 11 TYR CA C 2.014 14.946 6.055 1.00 . A A . 11 TYR CA 1 1 15 8210 1 1 11 TYR CB C 3.129 14.909 7.096 1.00 . A A . 11 TYR CB 1 1 15 8211 1 1 11 TYR CD1 C 4.687 16.253 5.638 1.00 . A A . 11 TYR CD1 1 1 15 8212 1 1 11 TYR CD2 C 5.581 14.366 6.872 1.00 . A A . 11 TYR CD2 1 1 15 8213 1 1 11 TYR CE1 C 5.957 16.507 5.105 1.00 . A A . 11 TYR CE1 1 1 15 8214 1 1 11 TYR CE2 C 6.851 14.620 6.339 1.00 . A A . 11 TYR CE2 1 1 15 8215 1 1 11 TYR CG C 4.499 15.183 6.521 1.00 . A A . 11 TYR CG 1 1 15 8216 1 1 11 TYR CZ C 7.038 15.690 5.456 1.00 . A A . 11 TYR CZ 1 1 15 8217 1 1 11 TYR H H 0.709 14.880 7.729 1.00 . A A . 11 TYR H 1 1 15 8218 1 1 11 TYR HA H 2.060 15.895 5.521 1.00 . A A . 11 TYR HA 1 1 15 8219 1 1 11 TYR HB2 H 2.918 15.656 7.861 1.00 . A A . 11 TYR HB2 1 1 15 8220 1 1 11 TYR HB3 H 3.138 13.923 7.562 1.00 . A A . 11 TYR HB3 1 1 15 8221 1 1 11 TYR HD1 H 3.852 16.882 5.369 1.00 . A A . 11 TYR HD1 1 1 15 8222 1 1 11 TYR HD2 H 5.436 13.541 7.554 1.00 . A A . 11 TYR HD2 1 1 15 8223 1 1 11 TYR HE1 H 6.101 17.331 4.424 1.00 . A A . 11 TYR HE1 1 1 15 8224 1 1 11 TYR HE2 H 7.685 13.989 6.609 1.00 . A A . 11 TYR HE2 1 1 15 8225 1 1 11 TYR HH H 8.405 15.541 4.071 1.00 . A A . 11 TYR HH 1 1 15 8226 1 1 11 TYR N N 0.731 14.842 6.721 1.00 . A A . 11 TYR N 1 1 15 8227 1 1 11 TYR O O 1.492 12.793 5.199 1.00 . A A . 11 TYR O 1 1 15 8228 1 1 11 TYR OH O 8.275 15.937 4.936 1.00 . A A . 11 TYR OH 1 1 15 8229 1 1 12 GLU C C 4.757 12.610 3.007 1.00 . A A . 12 GLU C 1 1 15 8230 1 1 12 GLU CA C 3.272 12.973 3.071 1.00 . A A . 12 GLU CA 1 1 15 8231 1 1 12 GLU CB C 2.759 13.426 1.703 1.00 . A A . 12 GLU CB 1 1 15 8232 1 1 12 GLU CD C 1.284 12.313 -0.012 1.00 . A A . 12 GLU CD 1 1 15 8233 1 1 12 GLU CG C 1.371 12.847 1.419 1.00 . A A . 12 GLU CG 1 1 15 8234 1 1 12 GLU H H 3.594 14.825 3.969 1.00 . A A . 12 GLU H 1 1 15 8235 1 1 12 GLU HA H 2.694 12.109 3.401 1.00 . A A . 12 GLU HA 1 1 15 8236 1 1 12 GLU HB2 H 2.716 14.515 1.670 1.00 . A A . 12 GLU HB2 1 1 15 8237 1 1 12 GLU HB3 H 3.454 13.111 0.927 1.00 . A A . 12 GLU HB3 1 1 15 8238 1 1 12 GLU HE2 H -0.168 13.422 -0.467 1.00 . A A . 12 GLU HE2 1 1 15 8239 1 1 12 GLU HG2 H 1.156 12.045 2.124 1.00 . A A . 12 GLU HG2 1 1 15 8240 1 1 12 GLU HG3 H 0.614 13.617 1.569 1.00 . A A . 12 GLU HG3 1 1 15 8241 1 1 12 GLU N N 3.046 13.996 4.078 1.00 . A A . 12 GLU N 1 1 15 8242 1 1 12 GLU O O 5.635 13.465 2.924 1.00 . A A . 12 GLU O 1 1 15 8243 1 1 12 GLU OE1 O 2.269 11.766 -0.531 1.00 . A A . 12 GLU OE1 1 1 15 8244 1 1 12 GLU OE2 O 0.141 12.479 -0.588 1.00 . A A . 12 GLU OE2 1 1 15 8245 1 1 13 TYR C C 6.567 9.948 1.748 1.00 . A A . 13 TYR C 1 1 15 8246 1 1 13 TYR CA C 6.377 10.795 2.998 1.00 . A A . 13 TYR CA 1 1 15 8247 1 1 13 TYR CB C 6.659 9.976 4.255 1.00 . A A . 13 TYR CB 1 1 15 8248 1 1 13 TYR CD1 C 9.128 10.417 4.503 1.00 . A A . 13 TYR CD1 1 1 15 8249 1 1 13 TYR CD2 C 8.368 8.124 4.293 1.00 . A A . 13 TYR CD2 1 1 15 8250 1 1 13 TYR CE1 C 10.452 9.970 4.593 1.00 . A A . 13 TYR CE1 1 1 15 8251 1 1 13 TYR CE2 C 9.692 7.677 4.384 1.00 . A A . 13 TYR CE2 1 1 15 8252 1 1 13 TYR CG C 8.087 9.494 4.353 1.00 . A A . 13 TYR CG 1 1 15 8253 1 1 13 TYR CZ C 10.734 8.600 4.534 1.00 . A A . 13 TYR CZ 1 1 15 8254 1 1 13 TYR H H 4.262 10.638 3.117 1.00 . A A . 13 TYR H 1 1 15 8255 1 1 13 TYR HA H 7.068 11.637 2.963 1.00 . A A . 13 TYR HA 1 1 15 8256 1 1 13 TYR HB2 H 6.438 10.590 5.128 1.00 . A A . 13 TYR HB2 1 1 15 8257 1 1 13 TYR HB3 H 5.998 9.109 4.260 1.00 . A A . 13 TYR HB3 1 1 15 8258 1 1 13 TYR HD1 H 8.910 11.474 4.549 1.00 . A A . 13 TYR HD1 1 1 15 8259 1 1 13 TYR HD2 H 7.564 7.411 4.177 1.00 . A A . 13 TYR HD2 1 1 15 8260 1 1 13 TYR HE1 H 11.255 10.683 4.709 1.00 . A A . 13 TYR HE1 1 1 15 8261 1 1 13 TYR HE2 H 9.910 6.620 4.337 1.00 . A A . 13 TYR HE2 1 1 15 8262 1 1 13 TYR HH H 12.565 8.708 5.198 1.00 . A A . 13 TYR HH 1 1 15 8263 1 1 13 TYR N N 5.021 11.302 3.049 1.00 . A A . 13 TYR N 1 1 15 8264 1 1 13 TYR O O 5.587 9.390 1.254 1.00 . A A . 13 TYR O 1 1 15 8265 1 1 13 TYR OH O 12.023 8.165 4.621 1.00 . A A . 13 TYR OH 1 1 15 8266 1 1 14 ASP C C 9.294 8.183 0.347 1.00 . A A . 14 ASP C 1 1 15 8267 1 1 14 ASP CA C 8.087 9.085 0.078 1.00 . A A . 14 ASP CA 1 1 15 8268 1 1 14 ASP CB C 8.430 9.991 -1.108 1.00 . A A . 14 ASP CB 1 1 15 8269 1 1 14 ASP CG C 8.160 9.382 -2.485 1.00 . A A . 14 ASP CG 1 1 15 8270 1 1 14 ASP H H 8.588 10.325 1.675 1.00 . A A . 14 ASP H 1 1 15 8271 1 1 14 ASP HA H 7.178 8.518 -0.121 1.00 . A A . 14 ASP HA 1 1 15 8272 1 1 14 ASP HB2 H 7.858 10.914 -1.017 1.00 . A A . 14 ASP HB2 1 1 15 8273 1 1 14 ASP HB3 H 9.484 10.261 -1.047 1.00 . A A . 14 ASP HB3 1 1 15 8274 1 1 14 ASP HD2 H 9.181 10.234 -3.819 1.00 . A A . 14 ASP HD2 1 1 15 8275 1 1 14 ASP N N 7.799 9.869 1.267 1.00 . A A . 14 ASP N 1 1 15 8276 1 1 14 ASP O O 10.445 8.551 0.131 1.00 . A A . 14 ASP O 1 1 15 8277 1 1 14 ASP OD1 O 7.884 8.179 -2.610 1.00 . A A . 14 ASP OD1 1 1 15 8278 1 1 14 ASP OD2 O 8.243 10.209 -3.472 1.00 . A A . 14 ASP OD2 1 1 15 8279 1 1 15 PRO C C 11.133 6.035 0.166 1.00 . A A . 15 PRO C 1 1 15 8280 1 1 15 PRO CA C 9.979 5.962 1.155 1.00 . A A . 15 PRO CA 1 1 15 8281 1 1 15 PRO CB C 9.231 4.637 1.028 1.00 . A A . 15 PRO CB 1 1 15 8282 1 1 15 PRO CD C 7.654 6.508 1.098 1.00 . A A . 15 PRO CD 1 1 15 8283 1 1 15 PRO CG C 7.823 5.072 1.583 1.00 . A A . 15 PRO CG 1 1 15 8284 1 1 15 PRO HA H 10.353 6.091 2.171 1.00 . A A . 15 PRO HA 1 1 15 8285 1 1 15 PRO HB2 H 9.203 4.275 -0.001 1.00 . A A . 15 PRO HB2 1 1 15 8286 1 1 15 PRO HB3 H 9.695 3.899 1.683 1.00 . A A . 15 PRO HB3 1 1 15 8287 1 1 15 PRO HD2 H 7.031 6.545 0.203 1.00 . A A . 15 PRO HD2 1 1 15 8288 1 1 15 PRO HD3 H 7.215 7.116 1.889 1.00 . A A . 15 PRO HD3 1 1 15 8289 1 1 15 PRO HG2 H 7.119 4.429 1.057 1.00 . A A . 15 PRO HG2 1 1 15 8290 1 1 15 PRO HG3 H 7.698 4.981 2.662 1.00 . A A . 15 PRO HG3 1 1 15 8291 1 1 15 PRO N N 8.997 6.975 0.831 1.00 . A A . 15 PRO N 1 1 15 8292 1 1 15 PRO O O 10.912 5.808 -1.022 1.00 . A A . 15 PRO O 1 1 15 8293 1 1 16 ALA C C 14.628 7.118 0.573 1.00 . A A . 16 ALA C 1 1 15 8294 1 1 16 ALA CA C 13.490 6.445 -0.197 1.00 . A A . 16 ALA CA 1 1 15 8295 1 1 16 ALA CB C 13.121 7.203 -1.474 1.00 . A A . 16 ALA CB 1 1 15 8296 1 1 16 ALA H H 12.493 6.531 1.631 1.00 . A A . 16 ALA H 1 1 15 8297 1 1 16 ALA HA H 13.791 5.432 -0.464 1.00 . A A . 16 ALA HA 1 1 15 8298 1 1 16 ALA HB1 H 13.949 7.851 -1.763 1.00 . A A . 16 ALA HB1 1 1 15 8299 1 1 16 ALA HB2 H 12.921 6.491 -2.274 1.00 . A A . 16 ALA HB2 1 1 15 8300 1 1 16 ALA HB3 H 12.232 7.807 -1.295 1.00 . A A . 16 ALA HB3 1 1 15 8301 1 1 16 ALA N N 12.322 6.347 0.663 1.00 . A A . 16 ALA N 1 1 15 8302 1 1 16 ALA O O 15.007 8.247 0.266 1.00 . A A . 16 ALA O 1 1 15 8303 1 1 17 PHE C C 17.227 5.799 2.716 1.00 . A A . 17 PHE C 1 1 15 8304 1 1 17 PHE CA C 16.230 6.907 2.373 1.00 . A A . 17 PHE CA 1 1 15 8305 1 1 17 PHE CB C 15.609 7.436 3.666 1.00 . A A . 17 PHE CB 1 1 15 8306 1 1 17 PHE CD1 C 15.838 9.836 2.989 1.00 . A A . 17 PHE CD1 1 1 15 8307 1 1 17 PHE CD2 C 16.360 9.258 5.212 1.00 . A A . 17 PHE CD2 1 1 15 8308 1 1 17 PHE CE1 C 16.153 11.193 3.269 1.00 . A A . 17 PHE CE1 1 1 15 8309 1 1 17 PHE CE2 C 16.675 10.614 5.491 1.00 . A A . 17 PHE CE2 1 1 15 8310 1 1 17 PHE CG C 15.948 8.898 3.966 1.00 . A A . 17 PHE CG 1 1 15 8311 1 1 17 PHE CZ C 16.565 11.553 4.513 1.00 . A A . 17 PHE CZ 1 1 15 8312 1 1 17 PHE H H 14.828 5.477 1.799 1.00 . A A . 17 PHE H 1 1 15 8313 1 1 17 PHE HA H 16.734 7.679 1.791 1.00 . A A . 17 PHE HA 1 1 15 8314 1 1 17 PHE HB2 H 14.525 7.330 3.606 1.00 . A A . 17 PHE HB2 1 1 15 8315 1 1 17 PHE HB3 H 15.944 6.818 4.499 1.00 . A A . 17 PHE HB3 1 1 15 8316 1 1 17 PHE HD1 H 15.507 9.548 1.991 1.00 . A A . 17 PHE HD1 1 1 15 8317 1 1 17 PHE HD2 H 16.448 8.505 5.996 1.00 . A A . 17 PHE HD2 1 1 15 8318 1 1 17 PHE HE1 H 16.064 11.946 2.485 1.00 . A A . 17 PHE HE1 1 1 15 8319 1 1 17 PHE HE2 H 17.005 10.903 6.489 1.00 . A A . 17 PHE HE2 1 1 15 8320 1 1 17 PHE HZ H 16.806 12.594 4.728 1.00 . A A . 17 PHE HZ 1 1 15 8321 1 1 17 PHE N N 15.142 6.395 1.557 1.00 . A A . 17 PHE N 1 1 15 8322 1 1 17 PHE O O 17.239 4.749 2.074 1.00 . A A . 17 PHE O 1 1 15 8323 1 1 18 GLU C C 19.027 4.988 5.689 1.00 . A A . 18 GLU C 1 1 15 8324 1 1 18 GLU CA C 19.037 5.108 4.164 1.00 . A A . 18 GLU CA 1 1 15 8325 1 1 18 GLU CB C 20.427 5.490 3.653 1.00 . A A . 18 GLU CB 1 1 15 8326 1 1 18 GLU CD C 21.072 3.387 2.420 1.00 . A A . 18 GLU CD 1 1 15 8327 1 1 18 GLU CG C 21.357 4.275 3.633 1.00 . A A . 18 GLU CG 1 1 15 8328 1 1 18 GLU H H 18.022 6.924 4.244 1.00 . A A . 18 GLU H 1 1 15 8329 1 1 18 GLU HA H 18.740 4.158 3.717 1.00 . A A . 18 GLU HA 1 1 15 8330 1 1 18 GLU HB2 H 20.347 5.909 2.650 1.00 . A A . 18 GLU HB2 1 1 15 8331 1 1 18 GLU HB3 H 20.851 6.267 4.291 1.00 . A A . 18 GLU HB3 1 1 15 8332 1 1 18 GLU HE2 H 21.867 2.434 1.003 1.00 . A A . 18 GLU HE2 1 1 15 8333 1 1 18 GLU HG2 H 22.395 4.607 3.609 1.00 . A A . 18 GLU HG2 1 1 15 8334 1 1 18 GLU HG3 H 21.228 3.698 4.549 1.00 . A A . 18 GLU HG3 1 1 15 8335 1 1 18 GLU N N 18.039 6.068 3.727 1.00 . A A . 18 GLU N 1 1 15 8336 1 1 18 GLU O O 18.969 3.883 6.229 1.00 . A A . 18 GLU O 1 1 15 8337 1 1 18 GLU OE1 O 19.906 3.222 2.032 1.00 . A A . 18 GLU OE1 1 1 15 8338 1 1 18 GLU OE2 O 22.115 2.860 1.874 1.00 . A A . 18 GLU OE2 1 1 15 8339 1 1 19 ASP C C 17.652 6.390 8.293 1.00 . A A . 19 ASP C 1 1 15 8340 1 1 19 ASP CA C 19.082 6.177 7.795 1.00 . A A . 19 ASP CA 1 1 15 8341 1 1 19 ASP CB C 19.942 7.330 8.317 1.00 . A A . 19 ASP CB 1 1 15 8342 1 1 19 ASP CG C 20.087 7.391 9.839 1.00 . A A . 19 ASP CG 1 1 15 8343 1 1 19 ASP H H 19.131 7.033 5.896 1.00 . A A . 19 ASP H 1 1 15 8344 1 1 19 ASP HA H 19.494 5.217 8.107 1.00 . A A . 19 ASP HA 1 1 15 8345 1 1 19 ASP HB2 H 20.936 7.251 7.875 1.00 . A A . 19 ASP HB2 1 1 15 8346 1 1 19 ASP HB3 H 19.513 8.270 7.969 1.00 . A A . 19 ASP HB3 1 1 15 8347 1 1 19 ASP HD2 H 18.951 8.225 11.089 1.00 . A A . 19 ASP HD2 1 1 15 8348 1 1 19 ASP N N 19.085 6.139 6.343 1.00 . A A . 19 ASP N 1 1 15 8349 1 1 19 ASP O O 17.189 7.526 8.394 1.00 . A A . 19 ASP O 1 1 15 8350 1 1 19 ASP OD1 O 20.615 6.463 10.468 1.00 . A A . 19 ASP OD1 1 1 15 8351 1 1 19 ASP OD2 O 19.623 8.463 10.387 1.00 . A A . 19 ASP OD2 1 1 15 8352 1 1 20 LEU C C 15.520 4.545 10.385 1.00 . A A . 20 LEU C 1 1 15 8353 1 1 20 LEU CA C 15.623 5.333 9.078 1.00 . A A . 20 LEU CA 1 1 15 8354 1 1 20 LEU CB C 14.652 4.857 7.995 1.00 . A A . 20 LEU CB 1 1 15 8355 1 1 20 LEU CD1 C 12.559 4.878 9.401 1.00 . A A . 20 LEU CD1 1 1 15 8356 1 1 20 LEU CD2 C 13.167 6.895 7.987 1.00 . A A . 20 LEU CD2 1 1 15 8357 1 1 20 LEU CG C 13.215 5.370 8.110 1.00 . A A . 20 LEU CG 1 1 15 8358 1 1 20 LEU H H 17.376 4.362 8.507 1.00 . A A . 20 LEU H 1 1 15 8359 1 1 20 LEU HA H 15.389 6.376 9.284 1.00 . A A . 20 LEU HA 1 1 15 8360 1 1 20 LEU HB2 H 15.047 5.155 7.024 1.00 . A A . 20 LEU HB2 1 1 15 8361 1 1 20 LEU HB3 H 14.630 3.767 8.008 1.00 . A A . 20 LEU HB3 1 1 15 8362 1 1 20 LEU HD11 H 11.576 5.338 9.507 1.00 . A A . 20 LEU HD11 1 1 15 8363 1 1 20 LEU HD12 H 12.450 3.794 9.364 1.00 . A A . 20 LEU HD12 1 1 15 8364 1 1 20 LEU HD13 H 13.182 5.152 10.253 1.00 . A A . 20 LEU HD13 1 1 15 8365 1 1 20 LEU HD21 H 13.257 7.342 8.977 1.00 . A A . 20 LEU HD21 1 1 15 8366 1 1 20 LEU HD22 H 13.989 7.235 7.358 1.00 . A A . 20 LEU HD22 1 1 15 8367 1 1 20 LEU HD23 H 12.219 7.193 7.538 1.00 . A A . 20 LEU HD23 1 1 15 8368 1 1 20 LEU HG H 12.639 4.962 7.280 1.00 . A A . 20 LEU HG 1 1 15 8369 1 1 20 LEU N N 16.992 5.281 8.592 1.00 . A A . 20 LEU N 1 1 15 8370 1 1 20 LEU O O 15.093 3.393 10.421 1.00 . A A . 20 LEU O 1 1 15 8371 1 1 21 PRO C C 14.499 4.242 13.183 1.00 . A A . 21 PRO C 1 1 15 8372 1 1 21 PRO CA C 15.917 4.650 12.811 1.00 . A A . 21 PRO CA 1 1 15 8373 1 1 21 PRO CB C 16.413 5.784 13.706 1.00 . A A . 21 PRO CB 1 1 15 8374 1 1 21 PRO CD C 16.435 6.556 11.467 1.00 . A A . 21 PRO CD 1 1 15 8375 1 1 21 PRO CG C 17.228 6.686 12.765 1.00 . A A . 21 PRO CG 1 1 15 8376 1 1 21 PRO HA H 16.581 3.789 12.885 1.00 . A A . 21 PRO HA 1 1 15 8377 1 1 21 PRO HB2 H 15.595 6.321 14.186 1.00 . A A . 21 PRO HB2 1 1 15 8378 1 1 21 PRO HB3 H 17.099 5.379 14.450 1.00 . A A . 21 PRO HB3 1 1 15 8379 1 1 21 PRO HD2 H 15.629 7.288 11.429 1.00 . A A . 21 PRO HD2 1 1 15 8380 1 1 21 PRO HD3 H 17.102 6.684 10.614 1.00 . A A . 21 PRO HD3 1 1 15 8381 1 1 21 PRO HG2 H 17.321 7.741 13.025 1.00 . A A . 21 PRO HG2 1 1 15 8382 1 1 21 PRO HG3 H 18.209 6.215 12.702 1.00 . A A . 21 PRO HG3 1 1 15 8383 1 1 21 PRO N N 15.929 5.201 11.473 1.00 . A A . 21 PRO N 1 1 15 8384 1 1 21 PRO O O 13.609 4.350 12.340 1.00 . A A . 21 PRO O 1 1 15 8385 1 1 22 ASP C C 12.441 4.419 15.832 1.00 . A A . 22 ASP C 1 1 15 8386 1 1 22 ASP CA C 13.000 3.369 14.869 1.00 . A A . 22 ASP CA 1 1 15 8387 1 1 22 ASP CB C 13.073 2.035 15.615 1.00 . A A . 22 ASP CB 1 1 15 8388 1 1 22 ASP CG C 14.151 1.957 16.698 1.00 . A A . 22 ASP CG 1 1 15 8389 1 1 22 ASP H H 15.044 3.701 15.093 1.00 . A A . 22 ASP H 1 1 15 8390 1 1 22 ASP HA H 12.401 3.272 13.963 1.00 . A A . 22 ASP HA 1 1 15 8391 1 1 22 ASP HB2 H 12.104 1.838 16.072 1.00 . A A . 22 ASP HB2 1 1 15 8392 1 1 22 ASP HB3 H 13.251 1.240 14.890 1.00 . A A . 22 ASP HB3 1 1 15 8393 1 1 22 ASP HD2 H 12.892 2.494 17.993 1.00 . A A . 22 ASP HD2 1 1 15 8394 1 1 22 ASP N N 14.315 3.786 14.414 1.00 . A A . 22 ASP N 1 1 15 8395 1 1 22 ASP O O 12.064 4.095 16.957 1.00 . A A . 22 ASP O 1 1 15 8396 1 1 22 ASP OD1 O 15.354 1.937 16.402 1.00 . A A . 22 ASP OD1 1 1 15 8397 1 1 22 ASP OD2 O 13.705 1.918 17.909 1.00 . A A . 22 ASP OD2 1 1 15 8398 1 1 23 ASP C C 11.833 8.018 15.302 1.00 . A A . 23 ASP C 1 1 15 8399 1 1 23 ASP CA C 11.899 6.753 16.158 1.00 . A A . 23 ASP CA 1 1 15 8400 1 1 23 ASP CB C 12.819 7.034 17.348 1.00 . A A . 23 ASP CB 1 1 15 8401 1 1 23 ASP CG C 14.310 6.822 17.077 1.00 . A A . 23 ASP CG 1 1 15 8402 1 1 23 ASP H H 12.714 5.908 14.438 1.00 . A A . 23 ASP H 1 1 15 8403 1 1 23 ASP HA H 10.916 6.428 16.500 1.00 . A A . 23 ASP HA 1 1 15 8404 1 1 23 ASP HB2 H 12.667 8.066 17.669 1.00 . A A . 23 ASP HB2 1 1 15 8405 1 1 23 ASP HB3 H 12.522 6.394 18.178 1.00 . A A . 23 ASP HB3 1 1 15 8406 1 1 23 ASP HD2 H 15.541 8.146 17.604 1.00 . A A . 23 ASP HD2 1 1 15 8407 1 1 23 ASP N N 12.406 5.654 15.354 1.00 . A A . 23 ASP N 1 1 15 8408 1 1 23 ASP O O 12.498 9.009 15.599 1.00 . A A . 23 ASP O 1 1 15 8409 1 1 23 ASP OD1 O 14.810 5.687 17.111 1.00 . A A . 23 ASP OD1 1 1 15 8410 1 1 23 ASP OD2 O 14.976 7.897 16.817 1.00 . A A . 23 ASP OD2 1 1 15 8411 1 1 24 TRP C C 9.664 9.894 13.834 1.00 . A A . 24 TRP C 1 1 15 8412 1 1 24 TRP CA C 10.861 9.072 13.352 1.00 . A A . 24 TRP CA 1 1 15 8413 1 1 24 TRP CB C 10.718 8.598 11.904 1.00 . A A . 24 TRP CB 1 1 15 8414 1 1 24 TRP CD1 C 12.182 10.417 10.805 1.00 . A A . 24 TRP CD1 1 1 15 8415 1 1 24 TRP CD2 C 10.278 10.058 9.730 1.00 . A A . 24 TRP CD2 1 1 15 8416 1 1 24 TRP CE2 C 10.960 11.043 9.044 1.00 . A A . 24 TRP CE2 1 1 15 8417 1 1 24 TRP CE3 C 9.021 9.599 9.296 1.00 . A A . 24 TRP CE3 1 1 15 8418 1 1 24 TRP CG C 11.076 9.662 10.865 1.00 . A A . 24 TRP CG 1 1 15 8419 1 1 24 TRP CH2 C 9.214 11.212 7.436 1.00 . A A . 24 TRP CH2 1 1 15 8420 1 1 24 TRP CZ2 C 10.464 11.654 7.886 1.00 . A A . 24 TRP CZ2 1 1 15 8421 1 1 24 TRP CZ3 C 8.541 10.219 8.137 1.00 . A A . 24 TRP CZ3 1 1 15 8422 1 1 24 TRP H H 10.485 7.134 14.021 1.00 . A A . 24 TRP H 1 1 15 8423 1 1 24 TRP HA H 11.770 9.671 13.402 1.00 . A A . 24 TRP HA 1 1 15 8424 1 1 24 TRP HB2 H 11.354 7.727 11.753 1.00 . A A . 24 TRP HB2 1 1 15 8425 1 1 24 TRP HB3 H 9.690 8.275 11.739 1.00 . A A . 24 TRP HB3 1 1 15 8426 1 1 24 TRP HD1 H 13.000 10.366 11.523 1.00 . A A . 24 TRP HD1 1 1 15 8427 1 1 24 TRP HE1 H 12.926 11.986 9.441 1.00 . A A . 24 TRP HE1 1 1 15 8428 1 1 24 TRP HE3 H 8.464 8.823 9.819 1.00 . A A . 24 TRP HE3 1 1 15 8429 1 1 24 TRP HH2 H 8.771 11.646 6.539 1.00 . A A . 24 TRP HH2 1 1 15 8430 1 1 24 TRP HZ2 H 11.022 12.430 7.362 1.00 . A A . 24 TRP HZ2 1 1 15 8431 1 1 24 TRP HZ3 H 7.570 9.901 7.758 1.00 . A A . 24 TRP HZ3 1 1 15 8432 1 1 24 TRP N N 11.023 7.944 14.255 1.00 . A A . 24 TRP N 1 1 15 8433 1 1 24 TRP NE1 N 12.153 11.269 9.719 1.00 . A A . 24 TRP NE1 1 1 15 8434 1 1 24 TRP O O 8.650 9.337 14.251 1.00 . A A . 24 TRP O 1 1 15 8435 1 1 25 ALA C C 8.427 13.064 13.035 1.00 . A A . 25 ALA C 1 1 15 8436 1 1 25 ALA CA C 8.767 12.113 14.184 1.00 . A A . 25 ALA CA 1 1 15 8437 1 1 25 ALA CB C 9.209 12.857 15.446 1.00 . A A . 25 ALA CB 1 1 15 8438 1 1 25 ALA H H 10.650 11.654 13.420 1.00 . A A . 25 ALA H 1 1 15 8439 1 1 25 ALA HA H 7.890 11.513 14.419 1.00 . A A . 25 ALA HA 1 1 15 8440 1 1 25 ALA HB1 H 9.938 12.253 15.987 1.00 . A A . 25 ALA HB1 1 1 15 8441 1 1 25 ALA HB2 H 9.661 13.809 15.167 1.00 . A A . 25 ALA HB2 1 1 15 8442 1 1 25 ALA HB3 H 8.343 13.038 16.082 1.00 . A A . 25 ALA HB3 1 1 15 8443 1 1 25 ALA N N 9.823 11.208 13.760 1.00 . A A . 25 ALA N 1 1 15 8444 1 1 25 ALA O O 9.321 13.594 12.377 1.00 . A A . 25 ALA O 1 1 15 8445 1 1 26 CYS C C 7.310 15.504 11.964 1.00 . A A . 26 CYS C 1 1 15 8446 1 1 26 CYS CA C 6.662 14.131 11.772 1.00 . A A . 26 CYS CA 1 1 15 8447 1 1 26 CYS CB C 5.135 14.220 11.746 1.00 . A A . 26 CYS CB 1 1 15 8448 1 1 26 CYS H H 6.411 12.819 13.369 1.00 . A A . 26 CYS H 1 1 15 8449 1 1 26 CYS HA H 6.977 13.683 10.829 1.00 . A A . 26 CYS HA 1 1 15 8450 1 1 26 CYS HB2 H 4.724 13.269 12.084 1.00 . A A . 26 CYS HB2 1 1 15 8451 1 1 26 CYS HB3 H 4.817 14.977 12.464 1.00 . A A . 26 CYS HB3 1 1 15 8452 1 1 26 CYS N N 7.132 13.253 12.830 1.00 . A A . 26 CYS N 1 1 15 8453 1 1 26 CYS O O 7.342 16.064 13.058 1.00 . A A . 26 CYS O 1 1 15 8454 1 1 26 CYS SG S 4.416 14.625 10.113 1.00 . A A . 26 CYS SG 1 1 15 8455 1 1 27 PRO C C 7.461 18.436 10.976 1.00 . A A . 27 PRO C 1 1 15 8456 1 1 27 PRO CA C 8.492 17.328 10.811 1.00 . A A . 27 PRO CA 1 1 15 8457 1 1 27 PRO CB C 9.141 17.385 9.430 1.00 . A A . 27 PRO CB 1 1 15 8458 1 1 27 PRO CD C 7.814 15.411 9.557 1.00 . A A . 27 PRO CD 1 1 15 8459 1 1 27 PRO CG C 8.178 16.523 8.576 1.00 . A A . 27 PRO CG 1 1 15 8460 1 1 27 PRO HA H 9.250 17.410 11.590 1.00 . A A . 27 PRO HA 1 1 15 8461 1 1 27 PRO HB2 H 9.205 18.402 9.044 1.00 . A A . 27 PRO HB2 1 1 15 8462 1 1 27 PRO HB3 H 10.129 16.928 9.478 1.00 . A A . 27 PRO HB3 1 1 15 8463 1 1 27 PRO HD2 H 6.833 14.995 9.327 1.00 . A A . 27 PRO HD2 1 1 15 8464 1 1 27 PRO HD3 H 8.574 14.629 9.528 1.00 . A A . 27 PRO HD3 1 1 15 8465 1 1 27 PRO HG2 H 7.264 16.972 8.187 1.00 . A A . 27 PRO HG2 1 1 15 8466 1 1 27 PRO HG3 H 8.809 16.167 7.761 1.00 . A A . 27 PRO HG3 1 1 15 8467 1 1 27 PRO N N 7.834 16.041 10.859 1.00 . A A . 27 PRO N 1 1 15 8468 1 1 27 PRO O O 7.843 19.605 10.997 1.00 . A A . 27 PRO O 1 1 15 8469 1 1 28 VAL C C 4.576 18.950 12.666 1.00 . A A . 28 VAL C 1 1 15 8470 1 1 28 VAL CA C 5.134 19.036 11.244 1.00 . A A . 28 VAL CA 1 1 15 8471 1 1 28 VAL CB C 4.065 18.828 10.170 1.00 . A A . 28 VAL CB 1 1 15 8472 1 1 28 VAL CG1 C 2.944 19.859 10.304 1.00 . A A . 28 VAL CG1 1 1 15 8473 1 1 28 VAL CG2 C 4.681 18.867 8.769 1.00 . A A . 28 VAL CG2 1 1 15 8474 1 1 28 VAL H H 5.893 17.105 11.067 1.00 . A A . 28 VAL H 1 1 15 8475 1 1 28 VAL HA H 5.571 20.024 11.098 1.00 . A A . 28 VAL HA 1 1 15 8476 1 1 28 VAL HB H 3.631 17.839 10.316 1.00 . A A . 28 VAL HB 1 1 15 8477 1 1 28 VAL HG11 H 2.386 19.672 11.221 1.00 . A A . 28 VAL HG11 1 1 15 8478 1 1 28 VAL HG12 H 3.373 20.860 10.338 1.00 . A A . 28 VAL HG12 1 1 15 8479 1 1 28 VAL HG13 H 2.273 19.781 9.448 1.00 . A A . 28 VAL HG13 1 1 15 8480 1 1 28 VAL HG21 H 4.581 17.887 8.301 1.00 . A A . 28 VAL HG21 1 1 15 8481 1 1 28 VAL HG22 H 4.164 19.611 8.165 1.00 . A A . 28 VAL HG22 1 1 15 8482 1 1 28 VAL HG23 H 5.736 19.128 8.843 1.00 . A A . 28 VAL HG23 1 1 15 8483 1 1 28 VAL N N 6.196 18.057 11.085 1.00 . A A . 28 VAL N 1 1 15 8484 1 1 28 VAL O O 5.079 19.609 13.575 1.00 . A A . 28 VAL O 1 1 15 8485 1 1 29 CYS C C 4.006 17.663 15.142 1.00 . A A . 29 CYS C 1 1 15 8486 1 1 29 CYS CA C 2.913 17.952 14.111 1.00 . A A . 29 CYS CA 1 1 15 8487 1 1 29 CYS CB C 1.855 16.847 14.075 1.00 . A A . 29 CYS CB 1 1 15 8488 1 1 29 CYS H H 3.141 17.600 12.070 1.00 . A A . 29 CYS H 1 1 15 8489 1 1 29 CYS HA H 2.400 18.885 14.342 1.00 . A A . 29 CYS HA 1 1 15 8490 1 1 29 CYS HB2 H 1.457 16.712 15.082 1.00 . A A . 29 CYS HB2 1 1 15 8491 1 1 29 CYS HB3 H 1.027 17.175 13.447 1.00 . A A . 29 CYS HB3 1 1 15 8492 1 1 29 CYS N N 3.544 18.132 12.815 1.00 . A A . 29 CYS N 1 1 15 8493 1 1 29 CYS O O 4.044 18.285 16.202 1.00 . A A . 29 CYS O 1 1 15 8494 1 1 29 CYS SG S 2.453 15.231 13.460 1.00 . A A . 29 CYS SG 1 1 15 8495 1 1 30 GLY C C 5.709 14.963 16.296 1.00 . A A . 30 GLY C 1 1 15 8496 1 1 30 GLY CA C 5.959 16.339 15.676 1.00 . A A . 30 GLY CA 1 1 15 8497 1 1 30 GLY H H 4.829 16.217 13.930 1.00 . A A . 30 GLY H 1 1 15 8498 1 1 30 GLY HA2 H 6.894 16.326 15.118 1.00 . A A . 30 GLY HA2 1 1 15 8499 1 1 30 GLY HA3 H 6.068 17.083 16.465 1.00 . A A . 30 GLY HA3 1 1 15 8500 1 1 30 GLY N N 4.867 16.718 14.794 1.00 . A A . 30 GLY N 1 1 15 8501 1 1 30 GLY O O 6.604 14.382 16.907 1.00 . A A . 30 GLY O 1 1 15 8502 1 1 31 ALA C C 5.133 12.137 16.211 1.00 . A A . 31 ALA C 1 1 15 8503 1 1 31 ALA CA C 4.109 13.184 16.653 1.00 . A A . 31 ALA CA 1 1 15 8504 1 1 31 ALA CB C 2.689 12.839 16.198 1.00 . A A . 31 ALA CB 1 1 15 8505 1 1 31 ALA H H 3.765 14.961 15.619 1.00 . A A . 31 ALA H 1 1 15 8506 1 1 31 ALA HA H 4.121 13.257 17.740 1.00 . A A . 31 ALA HA 1 1 15 8507 1 1 31 ALA HB1 H 2.386 11.892 16.643 1.00 . A A . 31 ALA HB1 1 1 15 8508 1 1 31 ALA HB2 H 2.005 13.626 16.514 1.00 . A A . 31 ALA HB2 1 1 15 8509 1 1 31 ALA HB3 H 2.667 12.753 15.111 1.00 . A A . 31 ALA HB3 1 1 15 8510 1 1 31 ALA N N 4.488 14.482 16.118 1.00 . A A . 31 ALA N 1 1 15 8511 1 1 31 ALA O O 5.937 12.389 15.315 1.00 . A A . 31 ALA O 1 1 15 8512 1 1 32 SER C C 5.603 9.264 15.208 1.00 . A A . 32 SER C 1 1 15 8513 1 1 32 SER CA C 5.984 9.898 16.549 1.00 . A A . 32 SER CA 1 1 15 8514 1 1 32 SER CB C 5.983 8.841 17.654 1.00 . A A . 32 SER CB 1 1 15 8515 1 1 32 SER H H 4.415 10.788 17.590 1.00 . A A . 32 SER H 1 1 15 8516 1 1 32 SER HA H 6.971 10.358 16.487 1.00 . A A . 32 SER HA 1 1 15 8517 1 1 32 SER HB2 H 6.958 8.354 17.691 1.00 . A A . 32 SER HB2 1 1 15 8518 1 1 32 SER HB3 H 5.833 9.326 18.619 1.00 . A A . 32 SER HB3 1 1 15 8519 1 1 32 SER HG H 4.236 8.236 16.888 1.00 . A A . 32 SER HG 1 1 15 8520 1 1 32 SER N N 5.072 10.984 16.862 1.00 . A A . 32 SER N 1 1 15 8521 1 1 32 SER O O 4.623 9.669 14.584 1.00 . A A . 32 SER O 1 1 15 8522 1 1 32 SER OG O 4.970 7.859 17.454 1.00 . A A . 32 SER OG 1 1 15 8523 1 1 33 LYS C C 4.919 6.699 13.699 1.00 . A A . 33 LYS C 1 1 15 8524 1 1 33 LYS CA C 6.155 7.590 13.554 1.00 . A A . 33 LYS CA 1 1 15 8525 1 1 33 LYS CB C 7.408 6.834 13.108 1.00 . A A . 33 LYS CB 1 1 15 8526 1 1 33 LYS CD C 8.576 4.600 13.044 1.00 . A A . 33 LYS CD 1 1 15 8527 1 1 33 LYS CE C 8.561 3.161 13.564 1.00 . A A . 33 LYS CE 1 1 15 8528 1 1 33 LYS CG C 7.319 5.354 13.485 1.00 . A A . 33 LYS CG 1 1 15 8529 1 1 33 LYS H H 7.191 7.960 15.321 1.00 . A A . 33 LYS H 1 1 15 8530 1 1 33 LYS HA H 5.949 8.346 12.796 1.00 . A A . 33 LYS HA 1 1 15 8531 1 1 33 LYS HB2 H 7.532 6.932 12.030 1.00 . A A . 33 LYS HB2 1 1 15 8532 1 1 33 LYS HB3 H 8.289 7.279 13.571 1.00 . A A . 33 LYS HB3 1 1 15 8533 1 1 33 LYS HD2 H 8.640 4.597 11.956 1.00 . A A . 33 LYS HD2 1 1 15 8534 1 1 33 LYS HD3 H 9.462 5.116 13.414 1.00 . A A . 33 LYS HD3 1 1 15 8535 1 1 33 LYS HE2 H 7.563 2.906 13.919 1.00 . A A . 33 LYS HE2 1 1 15 8536 1 1 33 LYS HE3 H 8.796 2.472 12.751 1.00 . A A . 33 LYS HE3 1 1 15 8537 1 1 33 LYS HG2 H 7.191 5.256 14.562 1.00 . A A . 33 LYS HG2 1 1 15 8538 1 1 33 LYS HG3 H 6.441 4.909 13.017 1.00 . A A . 33 LYS HG3 1 1 15 8539 1 1 33 LYS HZ1 H 10.078 2.140 14.564 1.00 . A A . 33 LYS HZ1 1 1 15 8540 1 1 33 LYS HZ2 H 10.210 3.759 14.690 1.00 . A A . 33 LYS HZ2 1 1 15 8541 1 1 33 LYS N N 6.397 8.283 14.807 1.00 . A A . 33 LYS N 1 1 15 8542 1 1 33 LYS NZ N 9.542 2.995 14.660 1.00 . A A . 33 LYS NZ 1 1 15 8543 1 1 33 LYS O O 4.357 6.244 12.704 1.00 . A A . 33 LYS O 1 1 15 8544 1 1 34 ASP C C 2.102 6.404 14.840 1.00 . A A . 34 ASP C 1 1 15 8545 1 1 34 ASP CA C 3.373 5.649 15.234 1.00 . A A . 34 ASP CA 1 1 15 8546 1 1 34 ASP CB C 3.287 5.323 16.726 1.00 . A A . 34 ASP CB 1 1 15 8547 1 1 34 ASP CG C 2.805 6.474 17.612 1.00 . A A . 34 ASP CG 1 1 15 8548 1 1 34 ASP H H 4.994 6.851 15.750 1.00 . A A . 34 ASP H 1 1 15 8549 1 1 34 ASP HA H 3.518 4.741 14.648 1.00 . A A . 34 ASP HA 1 1 15 8550 1 1 34 ASP HB2 H 2.613 4.476 16.859 1.00 . A A . 34 ASP HB2 1 1 15 8551 1 1 34 ASP HB3 H 4.270 5.005 17.071 1.00 . A A . 34 ASP HB3 1 1 15 8552 1 1 34 ASP HD2 H 3.551 5.661 19.138 1.00 . A A . 34 ASP HD2 1 1 15 8553 1 1 34 ASP N N 4.532 6.477 14.946 1.00 . A A . 34 ASP N 1 1 15 8554 1 1 34 ASP O O 1.031 5.809 14.731 1.00 . A A . 34 ASP O 1 1 15 8555 1 1 34 ASP OD1 O 2.491 7.569 17.122 1.00 . A A . 34 ASP OD1 1 1 15 8556 1 1 34 ASP OD2 O 2.757 6.207 18.874 1.00 . A A . 34 ASP OD2 1 1 15 8557 1 1 35 ALA C C 0.812 8.314 12.780 1.00 . A A . 35 ALA C 1 1 15 8558 1 1 35 ALA CA C 1.141 8.545 14.255 1.00 . A A . 35 ALA CA 1 1 15 8559 1 1 35 ALA CB C 1.476 10.007 14.557 1.00 . A A . 35 ALA CB 1 1 15 8560 1 1 35 ALA H H 3.137 8.179 14.725 1.00 . A A . 35 ALA H 1 1 15 8561 1 1 35 ALA HA H 0.284 8.249 14.860 1.00 . A A . 35 ALA HA 1 1 15 8562 1 1 35 ALA HB1 H 2.394 10.284 14.038 1.00 . A A . 35 ALA HB1 1 1 15 8563 1 1 35 ALA HB2 H 0.659 10.644 14.215 1.00 . A A . 35 ALA HB2 1 1 15 8564 1 1 35 ALA HB3 H 1.611 10.136 15.630 1.00 . A A . 35 ALA HB3 1 1 15 8565 1 1 35 ALA N N 2.262 7.703 14.635 1.00 . A A . 35 ALA N 1 1 15 8566 1 1 35 ALA O O -0.203 8.799 12.282 1.00 . A A . 35 ALA O 1 1 15 8567 1 1 36 PHE C C 0.874 5.890 10.523 1.00 . A A . 36 PHE C 1 1 15 8568 1 1 36 PHE CA C 1.506 7.271 10.711 1.00 . A A . 36 PHE CA 1 1 15 8569 1 1 36 PHE CB C 2.894 7.276 10.066 1.00 . A A . 36 PHE CB 1 1 15 8570 1 1 36 PHE CD1 C 3.738 9.415 11.058 1.00 . A A . 36 PHE CD1 1 1 15 8571 1 1 36 PHE CD2 C 3.850 9.158 8.720 1.00 . A A . 36 PHE CD2 1 1 15 8572 1 1 36 PHE CE1 C 4.317 10.707 10.944 1.00 . A A . 36 PHE CE1 1 1 15 8573 1 1 36 PHE CE2 C 4.429 10.450 8.604 1.00 . A A . 36 PHE CE2 1 1 15 8574 1 1 36 PHE CG C 3.518 8.668 9.943 1.00 . A A . 36 PHE CG 1 1 15 8575 1 1 36 PHE CZ C 4.650 11.196 9.720 1.00 . A A . 36 PHE CZ 1 1 15 8576 1 1 36 PHE H H 2.513 7.182 12.532 1.00 . A A . 36 PHE H 1 1 15 8577 1 1 36 PHE HA H 0.840 8.031 10.302 1.00 . A A . 36 PHE HA 1 1 15 8578 1 1 36 PHE HB2 H 3.558 6.642 10.654 1.00 . A A . 36 PHE HB2 1 1 15 8579 1 1 36 PHE HB3 H 2.824 6.831 9.074 1.00 . A A . 36 PHE HB3 1 1 15 8580 1 1 36 PHE HD1 H 3.471 9.022 12.040 1.00 . A A . 36 PHE HD1 1 1 15 8581 1 1 36 PHE HD2 H 3.673 8.559 7.826 1.00 . A A . 36 PHE HD2 1 1 15 8582 1 1 36 PHE HE1 H 4.494 11.306 11.837 1.00 . A A . 36 PHE HE1 1 1 15 8583 1 1 36 PHE HE2 H 4.696 10.843 7.624 1.00 . A A . 36 PHE HE2 1 1 15 8584 1 1 36 PHE HZ H 5.094 12.188 9.632 1.00 . A A . 36 PHE HZ 1 1 15 8585 1 1 36 PHE N N 1.690 7.572 12.119 1.00 . A A . 36 PHE N 1 1 15 8586 1 1 36 PHE O O 1.184 4.956 11.262 1.00 . A A . 36 PHE O 1 1 15 8587 1 1 37 GLU C C -0.275 4.043 7.850 1.00 . A A . 37 GLU C 1 1 15 8588 1 1 37 GLU CA C -0.675 4.552 9.236 1.00 . A A . 37 GLU CA 1 1 15 8589 1 1 37 GLU CB C -2.194 4.710 9.344 1.00 . A A . 37 GLU CB 1 1 15 8590 1 1 37 GLU CD C -4.018 3.393 10.483 1.00 . A A . 37 GLU CD 1 1 15 8591 1 1 37 GLU CG C -2.881 3.348 9.460 1.00 . A A . 37 GLU CG 1 1 15 8592 1 1 37 GLU H H -0.246 6.567 8.934 1.00 . A A . 37 GLU H 1 1 15 8593 1 1 37 GLU HA H -0.335 3.851 10.000 1.00 . A A . 37 GLU HA 1 1 15 8594 1 1 37 GLU HB2 H -2.439 5.320 10.215 1.00 . A A . 37 GLU HB2 1 1 15 8595 1 1 37 GLU HB3 H -2.571 5.240 8.469 1.00 . A A . 37 GLU HB3 1 1 15 8596 1 1 37 GLU HE2 H -5.848 3.153 10.107 1.00 . A A . 37 GLU HE2 1 1 15 8597 1 1 37 GLU HG2 H -3.273 3.051 8.488 1.00 . A A . 37 GLU HG2 1 1 15 8598 1 1 37 GLU HG3 H -2.152 2.593 9.753 1.00 . A A . 37 GLU HG3 1 1 15 8599 1 1 37 GLU N N 0.001 5.803 9.531 1.00 . A A . 37 GLU N 1 1 15 8600 1 1 37 GLU O O -0.554 4.692 6.843 1.00 . A A . 37 GLU O 1 1 15 8601 1 1 37 GLU OE1 O -3.937 4.141 11.468 1.00 . A A . 37 GLU OE1 1 1 15 8602 1 1 37 GLU OE2 O -5.014 2.615 10.225 1.00 . A A . 37 GLU OE2 1 1 15 8603 1 1 38 LYS C C -0.385 2.117 5.663 1.00 . A A . 38 LYS C 1 1 15 8604 1 1 38 LYS CA C 0.816 2.286 6.597 1.00 . A A . 38 LYS CA 1 1 15 8605 1 1 38 LYS CB C 1.571 0.984 6.869 1.00 . A A . 38 LYS CB 1 1 15 8606 1 1 38 LYS CD C 1.497 -0.301 4.700 1.00 . A A . 38 LYS CD 1 1 15 8607 1 1 38 LYS CE C 1.926 -1.769 4.728 1.00 . A A . 38 LYS CE 1 1 15 8608 1 1 38 LYS CG C 2.364 0.542 5.637 1.00 . A A . 38 LYS CG 1 1 15 8609 1 1 38 LYS H H 0.596 2.367 8.666 1.00 . A A . 38 LYS H 1 1 15 8610 1 1 38 LYS HA H 1.520 2.976 6.132 1.00 . A A . 38 LYS HA 1 1 15 8611 1 1 38 LYS HB2 H 2.248 1.121 7.712 1.00 . A A . 38 LYS HB2 1 1 15 8612 1 1 38 LYS HB3 H 0.865 0.202 7.151 1.00 . A A . 38 LYS HB3 1 1 15 8613 1 1 38 LYS HD2 H 0.451 -0.218 4.993 1.00 . A A . 38 LYS HD2 1 1 15 8614 1 1 38 LYS HD3 H 1.574 0.085 3.683 1.00 . A A . 38 LYS HD3 1 1 15 8615 1 1 38 LYS HE2 H 2.732 -1.933 4.013 1.00 . A A . 38 LYS HE2 1 1 15 8616 1 1 38 LYS HE3 H 2.320 -2.020 5.714 1.00 . A A . 38 LYS HE3 1 1 15 8617 1 1 38 LYS HG2 H 2.735 1.419 5.106 1.00 . A A . 38 LYS HG2 1 1 15 8618 1 1 38 LYS HG3 H 3.235 -0.034 5.949 1.00 . A A . 38 LYS HG3 1 1 15 8619 1 1 38 LYS HZ1 H 0.001 -2.132 4.020 1.00 . A A . 38 LYS HZ1 1 1 15 8620 1 1 38 LYS HZ2 H 1.029 -3.359 3.724 1.00 . A A . 38 LYS HZ2 1 1 15 8621 1 1 38 LYS N N 0.373 2.888 7.842 1.00 . A A . 38 LYS N 1 1 15 8622 1 1 38 LYS NZ N 0.782 -2.650 4.405 1.00 . A A . 38 LYS NZ 1 1 15 8623 1 1 38 LYS O O -1.400 1.540 6.049 1.00 . A A . 38 LYS O 1 1 15 8624 1 1 39 GLN C C -0.705 2.185 2.092 1.00 . A A . 39 GLN C 1 1 15 8625 1 1 39 GLN CA C -1.288 2.544 3.460 1.00 . A A . 39 GLN CA 1 1 15 8626 1 1 39 GLN CB C -2.083 3.850 3.392 1.00 . A A . 39 GLN CB 1 1 15 8627 1 1 39 GLN CD C -4.306 4.304 4.490 1.00 . A A . 39 GLN CD 1 1 15 8628 1 1 39 GLN CG C -3.587 3.574 3.355 1.00 . A A . 39 GLN CG 1 1 15 8629 1 1 39 GLN H H 0.600 3.099 4.146 1.00 . A A . 39 GLN H 1 1 15 8630 1 1 39 GLN HA H -1.943 1.745 3.805 1.00 . A A . 39 GLN HA 1 1 15 8631 1 1 39 GLN HB2 H -1.844 4.471 4.254 1.00 . A A . 39 GLN HB2 1 1 15 8632 1 1 39 GLN HB3 H -1.790 4.412 2.504 1.00 . A A . 39 GLN HB3 1 1 15 8633 1 1 39 GLN HE21 H -4.006 6.044 3.500 1.00 . A A . 39 GLN HE21 1 1 15 8634 1 1 39 GLN HE22 H -4.846 6.185 5.008 1.00 . A A . 39 GLN HE22 1 1 15 8635 1 1 39 GLN HG2 H -3.996 3.894 2.396 1.00 . A A . 39 GLN HG2 1 1 15 8636 1 1 39 GLN HG3 H -3.766 2.501 3.435 1.00 . A A . 39 GLN HG3 1 1 15 8637 1 1 39 GLN N N -0.229 2.631 4.452 1.00 . A A . 39 GLN N 1 1 15 8638 1 1 39 GLN NE2 N -4.394 5.620 4.319 1.00 . A A . 39 GLN NE2 1 1 15 8639 1 1 39 GLN O O -0.116 1.118 1.925 1.00 . A A . 39 GLN O 1 1 15 8640 1 1 39 GLN OE1 O -4.754 3.711 5.459 1.00 . A A . 39 GLN OE1 1 1 16 8641 1 1 1 MET C C 3.246 2.083 -1.609 1.00 . A A . 1 MET C 1 1 16 8642 1 1 1 MET CA C 2.935 1.687 -3.054 1.00 . A A . 1 MET CA 1 1 16 8643 1 1 1 MET CB C 2.685 0.180 -3.128 1.00 . A A . 1 MET CB 1 1 16 8644 1 1 1 MET CE C 0.244 -2.241 -5.245 1.00 . A A . 1 MET CE 1 1 16 8645 1 1 1 MET CG C 1.741 -0.164 -4.282 1.00 . A A . 1 MET CG 1 1 16 8646 1 1 1 MET H1 H 4.640 2.755 -3.592 1.00 . A A . 1 MET H1 1 1 16 8647 1 1 1 MET HA H 2.075 2.250 -3.415 1.00 . A A . 1 MET HA 1 1 16 8648 1 1 1 MET HB2 H 3.632 -0.344 -3.260 1.00 . A A . 1 MET HB2 1 1 16 8649 1 1 1 MET HB3 H 2.257 -0.168 -2.188 1.00 . A A . 1 MET HB3 1 1 16 8650 1 1 1 MET HE1 H -0.040 -3.235 -4.901 1.00 . A A . 1 MET HE1 1 1 16 8651 1 1 1 MET HE2 H -0.435 -1.502 -4.819 1.00 . A A . 1 MET HE2 1 1 16 8652 1 1 1 MET HE3 H 0.188 -2.202 -6.331 1.00 . A A . 1 MET HE3 1 1 16 8653 1 1 1 MET HG2 H 0.711 0.046 -3.995 1.00 . A A . 1 MET HG2 1 1 16 8654 1 1 1 MET HG3 H 1.965 0.464 -5.146 1.00 . A A . 1 MET HG3 1 1 16 8655 1 1 1 MET N N 4.032 2.041 -3.938 1.00 . A A . 1 MET N 1 1 16 8656 1 1 1 MET O O 2.448 2.760 -0.962 1.00 . A A . 1 MET O 1 1 16 8657 1 1 1 MET SD S 1.913 -1.885 -4.721 1.00 . A A . 1 MET SD 1 1 16 8658 1 1 2 ASP C C 4.710 3.448 0.458 1.00 . A A . 2 ASP C 1 1 16 8659 1 1 2 ASP CA C 4.833 1.943 0.211 1.00 . A A . 2 ASP CA 1 1 16 8660 1 1 2 ASP CB C 6.294 1.545 0.430 1.00 . A A . 2 ASP CB 1 1 16 8661 1 1 2 ASP CG C 6.541 0.041 0.560 1.00 . A A . 2 ASP CG 1 1 16 8662 1 1 2 ASP H H 5.049 1.094 -1.679 1.00 . A A . 2 ASP H 1 1 16 8663 1 1 2 ASP HA H 4.172 1.360 0.854 1.00 . A A . 2 ASP HA 1 1 16 8664 1 1 2 ASP HB2 H 6.886 1.925 -0.402 1.00 . A A . 2 ASP HB2 1 1 16 8665 1 1 2 ASP HB3 H 6.656 2.037 1.332 1.00 . A A . 2 ASP HB3 1 1 16 8666 1 1 2 ASP HD2 H 7.265 -0.320 -1.141 1.00 . A A . 2 ASP HD2 1 1 16 8667 1 1 2 ASP N N 4.407 1.643 -1.146 1.00 . A A . 2 ASP N 1 1 16 8668 1 1 2 ASP O O 5.478 4.236 -0.094 1.00 . A A . 2 ASP O 1 1 16 8669 1 1 2 ASP OD1 O 6.749 -0.479 1.666 1.00 . A A . 2 ASP OD1 1 1 16 8670 1 1 2 ASP OD2 O 6.513 -0.615 -0.551 1.00 . A A . 2 ASP OD2 1 1 16 8671 1 1 3 ILE C C 3.270 5.333 3.120 1.00 . A A . 3 ILE C 1 1 16 8672 1 1 3 ILE CA C 3.508 5.199 1.615 1.00 . A A . 3 ILE CA 1 1 16 8673 1 1 3 ILE CB C 2.374 5.769 0.760 1.00 . A A . 3 ILE CB 1 1 16 8674 1 1 3 ILE CD1 C 1.458 5.716 -1.589 1.00 . A A . 3 ILE CD1 1 1 16 8675 1 1 3 ILE CG1 C 2.723 5.700 -0.728 1.00 . A A . 3 ILE CG1 1 1 16 8676 1 1 3 ILE CG2 C 2.017 7.189 1.200 1.00 . A A . 3 ILE CG2 1 1 16 8677 1 1 3 ILE H H 3.121 3.156 1.733 1.00 . A A . 3 ILE H 1 1 16 8678 1 1 3 ILE HA H 4.414 5.750 1.358 1.00 . A A . 3 ILE HA 1 1 16 8679 1 1 3 ILE HB H 1.489 5.151 0.912 1.00 . A A . 3 ILE HB 1 1 16 8680 1 1 3 ILE HD11 H 1.735 5.768 -2.642 1.00 . A A . 3 ILE HD11 1 1 16 8681 1 1 3 ILE HD12 H 0.885 4.806 -1.409 1.00 . A A . 3 ILE HD12 1 1 16 8682 1 1 3 ILE HD13 H 0.853 6.584 -1.329 1.00 . A A . 3 ILE HD13 1 1 16 8683 1 1 3 ILE HG12 H 3.360 6.544 -0.996 1.00 . A A . 3 ILE HG12 1 1 16 8684 1 1 3 ILE HG13 H 3.293 4.794 -0.931 1.00 . A A . 3 ILE HG13 1 1 16 8685 1 1 3 ILE HG21 H 0.932 7.302 1.218 1.00 . A A . 3 ILE HG21 1 1 16 8686 1 1 3 ILE HG22 H 2.417 7.373 2.197 1.00 . A A . 3 ILE HG22 1 1 16 8687 1 1 3 ILE HG23 H 2.444 7.906 0.499 1.00 . A A . 3 ILE HG23 1 1 16 8688 1 1 3 ILE N N 3.741 3.803 1.288 1.00 . A A . 3 ILE N 1 1 16 8689 1 1 3 ILE O O 2.589 4.526 3.748 1.00 . A A . 3 ILE O 1 1 16 8690 1 1 4 TYR C C 3.081 8.016 5.324 1.00 . A A . 4 TYR C 1 1 16 8691 1 1 4 TYR CA C 3.729 6.654 5.111 1.00 . A A . 4 TYR CA 1 1 16 8692 1 1 4 TYR CB C 5.108 6.604 5.763 1.00 . A A . 4 TYR CB 1 1 16 8693 1 1 4 TYR CD1 C 5.107 4.416 7.014 1.00 . A A . 4 TYR CD1 1 1 16 8694 1 1 4 TYR CD2 C 6.615 4.684 5.134 1.00 . A A . 4 TYR CD2 1 1 16 8695 1 1 4 TYR CE1 C 5.583 3.115 7.212 1.00 . A A . 4 TYR CE1 1 1 16 8696 1 1 4 TYR CE2 C 7.092 3.382 5.332 1.00 . A A . 4 TYR CE2 1 1 16 8697 1 1 4 TYR CG C 5.622 5.200 5.976 1.00 . A A . 4 TYR CG 1 1 16 8698 1 1 4 TYR CZ C 6.577 2.597 6.370 1.00 . A A . 4 TYR CZ 1 1 16 8699 1 1 4 TYR H H 4.406 7.022 3.132 1.00 . A A . 4 TYR H 1 1 16 8700 1 1 4 TYR HA H 3.097 5.888 5.560 1.00 . A A . 4 TYR HA 1 1 16 8701 1 1 4 TYR HB2 H 5.812 7.141 5.127 1.00 . A A . 4 TYR HB2 1 1 16 8702 1 1 4 TYR HB3 H 5.055 7.106 6.729 1.00 . A A . 4 TYR HB3 1 1 16 8703 1 1 4 TYR HD1 H 4.341 4.814 7.664 1.00 . A A . 4 TYR HD1 1 1 16 8704 1 1 4 TYR HD2 H 7.013 5.289 4.333 1.00 . A A . 4 TYR HD2 1 1 16 8705 1 1 4 TYR HE1 H 5.185 2.509 8.013 1.00 . A A . 4 TYR HE1 1 1 16 8706 1 1 4 TYR HE2 H 7.857 2.983 4.683 1.00 . A A . 4 TYR HE2 1 1 16 8707 1 1 4 TYR HH H 7.809 1.126 6.026 1.00 . A A . 4 TYR HH 1 1 16 8708 1 1 4 TYR N N 3.856 6.387 3.693 1.00 . A A . 4 TYR N 1 1 16 8709 1 1 4 TYR O O 3.802 9.003 5.456 1.00 . A A . 4 TYR O 1 1 16 8710 1 1 4 TYR OH O 7.040 1.330 6.563 1.00 . A A . 4 TYR OH 1 1 16 8711 1 1 5 VAL C C 0.687 9.443 7.034 1.00 . A A . 5 VAL C 1 1 16 8712 1 1 5 VAL CA C 1.039 9.291 5.552 1.00 . A A . 5 VAL CA 1 1 16 8713 1 1 5 VAL CB C -0.187 9.341 4.638 1.00 . A A . 5 VAL CB 1 1 16 8714 1 1 5 VAL CG1 C -0.864 10.712 4.703 1.00 . A A . 5 VAL CG1 1 1 16 8715 1 1 5 VAL CG2 C 0.187 8.982 3.200 1.00 . A A . 5 VAL CG2 1 1 16 8716 1 1 5 VAL H H 1.177 7.236 5.246 1.00 . A A . 5 VAL H 1 1 16 8717 1 1 5 VAL HA H 1.706 10.104 5.265 1.00 . A A . 5 VAL HA 1 1 16 8718 1 1 5 VAL HB H -0.901 8.598 4.995 1.00 . A A . 5 VAL HB 1 1 16 8719 1 1 5 VAL HG11 H -0.499 11.257 5.574 1.00 . A A . 5 VAL HG11 1 1 16 8720 1 1 5 VAL HG12 H -0.632 11.275 3.799 1.00 . A A . 5 VAL HG12 1 1 16 8721 1 1 5 VAL HG13 H -1.943 10.581 4.784 1.00 . A A . 5 VAL HG13 1 1 16 8722 1 1 5 VAL HG21 H -0.716 8.747 2.636 1.00 . A A . 5 VAL HG21 1 1 16 8723 1 1 5 VAL HG22 H 0.696 9.826 2.734 1.00 . A A . 5 VAL HG22 1 1 16 8724 1 1 5 VAL HG23 H 0.848 8.116 3.201 1.00 . A A . 5 VAL HG23 1 1 16 8725 1 1 5 VAL N N 1.756 8.044 5.354 1.00 . A A . 5 VAL N 1 1 16 8726 1 1 5 VAL O O 0.120 8.533 7.637 1.00 . A A . 5 VAL O 1 1 16 8727 1 1 6 CYS C C -0.751 10.987 9.159 1.00 . A A . 6 CYS C 1 1 16 8728 1 1 6 CYS CA C 0.765 10.882 8.976 1.00 . A A . 6 CYS CA 1 1 16 8729 1 1 6 CYS CB C 1.485 12.146 9.449 1.00 . A A . 6 CYS CB 1 1 16 8730 1 1 6 CYS H H 1.497 11.335 7.079 1.00 . A A . 6 CYS H 1 1 16 8731 1 1 6 CYS HA H 1.167 10.046 9.548 1.00 . A A . 6 CYS HA 1 1 16 8732 1 1 6 CYS HB2 H 2.515 12.115 9.093 1.00 . A A . 6 CYS HB2 1 1 16 8733 1 1 6 CYS HB3 H 1.013 13.012 8.985 1.00 . A A . 6 CYS HB3 1 1 16 8734 1 1 6 CYS N N 1.037 10.600 7.577 1.00 . A A . 6 CYS N 1 1 16 8735 1 1 6 CYS O O -1.461 11.413 8.251 1.00 . A A . 6 CYS O 1 1 16 8736 1 1 6 CYS SG S 1.500 12.388 11.263 1.00 . A A . 6 CYS SG 1 1 16 8737 1 1 7 THR C C -2.910 11.761 11.648 1.00 . A A . 7 THR C 1 1 16 8738 1 1 7 THR CA C -2.618 10.634 10.654 1.00 . A A . 7 THR CA 1 1 16 8739 1 1 7 THR CB C -3.033 9.253 11.164 1.00 . A A . 7 THR CB 1 1 16 8740 1 1 7 THR CG2 C -2.565 8.123 10.244 1.00 . A A . 7 THR CG2 1 1 16 8741 1 1 7 THR H H -0.616 10.244 11.075 1.00 . A A . 7 THR H 1 1 16 8742 1 1 7 THR HA H -3.166 10.864 9.740 1.00 . A A . 7 THR HA 1 1 16 8743 1 1 7 THR HB H -4.110 9.204 11.324 1.00 . A A . 7 THR HB 1 1 16 8744 1 1 7 THR HG1 H -2.503 9.777 13.021 1.00 . A A . 7 THR HG1 1 1 16 8745 1 1 7 THR HG21 H -3.322 7.938 9.482 1.00 . A A . 7 THR HG21 1 1 16 8746 1 1 7 THR HG22 H -1.630 8.411 9.763 1.00 . A A . 7 THR HG22 1 1 16 8747 1 1 7 THR HG23 H -2.408 7.218 10.829 1.00 . A A . 7 THR HG23 1 1 16 8748 1 1 7 THR N N -1.201 10.590 10.341 1.00 . A A . 7 THR N 1 1 16 8749 1 1 7 THR O O -3.950 11.760 12.304 1.00 . A A . 7 THR O 1 1 16 8750 1 1 7 THR OG1 O -2.264 9.075 12.351 1.00 . A A . 7 THR OG1 1 1 16 8751 1 1 8 VAL C C -2.262 15.110 11.810 1.00 . A A . 8 VAL C 1 1 16 8752 1 1 8 VAL CA C -2.117 13.825 12.628 1.00 . A A . 8 VAL CA 1 1 16 8753 1 1 8 VAL CB C -0.940 13.868 13.604 1.00 . A A . 8 VAL CB 1 1 16 8754 1 1 8 VAL CG1 C -0.989 15.130 14.468 1.00 . A A . 8 VAL CG1 1 1 16 8755 1 1 8 VAL CG2 C -0.902 12.609 14.473 1.00 . A A . 8 VAL CG2 1 1 16 8756 1 1 8 VAL H H -1.130 12.687 11.188 1.00 . A A . 8 VAL H 1 1 16 8757 1 1 8 VAL HA H -3.028 13.671 13.205 1.00 . A A . 8 VAL HA 1 1 16 8758 1 1 8 VAL HB H -0.021 13.899 13.019 1.00 . A A . 8 VAL HB 1 1 16 8759 1 1 8 VAL HG11 H -1.659 14.965 15.312 1.00 . A A . 8 VAL HG11 1 1 16 8760 1 1 8 VAL HG12 H 0.011 15.358 14.836 1.00 . A A . 8 VAL HG12 1 1 16 8761 1 1 8 VAL HG13 H -1.357 15.964 13.871 1.00 . A A . 8 VAL HG13 1 1 16 8762 1 1 8 VAL HG21 H 0.125 12.251 14.548 1.00 . A A . 8 VAL HG21 1 1 16 8763 1 1 8 VAL HG22 H -1.279 12.844 15.468 1.00 . A A . 8 VAL HG22 1 1 16 8764 1 1 8 VAL HG23 H -1.524 11.837 14.021 1.00 . A A . 8 VAL HG23 1 1 16 8765 1 1 8 VAL N N -1.974 12.695 11.726 1.00 . A A . 8 VAL N 1 1 16 8766 1 1 8 VAL O O -3.189 15.888 12.029 1.00 . A A . 8 VAL O 1 1 16 8767 1 1 9 CYS C C -1.757 16.036 8.621 1.00 . A A . 9 CYS C 1 1 16 8768 1 1 9 CYS CA C -1.346 16.468 10.030 1.00 . A A . 9 CYS CA 1 1 16 8769 1 1 9 CYS CB C 0.004 17.185 10.036 1.00 . A A . 9 CYS CB 1 1 16 8770 1 1 9 CYS H H -0.584 14.653 10.711 1.00 . A A . 9 CYS H 1 1 16 8771 1 1 9 CYS HA H -2.081 17.154 10.454 1.00 . A A . 9 CYS HA 1 1 16 8772 1 1 9 CYS HB2 H 0.039 17.872 9.190 1.00 . A A . 9 CYS HB2 1 1 16 8773 1 1 9 CYS HB3 H 0.075 17.790 10.940 1.00 . A A . 9 CYS HB3 1 1 16 8774 1 1 9 CYS N N -1.333 15.291 10.882 1.00 . A A . 9 CYS N 1 1 16 8775 1 1 9 CYS O O -2.283 16.839 7.851 1.00 . A A . 9 CYS O 1 1 16 8776 1 1 9 CYS SG S 1.461 16.080 9.954 1.00 . A A . 9 CYS SG 1 1 16 8777 1 1 10 GLY C C -0.679 14.392 6.041 1.00 . A A . 10 GLY C 1 1 16 8778 1 1 10 GLY CA C -1.840 14.222 7.024 1.00 . A A . 10 GLY CA 1 1 16 8779 1 1 10 GLY H H -1.075 14.124 8.960 1.00 . A A . 10 GLY H 1 1 16 8780 1 1 10 GLY HA2 H -2.085 13.165 7.122 1.00 . A A . 10 GLY HA2 1 1 16 8781 1 1 10 GLY HA3 H -2.728 14.721 6.634 1.00 . A A . 10 GLY HA3 1 1 16 8782 1 1 10 GLY N N -1.502 14.769 8.327 1.00 . A A . 10 GLY N 1 1 16 8783 1 1 10 GLY O O -0.849 14.391 4.824 1.00 . A A . 10 GLY O 1 1 16 8784 1 1 11 TYR C C 1.934 13.496 4.925 1.00 . A A . 11 TYR C 1 1 16 8785 1 1 11 TYR CA C 1.721 14.714 5.813 1.00 . A A . 11 TYR CA 1 1 16 8786 1 1 11 TYR CB C 2.916 14.923 6.739 1.00 . A A . 11 TYR CB 1 1 16 8787 1 1 11 TYR CD1 C 4.330 16.287 5.159 1.00 . A A . 11 TYR CD1 1 1 16 8788 1 1 11 TYR CD2 C 5.292 14.304 6.169 1.00 . A A . 11 TYR CD2 1 1 16 8789 1 1 11 TYR CE1 C 5.530 16.522 4.478 1.00 . A A . 11 TYR CE1 1 1 16 8790 1 1 11 TYR CE2 C 6.492 14.540 5.488 1.00 . A A . 11 TYR CE2 1 1 16 8791 1 1 11 TYR CG C 4.210 15.177 6.004 1.00 . A A . 11 TYR CG 1 1 16 8792 1 1 11 TYR CZ C 6.611 15.649 4.642 1.00 . A A . 11 TYR CZ 1 1 16 8793 1 1 11 TYR H H 0.607 14.533 7.612 1.00 . A A . 11 TYR H 1 1 16 8794 1 1 11 TYR HA H 1.604 15.594 5.181 1.00 . A A . 11 TYR HA 1 1 16 8795 1 1 11 TYR HB2 H 2.709 15.775 7.386 1.00 . A A . 11 TYR HB2 1 1 16 8796 1 1 11 TYR HB3 H 3.037 14.034 7.358 1.00 . A A . 11 TYR HB3 1 1 16 8797 1 1 11 TYR HD1 H 3.495 16.961 5.031 1.00 . A A . 11 TYR HD1 1 1 16 8798 1 1 11 TYR HD2 H 5.200 13.448 6.822 1.00 . A A . 11 TYR HD2 1 1 16 8799 1 1 11 TYR HE1 H 5.621 17.378 3.825 1.00 . A A . 11 TYR HE1 1 1 16 8800 1 1 11 TYR HE2 H 7.327 13.865 5.615 1.00 . A A . 11 TYR HE2 1 1 16 8801 1 1 11 TYR HH H 8.359 16.491 4.439 1.00 . A A . 11 TYR HH 1 1 16 8802 1 1 11 TYR N N 0.522 14.540 6.606 1.00 . A A . 11 TYR N 1 1 16 8803 1 1 11 TYR O O 1.287 12.474 5.152 1.00 . A A . 11 TYR O 1 1 16 8804 1 1 11 TYR OH O 7.780 15.878 3.978 1.00 . A A . 11 TYR OH 1 1 16 8805 1 1 12 GLU C C 4.604 12.271 2.956 1.00 . A A . 12 GLU C 1 1 16 8806 1 1 12 GLU CA C 3.097 12.518 3.042 1.00 . A A . 12 GLU CA 1 1 16 8807 1 1 12 GLU CB C 2.505 12.783 1.657 1.00 . A A . 12 GLU CB 1 1 16 8808 1 1 12 GLU CD C 0.218 12.847 0.595 1.00 . A A . 12 GLU CD 1 1 16 8809 1 1 12 GLU CG C 1.176 12.045 1.479 1.00 . A A . 12 GLU CG 1 1 16 8810 1 1 12 GLU H H 3.341 14.456 3.768 1.00 . A A . 12 GLU H 1 1 16 8811 1 1 12 GLU HA H 2.604 11.652 3.482 1.00 . A A . 12 GLU HA 1 1 16 8812 1 1 12 GLU HB2 H 2.352 13.854 1.522 1.00 . A A . 12 GLU HB2 1 1 16 8813 1 1 12 GLU HB3 H 3.209 12.463 0.889 1.00 . A A . 12 GLU HB3 1 1 16 8814 1 1 12 GLU HE2 H -0.792 13.875 1.807 1.00 . A A . 12 GLU HE2 1 1 16 8815 1 1 12 GLU HG2 H 1.357 11.068 1.031 1.00 . A A . 12 GLU HG2 1 1 16 8816 1 1 12 GLU HG3 H 0.720 11.872 2.452 1.00 . A A . 12 GLU HG3 1 1 16 8817 1 1 12 GLU N N 2.819 13.622 3.947 1.00 . A A . 12 GLU N 1 1 16 8818 1 1 12 GLU O O 5.410 13.187 2.806 1.00 . A A . 12 GLU O 1 1 16 8819 1 1 12 GLU OE1 O 0.555 13.167 -0.555 1.00 . A A . 12 GLU OE1 1 1 16 8820 1 1 12 GLU OE2 O -0.913 13.138 1.142 1.00 . A A . 12 GLU OE2 1 1 16 8821 1 1 13 TYR C C 6.607 9.759 1.743 1.00 . A A . 13 TYR C 1 1 16 8822 1 1 13 TYR CA C 6.363 10.589 2.995 1.00 . A A . 13 TYR CA 1 1 16 8823 1 1 13 TYR CB C 6.717 9.795 4.248 1.00 . A A . 13 TYR CB 1 1 16 8824 1 1 13 TYR CD1 C 9.202 10.210 4.307 1.00 . A A . 13 TYR CD1 1 1 16 8825 1 1 13 TYR CD2 C 8.404 7.922 4.235 1.00 . A A . 13 TYR CD2 1 1 16 8826 1 1 13 TYR CE1 C 10.524 9.748 4.321 1.00 . A A . 13 TYR CE1 1 1 16 8827 1 1 13 TYR CE2 C 9.726 7.460 4.249 1.00 . A A . 13 TYR CE2 1 1 16 8828 1 1 13 TYR CG C 8.143 9.297 4.264 1.00 . A A . 13 TYR CG 1 1 16 8829 1 1 13 TYR CZ C 10.786 8.373 4.292 1.00 . A A . 13 TYR CZ 1 1 16 8830 1 1 13 TYR H H 4.271 10.275 3.178 1.00 . A A . 13 TYR H 1 1 16 8831 1 1 13 TYR HA H 6.988 11.482 2.954 1.00 . A A . 13 TYR HA 1 1 16 8832 1 1 13 TYR HB2 H 6.562 10.431 5.119 1.00 . A A . 13 TYR HB2 1 1 16 8833 1 1 13 TYR HB3 H 6.048 8.937 4.317 1.00 . A A . 13 TYR HB3 1 1 16 8834 1 1 13 TYR HD1 H 9.001 11.271 4.330 1.00 . A A . 13 TYR HD1 1 1 16 8835 1 1 13 TYR HD2 H 7.586 7.217 4.202 1.00 . A A . 13 TYR HD2 1 1 16 8836 1 1 13 TYR HE1 H 11.342 10.453 4.354 1.00 . A A . 13 TYR HE1 1 1 16 8837 1 1 13 TYR HE2 H 9.927 6.400 4.227 1.00 . A A . 13 TYR HE2 1 1 16 8838 1 1 13 TYR HH H 12.474 7.907 3.434 1.00 . A A . 13 TYR HH 1 1 16 8839 1 1 13 TYR N N 4.972 10.991 3.056 1.00 . A A . 13 TYR N 1 1 16 8840 1 1 13 TYR O O 5.639 9.345 1.107 1.00 . A A . 13 TYR O 1 1 16 8841 1 1 13 TYR OH O 12.073 7.923 4.305 1.00 . A A . 13 TYR OH 1 1 16 8842 1 1 14 ASP C C 9.405 7.850 0.562 1.00 . A A . 14 ASP C 1 1 16 8843 1 1 14 ASP CA C 8.213 8.753 0.240 1.00 . A A . 14 ASP CA 1 1 16 8844 1 1 14 ASP CB C 8.608 9.660 -0.928 1.00 . A A . 14 ASP CB 1 1 16 8845 1 1 14 ASP CG C 8.380 9.062 -2.317 1.00 . A A . 14 ASP CG 1 1 16 8846 1 1 14 ASP H H 8.652 9.876 1.938 1.00 . A A . 14 ASP H 1 1 16 8847 1 1 14 ASP HA H 7.313 8.187 0.001 1.00 . A A . 14 ASP HA 1 1 16 8848 1 1 14 ASP HB2 H 8.046 10.591 -0.852 1.00 . A A . 14 ASP HB2 1 1 16 8849 1 1 14 ASP HB3 H 9.662 9.916 -0.828 1.00 . A A . 14 ASP HB3 1 1 16 8850 1 1 14 ASP HD2 H 9.966 8.113 -2.680 1.00 . A A . 14 ASP HD2 1 1 16 8851 1 1 14 ASP N N 7.871 9.535 1.416 1.00 . A A . 14 ASP N 1 1 16 8852 1 1 14 ASP O O 10.566 8.231 0.434 1.00 . A A . 14 ASP O 1 1 16 8853 1 1 14 ASP OD1 O 7.655 9.631 -3.147 1.00 . A A . 14 ASP OD1 1 1 16 8854 1 1 14 ASP OD2 O 8.991 7.946 -2.537 1.00 . A A . 14 ASP OD2 1 1 16 8855 1 1 15 PRO C C 11.274 5.726 0.447 1.00 . A A . 15 PRO C 1 1 16 8856 1 1 15 PRO CA C 10.052 5.610 1.347 1.00 . A A . 15 PRO CA 1 1 16 8857 1 1 15 PRO CB C 9.328 4.284 1.119 1.00 . A A . 15 PRO CB 1 1 16 8858 1 1 15 PRO CD C 7.731 6.144 1.150 1.00 . A A . 15 PRO CD 1 1 16 8859 1 1 15 PRO CG C 7.880 4.691 1.592 1.00 . A A . 15 PRO CG 1 1 16 8860 1 1 15 PRO HA H 10.351 5.703 2.390 1.00 . A A . 15 PRO HA 1 1 16 8861 1 1 15 PRO HB2 H 9.389 3.952 0.082 1.00 . A A . 15 PRO HB2 1 1 16 8862 1 1 15 PRO HB3 H 9.741 3.530 1.789 1.00 . A A . 15 PRO HB3 1 1 16 8863 1 1 15 PRO HD2 H 7.168 6.211 0.219 1.00 . A A . 15 PRO HD2 1 1 16 8864 1 1 15 PRO HD3 H 7.239 6.720 1.933 1.00 . A A . 15 PRO HD3 1 1 16 8865 1 1 15 PRO HG2 H 7.481 4.036 0.817 1.00 . A A . 15 PRO HG2 1 1 16 8866 1 1 15 PRO HG3 H 7.393 4.497 2.549 1.00 . A A . 15 PRO HG3 1 1 16 8867 1 1 15 PRO N N 9.086 6.626 0.989 1.00 . A A . 15 PRO N 1 1 16 8868 1 1 15 PRO O O 11.228 5.240 -0.683 1.00 . A A . 15 PRO O 1 1 16 8869 1 1 16 ALA C C 14.556 7.328 0.988 1.00 . A A . 16 ALA C 1 1 16 8870 1 1 16 ALA CA C 13.540 6.525 0.173 1.00 . A A . 16 ALA CA 1 1 16 8871 1 1 16 ALA CB C 13.204 7.193 -1.162 1.00 . A A . 16 ALA CB 1 1 16 8872 1 1 16 ALA H H 12.353 6.750 1.869 1.00 . A A . 16 ALA H 1 1 16 8873 1 1 16 ALA HA H 13.947 5.533 -0.024 1.00 . A A . 16 ALA HA 1 1 16 8874 1 1 16 ALA HB1 H 12.577 8.066 -0.984 1.00 . A A . 16 ALA HB1 1 1 16 8875 1 1 16 ALA HB2 H 14.127 7.503 -1.655 1.00 . A A . 16 ALA HB2 1 1 16 8876 1 1 16 ALA HB3 H 12.672 6.487 -1.799 1.00 . A A . 16 ALA HB3 1 1 16 8877 1 1 16 ALA N N 12.324 6.358 0.950 1.00 . A A . 16 ALA N 1 1 16 8878 1 1 16 ALA O O 14.844 8.479 0.666 1.00 . A A . 16 ALA O 1 1 16 8879 1 1 17 PHE C C 17.185 6.369 3.239 1.00 . A A . 17 PHE C 1 1 16 8880 1 1 17 PHE CA C 16.045 7.329 2.894 1.00 . A A . 17 PHE CA 1 1 16 8881 1 1 17 PHE CB C 15.316 7.719 4.181 1.00 . A A . 17 PHE CB 1 1 16 8882 1 1 17 PHE CD1 C 15.241 10.114 3.454 1.00 . A A . 17 PHE CD1 1 1 16 8883 1 1 17 PHE CD2 C 15.438 9.661 5.758 1.00 . A A . 17 PHE CD2 1 1 16 8884 1 1 17 PHE CE1 C 15.257 11.509 3.727 1.00 . A A . 17 PHE CE1 1 1 16 8885 1 1 17 PHE CE2 C 15.454 11.055 6.030 1.00 . A A . 17 PHE CE2 1 1 16 8886 1 1 17 PHE CG C 15.332 9.220 4.475 1.00 . A A . 17 PHE CG 1 1 16 8887 1 1 17 PHE CZ C 15.362 11.949 5.010 1.00 . A A . 17 PHE CZ 1 1 16 8888 1 1 17 PHE H H 14.827 5.753 2.284 1.00 . A A . 17 PHE H 1 1 16 8889 1 1 17 PHE HA H 16.445 8.185 2.350 1.00 . A A . 17 PHE HA 1 1 16 8890 1 1 17 PHE HB2 H 14.281 7.383 4.116 1.00 . A A . 17 PHE HB2 1 1 16 8891 1 1 17 PHE HB3 H 15.770 7.190 5.019 1.00 . A A . 17 PHE HB3 1 1 16 8892 1 1 17 PHE HD1 H 15.157 9.762 2.426 1.00 . A A . 17 PHE HD1 1 1 16 8893 1 1 17 PHE HD2 H 15.511 8.945 6.575 1.00 . A A . 17 PHE HD2 1 1 16 8894 1 1 17 PHE HE1 H 15.183 12.225 2.909 1.00 . A A . 17 PHE HE1 1 1 16 8895 1 1 17 PHE HE2 H 15.538 11.408 7.058 1.00 . A A . 17 PHE HE2 1 1 16 8896 1 1 17 PHE HZ H 15.374 13.018 5.219 1.00 . A A . 17 PHE HZ 1 1 16 8897 1 1 17 PHE N N 15.068 6.689 2.029 1.00 . A A . 17 PHE N 1 1 16 8898 1 1 17 PHE O O 17.136 5.190 2.890 1.00 . A A . 17 PHE O 1 1 16 8899 1 1 18 GLU C C 18.903 4.979 5.244 1.00 . A A . 18 GLU C 1 1 16 8900 1 1 18 GLU CA C 19.336 6.115 4.315 1.00 . A A . 18 GLU CA 1 1 16 8901 1 1 18 GLU CB C 20.403 6.988 4.976 1.00 . A A . 18 GLU CB 1 1 16 8902 1 1 18 GLU CD C 20.594 8.096 7.234 1.00 . A A . 18 GLU CD 1 1 16 8903 1 1 18 GLU CG C 19.771 7.986 5.949 1.00 . A A . 18 GLU CG 1 1 16 8904 1 1 18 GLU H H 18.218 7.869 4.198 1.00 . A A . 18 GLU H 1 1 16 8905 1 1 18 GLU HA H 19.736 5.702 3.388 1.00 . A A . 18 GLU HA 1 1 16 8906 1 1 18 GLU HB2 H 21.115 6.358 5.509 1.00 . A A . 18 GLU HB2 1 1 16 8907 1 1 18 GLU HB3 H 20.964 7.526 4.212 1.00 . A A . 18 GLU HB3 1 1 16 8908 1 1 18 GLU HE2 H 21.959 9.201 6.556 1.00 . A A . 18 GLU HE2 1 1 16 8909 1 1 18 GLU HG2 H 19.698 8.964 5.474 1.00 . A A . 18 GLU HG2 1 1 16 8910 1 1 18 GLU HG3 H 18.755 7.670 6.188 1.00 . A A . 18 GLU HG3 1 1 16 8911 1 1 18 GLU N N 18.186 6.909 3.918 1.00 . A A . 18 GLU N 1 1 16 8912 1 1 18 GLU O O 19.461 3.884 5.194 1.00 . A A . 18 GLU O 1 1 16 8913 1 1 18 GLU OE1 O 20.045 7.949 8.336 1.00 . A A . 18 GLU OE1 1 1 16 8914 1 1 18 GLU OE2 O 21.847 8.344 7.059 1.00 . A A . 18 GLU OE2 1 1 16 8915 1 1 19 ASP C C 16.126 4.843 7.665 1.00 . A A . 19 ASP C 1 1 16 8916 1 1 19 ASP CA C 17.398 4.298 7.010 1.00 . A A . 19 ASP CA 1 1 16 8917 1 1 19 ASP CB C 18.414 4.011 8.118 1.00 . A A . 19 ASP CB 1 1 16 8918 1 1 19 ASP CG C 18.676 2.527 8.386 1.00 . A A . 19 ASP CG 1 1 16 8919 1 1 19 ASP H H 17.464 6.174 6.105 1.00 . A A . 19 ASP H 1 1 16 8920 1 1 19 ASP HA H 17.211 3.403 6.417 1.00 . A A . 19 ASP HA 1 1 16 8921 1 1 19 ASP HB2 H 19.357 4.491 7.859 1.00 . A A . 19 ASP HB2 1 1 16 8922 1 1 19 ASP HB3 H 18.064 4.475 9.041 1.00 . A A . 19 ASP HB3 1 1 16 8923 1 1 19 ASP HD2 H 19.861 1.120 7.984 1.00 . A A . 19 ASP HD2 1 1 16 8924 1 1 19 ASP N N 17.912 5.280 6.071 1.00 . A A . 19 ASP N 1 1 16 8925 1 1 19 ASP O O 15.655 5.923 7.311 1.00 . A A . 19 ASP O 1 1 16 8926 1 1 19 ASP OD1 O 18.105 1.934 9.314 1.00 . A A . 19 ASP OD1 1 1 16 8927 1 1 19 ASP OD2 O 19.518 1.969 7.584 1.00 . A A . 19 ASP OD2 1 1 16 8928 1 1 20 LEU C C 14.489 3.991 10.768 1.00 . A A . 20 LEU C 1 1 16 8929 1 1 20 LEU CA C 14.399 4.460 9.315 1.00 . A A . 20 LEU CA 1 1 16 8930 1 1 20 LEU CB C 13.159 3.950 8.579 1.00 . A A . 20 LEU CB 1 1 16 8931 1 1 20 LEU CD1 C 11.542 5.413 7.312 1.00 . A A . 20 LEU CD1 1 1 16 8932 1 1 20 LEU CD2 C 10.747 4.061 9.305 1.00 . A A . 20 LEU CD2 1 1 16 8933 1 1 20 LEU CG C 11.910 4.829 8.677 1.00 . A A . 20 LEU CG 1 1 16 8934 1 1 20 LEU H H 15.996 3.193 8.890 1.00 . A A . 20 LEU H 1 1 16 8935 1 1 20 LEU HA H 14.353 5.549 9.306 1.00 . A A . 20 LEU HA 1 1 16 8936 1 1 20 LEU HB2 H 13.410 3.827 7.526 1.00 . A A . 20 LEU HB2 1 1 16 8937 1 1 20 LEU HB3 H 12.913 2.960 8.965 1.00 . A A . 20 LEU HB3 1 1 16 8938 1 1 20 LEU HD11 H 11.062 6.383 7.449 1.00 . A A . 20 LEU HD11 1 1 16 8939 1 1 20 LEU HD12 H 12.445 5.536 6.714 1.00 . A A . 20 LEU HD12 1 1 16 8940 1 1 20 LEU HD13 H 10.857 4.737 6.801 1.00 . A A . 20 LEU HD13 1 1 16 8941 1 1 20 LEU HD21 H 9.988 4.766 9.646 1.00 . A A . 20 LEU HD21 1 1 16 8942 1 1 20 LEU HD22 H 10.312 3.390 8.564 1.00 . A A . 20 LEU HD22 1 1 16 8943 1 1 20 LEU HD23 H 11.109 3.481 10.153 1.00 . A A . 20 LEU HD23 1 1 16 8944 1 1 20 LEU HG H 12.135 5.668 9.337 1.00 . A A . 20 LEU HG 1 1 16 8945 1 1 20 LEU N N 15.607 4.069 8.608 1.00 . A A . 20 LEU N 1 1 16 8946 1 1 20 LEU O O 13.984 2.936 11.145 1.00 . A A . 20 LEU O 1 1 16 8947 1 1 21 PRO C C 14.018 4.313 13.672 1.00 . A A . 21 PRO C 1 1 16 8948 1 1 21 PRO CA C 15.360 4.564 12.998 1.00 . A A . 21 PRO CA 1 1 16 8949 1 1 21 PRO CB C 16.008 5.841 13.526 1.00 . A A . 21 PRO CB 1 1 16 8950 1 1 21 PRO CD C 15.761 6.057 11.175 1.00 . A A . 21 PRO CD 1 1 16 8951 1 1 21 PRO CG C 16.800 6.364 12.252 1.00 . A A . 21 PRO CG 1 1 16 8952 1 1 21 PRO HA H 16.018 3.710 13.154 1.00 . A A . 21 PRO HA 1 1 16 8953 1 1 21 PRO HB2 H 15.273 6.551 13.909 1.00 . A A . 21 PRO HB2 1 1 16 8954 1 1 21 PRO HB3 H 16.733 5.582 14.299 1.00 . A A . 21 PRO HB3 1 1 16 8955 1 1 21 PRO HD2 H 15.025 6.858 11.106 1.00 . A A . 21 PRO HD2 1 1 16 8956 1 1 21 PRO HD3 H 16.257 5.914 10.215 1.00 . A A . 21 PRO HD3 1 1 16 8957 1 1 21 PRO HG2 H 16.974 7.440 12.288 1.00 . A A . 21 PRO HG2 1 1 16 8958 1 1 21 PRO HG3 H 17.733 5.826 12.093 1.00 . A A . 21 PRO HG3 1 1 16 8959 1 1 21 PRO N N 15.155 4.810 11.585 1.00 . A A . 21 PRO N 1 1 16 8960 1 1 21 PRO O O 12.990 4.419 13.006 1.00 . A A . 21 PRO O 1 1 16 8961 1 1 22 ASP C C 12.501 4.933 16.576 1.00 . A A . 22 ASP C 1 1 16 8962 1 1 22 ASP CA C 12.827 3.727 15.694 1.00 . A A . 22 ASP CA 1 1 16 8963 1 1 22 ASP CB C 12.981 2.505 16.600 1.00 . A A . 22 ASP CB 1 1 16 8964 1 1 22 ASP CG C 14.343 2.374 17.283 1.00 . A A . 22 ASP CG 1 1 16 8965 1 1 22 ASP H H 14.893 3.905 15.490 1.00 . A A . 22 ASP H 1 1 16 8966 1 1 22 ASP HA H 12.067 3.550 14.932 1.00 . A A . 22 ASP HA 1 1 16 8967 1 1 22 ASP HB2 H 12.207 2.540 17.367 1.00 . A A . 22 ASP HB2 1 1 16 8968 1 1 22 ASP HB3 H 12.800 1.607 16.008 1.00 . A A . 22 ASP HB3 1 1 16 8969 1 1 22 ASP HD2 H 15.475 0.902 16.970 1.00 . A A . 22 ASP HD2 1 1 16 8970 1 1 22 ASP N N 14.051 3.989 14.956 1.00 . A A . 22 ASP N 1 1 16 8971 1 1 22 ASP O O 12.391 4.803 17.794 1.00 . A A . 22 ASP O 1 1 16 8972 1 1 22 ASP OD1 O 14.525 2.804 18.433 1.00 . A A . 22 ASP OD1 1 1 16 8973 1 1 22 ASP OD2 O 15.254 1.795 16.578 1.00 . A A . 22 ASP OD2 1 1 16 8974 1 1 23 ASP C C 12.013 8.472 15.648 1.00 . A A . 23 ASP C 1 1 16 8975 1 1 23 ASP CA C 12.044 7.308 16.640 1.00 . A A . 23 ASP CA 1 1 16 8976 1 1 23 ASP CB C 13.105 7.615 17.698 1.00 . A A . 23 ASP CB 1 1 16 8977 1 1 23 ASP CG C 12.601 8.396 18.913 1.00 . A A . 23 ASP CG 1 1 16 8978 1 1 23 ASP H H 12.446 6.177 14.937 1.00 . A A . 23 ASP H 1 1 16 8979 1 1 23 ASP HA H 11.074 7.130 17.106 1.00 . A A . 23 ASP HA 1 1 16 8980 1 1 23 ASP HB2 H 13.536 6.675 18.043 1.00 . A A . 23 ASP HB2 1 1 16 8981 1 1 23 ASP HB3 H 13.910 8.181 17.229 1.00 . A A . 23 ASP HB3 1 1 16 8982 1 1 23 ASP HD2 H 11.699 9.585 17.764 1.00 . A A . 23 ASP HD2 1 1 16 8983 1 1 23 ASP N N 12.355 6.080 15.928 1.00 . A A . 23 ASP N 1 1 16 8984 1 1 23 ASP O O 12.790 9.418 15.772 1.00 . A A . 23 ASP O 1 1 16 8985 1 1 23 ASP OD1 O 12.630 7.899 20.048 1.00 . A A . 23 ASP OD1 1 1 16 8986 1 1 23 ASP OD2 O 12.156 9.579 18.654 1.00 . A A . 23 ASP OD2 1 1 16 8987 1 1 24 TRP C C 9.742 10.245 14.033 1.00 . A A . 24 TRP C 1 1 16 8988 1 1 24 TRP CA C 10.965 9.399 13.675 1.00 . A A . 24 TRP CA 1 1 16 8989 1 1 24 TRP CB C 10.880 8.787 12.276 1.00 . A A . 24 TRP CB 1 1 16 8990 1 1 24 TRP CD1 C 12.326 10.530 11.038 1.00 . A A . 24 TRP CD1 1 1 16 8991 1 1 24 TRP CD2 C 10.450 10.033 9.970 1.00 . A A . 24 TRP CD2 1 1 16 8992 1 1 24 TRP CE2 C 11.123 10.967 9.209 1.00 . A A . 24 TRP CE2 1 1 16 8993 1 1 24 TRP CE3 C 9.212 9.510 9.560 1.00 . A A . 24 TRP CE3 1 1 16 8994 1 1 24 TRP CG C 11.236 9.759 11.148 1.00 . A A . 24 TRP CG 1 1 16 8995 1 1 24 TRP CH2 C 9.404 10.952 7.564 1.00 . A A . 24 TRP CH2 1 1 16 8996 1 1 24 TRP CZ2 C 10.637 11.459 7.992 1.00 . A A . 24 TRP CZ2 1 1 16 8997 1 1 24 TRP CZ3 C 8.738 10.012 8.341 1.00 . A A . 24 TRP CZ3 1 1 16 8998 1 1 24 TRP H H 10.480 7.593 14.593 1.00 . A A . 24 TRP H 1 1 16 8999 1 1 24 TRP HA H 11.864 10.014 13.698 1.00 . A A . 24 TRP HA 1 1 16 9000 1 1 24 TRP HB2 H 11.549 7.927 12.224 1.00 . A A . 24 TRP HB2 1 1 16 9001 1 1 24 TRP HB3 H 9.870 8.413 12.113 1.00 . A A . 24 TRP HB3 1 1 16 9002 1 1 24 TRP HD1 H 13.132 10.562 11.771 1.00 . A A . 24 TRP HD1 1 1 16 9003 1 1 24 TRP HE1 H 13.063 11.985 9.550 1.00 . A A . 24 TRP HE1 1 1 16 9004 1 1 24 TRP HE3 H 8.660 8.772 10.142 1.00 . A A . 24 TRP HE3 1 1 16 9005 1 1 24 TRP HH2 H 8.968 11.292 6.625 1.00 . A A . 24 TRP HH2 1 1 16 9006 1 1 24 TRP HZ2 H 11.188 12.197 7.409 1.00 . A A . 24 TRP HZ2 1 1 16 9007 1 1 24 TRP HZ3 H 7.781 9.638 7.978 1.00 . A A . 24 TRP HZ3 1 1 16 9008 1 1 24 TRP N N 11.108 8.365 14.687 1.00 . A A . 24 TRP N 1 1 16 9009 1 1 24 TRP NE1 N 12.301 11.279 9.879 1.00 . A A . 24 TRP NE1 1 1 16 9010 1 1 24 TRP O O 8.690 9.708 14.376 1.00 . A A . 24 TRP O 1 1 16 9011 1 1 25 ALA C C 8.533 13.325 13.011 1.00 . A A . 25 ALA C 1 1 16 9012 1 1 25 ALA CA C 8.845 12.481 14.248 1.00 . A A . 25 ALA CA 1 1 16 9013 1 1 25 ALA CB C 9.238 13.336 15.454 1.00 . A A . 25 ALA CB 1 1 16 9014 1 1 25 ALA H H 10.779 11.983 13.658 1.00 . A A . 25 ALA H 1 1 16 9015 1 1 25 ALA HA H 7.964 11.892 14.507 1.00 . A A . 25 ALA HA 1 1 16 9016 1 1 25 ALA HB1 H 8.418 14.010 15.704 1.00 . A A . 25 ALA HB1 1 1 16 9017 1 1 25 ALA HB2 H 9.449 12.688 16.305 1.00 . A A . 25 ALA HB2 1 1 16 9018 1 1 25 ALA HB3 H 10.126 13.919 15.211 1.00 . A A . 25 ALA HB3 1 1 16 9019 1 1 25 ALA N N 9.921 11.555 13.939 1.00 . A A . 25 ALA N 1 1 16 9020 1 1 25 ALA O O 9.443 13.760 12.306 1.00 . A A . 25 ALA O 1 1 16 9021 1 1 26 CYS C C 7.501 15.675 11.695 1.00 . A A . 26 CYS C 1 1 16 9022 1 1 26 CYS CA C 6.801 14.317 11.644 1.00 . A A . 26 CYS CA 1 1 16 9023 1 1 26 CYS CB C 5.278 14.460 11.613 1.00 . A A . 26 CYS CB 1 1 16 9024 1 1 26 CYS H H 6.510 13.174 13.361 1.00 . A A . 26 CYS H 1 1 16 9025 1 1 26 CYS HA H 7.094 13.764 10.751 1.00 . A A . 26 CYS HA 1 1 16 9026 1 1 26 CYS HB2 H 4.839 13.639 12.178 1.00 . A A . 26 CYS HB2 1 1 16 9027 1 1 26 CYS HB3 H 5.004 15.382 12.125 1.00 . A A . 26 CYS HB3 1 1 16 9028 1 1 26 CYS N N 7.244 13.531 12.783 1.00 . A A . 26 CYS N 1 1 16 9029 1 1 26 CYS O O 7.583 16.328 12.734 1.00 . A A . 26 CYS O 1 1 16 9030 1 1 26 CYS SG S 4.543 14.477 9.937 1.00 . A A . 26 CYS SG 1 1 16 9031 1 1 27 PRO C C 7.718 18.498 10.403 1.00 . A A . 27 PRO C 1 1 16 9032 1 1 27 PRO CA C 8.711 17.346 10.353 1.00 . A A . 27 PRO CA 1 1 16 9033 1 1 27 PRO CB C 9.356 17.239 8.972 1.00 . A A . 27 PRO CB 1 1 16 9034 1 1 27 PRO CD C 7.932 15.350 9.294 1.00 . A A . 27 PRO CD 1 1 16 9035 1 1 27 PRO CG C 8.267 16.367 8.204 1.00 . A A . 27 PRO CG 1 1 16 9036 1 1 27 PRO HA H 9.474 17.482 11.119 1.00 . A A . 27 PRO HA 1 1 16 9037 1 1 27 PRO HB2 H 9.499 18.213 8.505 1.00 . A A . 27 PRO HB2 1 1 16 9038 1 1 27 PRO HB3 H 10.305 16.711 9.061 1.00 . A A . 27 PRO HB3 1 1 16 9039 1 1 27 PRO HD2 H 6.938 14.930 9.141 1.00 . A A . 27 PRO HD2 1 1 16 9040 1 1 27 PRO HD3 H 8.682 14.559 9.304 1.00 . A A . 27 PRO HD3 1 1 16 9041 1 1 27 PRO HG2 H 7.345 16.816 7.837 1.00 . A A . 27 PRO HG2 1 1 16 9042 1 1 27 PRO HG3 H 8.834 15.923 7.386 1.00 . A A . 27 PRO HG3 1 1 16 9043 1 1 27 PRO N N 8.011 16.092 10.534 1.00 . A A . 27 PRO N 1 1 16 9044 1 1 27 PRO O O 8.137 19.649 10.287 1.00 . A A . 27 PRO O 1 1 16 9045 1 1 28 VAL C C 4.799 19.217 12.031 1.00 . A A . 28 VAL C 1 1 16 9046 1 1 28 VAL CA C 5.415 19.200 10.631 1.00 . A A . 28 VAL CA 1 1 16 9047 1 1 28 VAL CB C 4.382 18.970 9.526 1.00 . A A . 28 VAL CB 1 1 16 9048 1 1 28 VAL CG1 C 3.320 20.072 9.529 1.00 . A A . 28 VAL CG1 1 1 16 9049 1 1 28 VAL CG2 C 5.057 18.864 8.157 1.00 . A A . 28 VAL CG2 1 1 16 9050 1 1 28 VAL H H 6.111 17.238 10.664 1.00 . A A . 28 VAL H 1 1 16 9051 1 1 28 VAL HA H 5.895 20.161 10.447 1.00 . A A . 28 VAL HA 1 1 16 9052 1 1 28 VAL HB H 3.882 18.022 9.726 1.00 . A A . 28 VAL HB 1 1 16 9053 1 1 28 VAL HG11 H 3.267 20.521 10.520 1.00 . A A . 28 VAL HG11 1 1 16 9054 1 1 28 VAL HG12 H 3.585 20.835 8.798 1.00 . A A . 28 VAL HG12 1 1 16 9055 1 1 28 VAL HG13 H 2.351 19.643 9.272 1.00 . A A . 28 VAL HG13 1 1 16 9056 1 1 28 VAL HG21 H 4.498 19.452 7.429 1.00 . A A . 28 VAL HG21 1 1 16 9057 1 1 28 VAL HG22 H 6.077 19.245 8.224 1.00 . A A . 28 VAL HG22 1 1 16 9058 1 1 28 VAL HG23 H 5.079 17.821 7.842 1.00 . A A . 28 VAL HG23 1 1 16 9059 1 1 28 VAL N N 6.443 18.176 10.571 1.00 . A A . 28 VAL N 1 1 16 9060 1 1 28 VAL O O 5.304 19.891 12.927 1.00 . A A . 28 VAL O 1 1 16 9061 1 1 29 CYS C C 4.072 18.217 14.553 1.00 . A A . 29 CYS C 1 1 16 9062 1 1 29 CYS CA C 3.025 18.388 13.450 1.00 . A A . 29 CYS CA 1 1 16 9063 1 1 29 CYS CB C 1.991 17.260 13.466 1.00 . A A . 29 CYS CB 1 1 16 9064 1 1 29 CYS H H 3.311 17.923 11.440 1.00 . A A . 29 CYS H 1 1 16 9065 1 1 29 CYS HA H 2.483 19.326 13.574 1.00 . A A . 29 CYS HA 1 1 16 9066 1 1 29 CYS HB2 H 1.472 17.273 14.424 1.00 . A A . 29 CYS HB2 1 1 16 9067 1 1 29 CYS HB3 H 1.245 17.459 12.696 1.00 . A A . 29 CYS HB3 1 1 16 9068 1 1 29 CYS N N 3.715 18.468 12.175 1.00 . A A . 29 CYS N 1 1 16 9069 1 1 29 CYS O O 3.992 18.867 15.596 1.00 . A A . 29 CYS O 1 1 16 9070 1 1 29 CYS SG S 2.679 15.586 13.194 1.00 . A A . 29 CYS SG 1 1 16 9071 1 1 30 GLY C C 5.680 15.980 16.227 1.00 . A A . 30 GLY C 1 1 16 9072 1 1 30 GLY CA C 6.089 17.077 15.243 1.00 . A A . 30 GLY CA 1 1 16 9073 1 1 30 GLY H H 5.086 16.817 13.437 1.00 . A A . 30 GLY H 1 1 16 9074 1 1 30 GLY HA2 H 6.994 16.777 14.714 1.00 . A A . 30 GLY HA2 1 1 16 9075 1 1 30 GLY HA3 H 6.327 17.989 15.790 1.00 . A A . 30 GLY HA3 1 1 16 9076 1 1 30 GLY N N 5.029 17.341 14.286 1.00 . A A . 30 GLY N 1 1 16 9077 1 1 30 GLY O O 6.069 16.011 17.394 1.00 . A A . 30 GLY O 1 1 16 9078 1 1 31 ALA C C 5.361 12.729 16.347 1.00 . A A . 31 ALA C 1 1 16 9079 1 1 31 ALA CA C 4.434 13.931 16.540 1.00 . A A . 31 ALA CA 1 1 16 9080 1 1 31 ALA CB C 2.980 13.609 16.185 1.00 . A A . 31 ALA CB 1 1 16 9081 1 1 31 ALA H H 4.589 15.018 14.771 1.00 . A A . 31 ALA H 1 1 16 9082 1 1 31 ALA HA H 4.478 14.248 17.583 1.00 . A A . 31 ALA HA 1 1 16 9083 1 1 31 ALA HB1 H 2.945 13.114 15.215 1.00 . A A . 31 ALA HB1 1 1 16 9084 1 1 31 ALA HB2 H 2.558 12.950 16.945 1.00 . A A . 31 ALA HB2 1 1 16 9085 1 1 31 ALA HB3 H 2.404 14.533 16.144 1.00 . A A . 31 ALA HB3 1 1 16 9086 1 1 31 ALA N N 4.900 15.035 15.722 1.00 . A A . 31 ALA N 1 1 16 9087 1 1 31 ALA O O 6.107 12.669 15.370 1.00 . A A . 31 ALA O 1 1 16 9088 1 1 32 SER C C 5.631 9.697 16.100 1.00 . A A . 32 SER C 1 1 16 9089 1 1 32 SER CA C 6.106 10.607 17.235 1.00 . A A . 32 SER CA 1 1 16 9090 1 1 32 SER CB C 6.075 9.855 18.567 1.00 . A A . 32 SER CB 1 1 16 9091 1 1 32 SER H H 4.673 11.859 18.081 1.00 . A A . 32 SER H 1 1 16 9092 1 1 32 SER HA H 7.118 10.962 17.042 1.00 . A A . 32 SER HA 1 1 16 9093 1 1 32 SER HB2 H 6.488 8.856 18.429 1.00 . A A . 32 SER HB2 1 1 16 9094 1 1 32 SER HB3 H 6.713 10.366 19.287 1.00 . A A . 32 SER HB3 1 1 16 9095 1 1 32 SER HG H 4.086 9.802 18.349 1.00 . A A . 32 SER HG 1 1 16 9096 1 1 32 SER N N 5.283 11.803 17.290 1.00 . A A . 32 SER N 1 1 16 9097 1 1 32 SER O O 4.462 9.733 15.719 1.00 . A A . 32 SER O 1 1 16 9098 1 1 32 SER OG O 4.754 9.753 19.092 1.00 . A A . 32 SER OG 1 1 16 9099 1 1 33 LYS C C 4.871 7.373 14.743 1.00 . A A . 33 LYS C 1 1 16 9100 1 1 33 LYS CA C 6.253 7.985 14.510 1.00 . A A . 33 LYS CA 1 1 16 9101 1 1 33 LYS CB C 7.366 6.946 14.353 1.00 . A A . 33 LYS CB 1 1 16 9102 1 1 33 LYS CD C 6.390 4.732 13.646 1.00 . A A . 33 LYS CD 1 1 16 9103 1 1 33 LYS CE C 6.952 3.507 12.921 1.00 . A A . 33 LYS CE 1 1 16 9104 1 1 33 LYS CG C 7.083 6.012 13.175 1.00 . A A . 33 LYS CG 1 1 16 9105 1 1 33 LYS H H 7.511 8.879 15.909 1.00 . A A . 33 LYS H 1 1 16 9106 1 1 33 LYS HA H 6.223 8.566 13.588 1.00 . A A . 33 LYS HA 1 1 16 9107 1 1 33 LYS HB2 H 8.321 7.451 14.200 1.00 . A A . 33 LYS HB2 1 1 16 9108 1 1 33 LYS HB3 H 7.458 6.365 15.270 1.00 . A A . 33 LYS HB3 1 1 16 9109 1 1 33 LYS HD2 H 6.523 4.616 14.722 1.00 . A A . 33 LYS HD2 1 1 16 9110 1 1 33 LYS HD3 H 5.318 4.807 13.463 1.00 . A A . 33 LYS HD3 1 1 16 9111 1 1 33 LYS HE2 H 6.553 3.462 11.907 1.00 . A A . 33 LYS HE2 1 1 16 9112 1 1 33 LYS HE3 H 8.034 3.592 12.835 1.00 . A A . 33 LYS HE3 1 1 16 9113 1 1 33 LYS HG2 H 6.456 6.523 12.445 1.00 . A A . 33 LYS HG2 1 1 16 9114 1 1 33 LYS HG3 H 8.018 5.761 12.673 1.00 . A A . 33 LYS HG3 1 1 16 9115 1 1 33 LYS HZ1 H 6.167 1.580 13.048 1.00 . A A . 33 LYS HZ1 1 1 16 9116 1 1 33 LYS HZ2 H 7.420 1.825 14.060 1.00 . A A . 33 LYS HZ2 1 1 16 9117 1 1 33 LYS N N 6.563 8.903 15.593 1.00 . A A . 33 LYS N 1 1 16 9118 1 1 33 LYS NZ N 6.604 2.268 13.652 1.00 . A A . 33 LYS NZ 1 1 16 9119 1 1 33 LYS O O 4.047 7.327 13.832 1.00 . A A . 33 LYS O 1 1 16 9120 1 1 34 ASP C C 2.246 7.216 15.872 1.00 . A A . 34 ASP C 1 1 16 9121 1 1 34 ASP CA C 3.391 6.312 16.335 1.00 . A A . 34 ASP CA 1 1 16 9122 1 1 34 ASP CB C 3.276 6.145 17.852 1.00 . A A . 34 ASP CB 1 1 16 9123 1 1 34 ASP CG C 3.634 7.389 18.668 1.00 . A A . 34 ASP CG 1 1 16 9124 1 1 34 ASP H H 5.335 6.961 16.706 1.00 . A A . 34 ASP H 1 1 16 9125 1 1 34 ASP HA H 3.384 5.342 15.839 1.00 . A A . 34 ASP HA 1 1 16 9126 1 1 34 ASP HB2 H 2.255 5.852 18.094 1.00 . A A . 34 ASP HB2 1 1 16 9127 1 1 34 ASP HB3 H 3.926 5.327 18.162 1.00 . A A . 34 ASP HB3 1 1 16 9128 1 1 34 ASP HD2 H 5.439 6.849 18.656 1.00 . A A . 34 ASP HD2 1 1 16 9129 1 1 34 ASP N N 4.660 6.919 15.970 1.00 . A A . 34 ASP N 1 1 16 9130 1 1 34 ASP O O 1.848 8.136 16.586 1.00 . A A . 34 ASP O 1 1 16 9131 1 1 34 ASP OD1 O 2.843 8.339 18.765 1.00 . A A . 34 ASP OD1 1 1 16 9132 1 1 34 ASP OD2 O 4.795 7.358 19.229 1.00 . A A . 34 ASP OD2 1 1 16 9133 1 1 35 ALA C C 0.602 7.462 12.602 1.00 . A A . 35 ALA C 1 1 16 9134 1 1 35 ALA CA C 0.658 7.697 14.113 1.00 . A A . 35 ALA CA 1 1 16 9135 1 1 35 ALA CB C 0.842 9.174 14.465 1.00 . A A . 35 ALA CB 1 1 16 9136 1 1 35 ALA H H 2.078 6.173 14.105 1.00 . A A . 35 ALA H 1 1 16 9137 1 1 35 ALA HA H -0.269 7.342 14.561 1.00 . A A . 35 ALA HA 1 1 16 9138 1 1 35 ALA HB1 H 0.531 9.791 13.622 1.00 . A A . 35 ALA HB1 1 1 16 9139 1 1 35 ALA HB2 H 0.236 9.417 15.338 1.00 . A A . 35 ALA HB2 1 1 16 9140 1 1 35 ALA HB3 H 1.892 9.366 14.688 1.00 . A A . 35 ALA HB3 1 1 16 9141 1 1 35 ALA N N 1.749 6.923 14.680 1.00 . A A . 35 ALA N 1 1 16 9142 1 1 35 ALA O O -0.461 7.562 11.992 1.00 . A A . 35 ALA O 1 1 16 9143 1 1 36 PHE C C 1.330 5.508 10.263 1.00 . A A . 36 PHE C 1 1 16 9144 1 1 36 PHE CA C 1.859 6.901 10.612 1.00 . A A . 36 PHE CA 1 1 16 9145 1 1 36 PHE CB C 3.343 6.978 10.244 1.00 . A A . 36 PHE CB 1 1 16 9146 1 1 36 PHE CD1 C 4.056 9.175 11.211 1.00 . A A . 36 PHE CD1 1 1 16 9147 1 1 36 PHE CD2 C 4.170 8.903 8.873 1.00 . A A . 36 PHE CD2 1 1 16 9148 1 1 36 PHE CE1 C 4.552 10.499 11.080 1.00 . A A . 36 PHE CE1 1 1 16 9149 1 1 36 PHE CE2 C 4.666 10.227 8.743 1.00 . A A . 36 PHE CE2 1 1 16 9150 1 1 36 PHE CG C 3.876 8.404 10.105 1.00 . A A . 36 PHE CG 1 1 16 9151 1 1 36 PHE CZ C 4.846 10.997 9.849 1.00 . A A . 36 PHE CZ 1 1 16 9152 1 1 36 PHE H H 2.623 7.072 12.542 1.00 . A A . 36 PHE H 1 1 16 9153 1 1 36 PHE HA H 1.253 7.654 10.110 1.00 . A A . 36 PHE HA 1 1 16 9154 1 1 36 PHE HB2 H 3.923 6.457 11.006 1.00 . A A . 36 PHE HB2 1 1 16 9155 1 1 36 PHE HB3 H 3.501 6.447 9.305 1.00 . A A . 36 PHE HB3 1 1 16 9156 1 1 36 PHE HD1 H 3.822 8.775 12.197 1.00 . A A . 36 PHE HD1 1 1 16 9157 1 1 36 PHE HD2 H 4.025 8.285 7.986 1.00 . A A . 36 PHE HD2 1 1 16 9158 1 1 36 PHE HE1 H 4.697 11.117 11.967 1.00 . A A . 36 PHE HE1 1 1 16 9159 1 1 36 PHE HE2 H 4.901 10.626 7.756 1.00 . A A . 36 PHE HE2 1 1 16 9160 1 1 36 PHE HZ H 5.226 12.014 9.749 1.00 . A A . 36 PHE HZ 1 1 16 9161 1 1 36 PHE N N 1.763 7.152 12.040 1.00 . A A . 36 PHE N 1 1 16 9162 1 1 36 PHE O O 1.593 4.544 10.979 1.00 . A A . 36 PHE O 1 1 16 9163 1 1 37 GLU C C 0.619 3.798 7.354 1.00 . A A . 37 GLU C 1 1 16 9164 1 1 37 GLU CA C 0.027 4.190 8.709 1.00 . A A . 37 GLU CA 1 1 16 9165 1 1 37 GLU CB C -1.500 4.272 8.638 1.00 . A A . 37 GLU CB 1 1 16 9166 1 1 37 GLU CD C -1.655 2.959 10.785 1.00 . A A . 37 GLU CD 1 1 16 9167 1 1 37 GLU CG C -2.146 3.077 9.341 1.00 . A A . 37 GLU CG 1 1 16 9168 1 1 37 GLU H H 0.385 6.239 8.586 1.00 . A A . 37 GLU H 1 1 16 9169 1 1 37 GLU HA H 0.310 3.457 9.463 1.00 . A A . 37 GLU HA 1 1 16 9170 1 1 37 GLU HB2 H -1.840 5.199 9.101 1.00 . A A . 37 GLU HB2 1 1 16 9171 1 1 37 GLU HB3 H -1.817 4.302 7.595 1.00 . A A . 37 GLU HB3 1 1 16 9172 1 1 37 GLU HE2 H -0.990 1.204 10.637 1.00 . A A . 37 GLU HE2 1 1 16 9173 1 1 37 GLU HG2 H -3.231 3.187 9.330 1.00 . A A . 37 GLU HG2 1 1 16 9174 1 1 37 GLU HG3 H -1.913 2.161 8.797 1.00 . A A . 37 GLU HG3 1 1 16 9175 1 1 37 GLU N N 0.595 5.449 9.163 1.00 . A A . 37 GLU N 1 1 16 9176 1 1 37 GLU O O 0.879 4.658 6.515 1.00 . A A . 37 GLU O 1 1 16 9177 1 1 37 GLU OE1 O -1.373 3.980 11.429 1.00 . A A . 37 GLU OE1 1 1 16 9178 1 1 37 GLU OE2 O -1.573 1.753 11.237 1.00 . A A . 37 GLU OE2 1 1 16 9179 1 1 38 LYS C C 0.241 1.756 4.938 1.00 . A A . 38 LYS C 1 1 16 9180 1 1 38 LYS CA C 1.371 1.982 5.945 1.00 . A A . 38 LYS CA 1 1 16 9181 1 1 38 LYS CB C 2.211 0.732 6.216 1.00 . A A . 38 LYS CB 1 1 16 9182 1 1 38 LYS CD C 4.602 0.540 5.438 1.00 . A A . 38 LYS CD 1 1 16 9183 1 1 38 LYS CE C 5.222 -0.842 5.657 1.00 . A A . 38 LYS CE 1 1 16 9184 1 1 38 LYS CG C 3.131 0.425 5.033 1.00 . A A . 38 LYS CG 1 1 16 9185 1 1 38 LYS H H 0.599 1.805 7.872 1.00 . A A . 38 LYS H 1 1 16 9186 1 1 38 LYS HA H 2.042 2.742 5.546 1.00 . A A . 38 LYS HA 1 1 16 9187 1 1 38 LYS HB2 H 2.807 0.879 7.117 1.00 . A A . 38 LYS HB2 1 1 16 9188 1 1 38 LYS HB3 H 1.556 -0.118 6.403 1.00 . A A . 38 LYS HB3 1 1 16 9189 1 1 38 LYS HD2 H 5.156 1.073 4.664 1.00 . A A . 38 LYS HD2 1 1 16 9190 1 1 38 LYS HD3 H 4.686 1.129 6.351 1.00 . A A . 38 LYS HD3 1 1 16 9191 1 1 38 LYS HE2 H 4.724 -1.574 5.021 1.00 . A A . 38 LYS HE2 1 1 16 9192 1 1 38 LYS HE3 H 6.272 -0.826 5.364 1.00 . A A . 38 LYS HE3 1 1 16 9193 1 1 38 LYS HG2 H 2.930 -0.581 4.664 1.00 . A A . 38 LYS HG2 1 1 16 9194 1 1 38 LYS HG3 H 2.921 1.112 4.214 1.00 . A A . 38 LYS HG3 1 1 16 9195 1 1 38 LYS HZ1 H 5.924 -0.991 7.614 1.00 . A A . 38 LYS HZ1 1 1 16 9196 1 1 38 LYS HZ2 H 4.309 -0.805 7.530 1.00 . A A . 38 LYS HZ2 1 1 16 9197 1 1 38 LYS N N 0.813 2.499 7.184 1.00 . A A . 38 LYS N 1 1 16 9198 1 1 38 LYS NZ N 5.102 -1.244 7.076 1.00 . A A . 38 LYS NZ 1 1 16 9199 1 1 38 LYS O O -0.356 0.681 4.901 1.00 . A A . 38 LYS O 1 1 16 9200 1 1 39 GLN C C -0.488 2.984 1.752 1.00 . A A . 39 GLN C 1 1 16 9201 1 1 39 GLN CA C -1.067 2.715 3.143 1.00 . A A . 39 GLN CA 1 1 16 9202 1 1 39 GLN CB C -2.201 3.691 3.463 1.00 . A A . 39 GLN CB 1 1 16 9203 1 1 39 GLN CD C -4.705 3.964 3.575 1.00 . A A . 39 GLN CD 1 1 16 9204 1 1 39 GLN CG C -3.552 3.123 3.023 1.00 . A A . 39 GLN CG 1 1 16 9205 1 1 39 GLN H H 0.472 3.658 4.185 1.00 . A A . 39 GLN H 1 1 16 9206 1 1 39 GLN HA H -1.447 1.695 3.194 1.00 . A A . 39 GLN HA 1 1 16 9207 1 1 39 GLN HB2 H -2.219 3.894 4.534 1.00 . A A . 39 GLN HB2 1 1 16 9208 1 1 39 GLN HB3 H -2.021 4.641 2.962 1.00 . A A . 39 GLN HB3 1 1 16 9209 1 1 39 GLN HE21 H -4.955 2.580 5.031 1.00 . A A . 39 GLN HE21 1 1 16 9210 1 1 39 GLN HE22 H -6.049 3.922 5.089 1.00 . A A . 39 GLN HE22 1 1 16 9211 1 1 39 GLN HG2 H -3.604 3.099 1.935 1.00 . A A . 39 GLN HG2 1 1 16 9212 1 1 39 GLN HG3 H -3.648 2.095 3.371 1.00 . A A . 39 GLN HG3 1 1 16 9213 1 1 39 GLN N N -0.019 2.787 4.148 1.00 . A A . 39 GLN N 1 1 16 9214 1 1 39 GLN NE2 N -5.285 3.445 4.654 1.00 . A A . 39 GLN NE2 1 1 16 9215 1 1 39 GLN O O 0.193 2.132 1.184 1.00 . A A . 39 GLN O 1 1 16 9216 1 1 39 GLN OE1 O -5.047 5.013 3.055 1.00 . A A . 39 GLN OE1 1 1 17 9217 1 1 1 MET C C 3.248 0.740 -1.204 1.00 . A A . 1 MET C 1 1 17 9218 1 1 1 MET CA C 2.517 0.528 -2.532 1.00 . A A . 1 MET CA 1 1 17 9219 1 1 1 MET CB C 1.078 1.036 -2.409 1.00 . A A . 1 MET CB 1 1 17 9220 1 1 1 MET CE C -0.205 3.932 -5.015 1.00 . A A . 1 MET CE 1 1 17 9221 1 1 1 MET CG C 0.603 1.664 -3.720 1.00 . A A . 1 MET CG 1 1 17 9222 1 1 1 MET H1 H 3.072 -1.109 -3.692 1.00 . A A . 1 MET H1 1 1 17 9223 1 1 1 MET HA H 3.049 1.039 -3.334 1.00 . A A . 1 MET HA 1 1 17 9224 1 1 1 MET HB2 H 0.420 0.210 -2.137 1.00 . A A . 1 MET HB2 1 1 17 9225 1 1 1 MET HB3 H 1.015 1.771 -1.606 1.00 . A A . 1 MET HB3 1 1 17 9226 1 1 1 MET HE1 H 0.597 3.478 -5.598 1.00 . A A . 1 MET HE1 1 1 17 9227 1 1 1 MET HE2 H -1.158 3.766 -5.517 1.00 . A A . 1 MET HE2 1 1 17 9228 1 1 1 MET HE3 H -0.025 5.004 -4.923 1.00 . A A . 1 MET HE3 1 1 17 9229 1 1 1 MET HG2 H 1.456 1.846 -4.374 1.00 . A A . 1 MET HG2 1 1 17 9230 1 1 1 MET HG3 H -0.058 0.973 -4.245 1.00 . A A . 1 MET HG3 1 1 17 9231 1 1 1 MET N N 2.506 -0.876 -2.902 1.00 . A A . 1 MET N 1 1 17 9232 1 1 1 MET O O 3.159 -0.091 -0.303 1.00 . A A . 1 MET O 1 1 17 9233 1 1 1 MET SD S -0.251 3.195 -3.390 1.00 . A A . 1 MET SD 1 1 17 9234 1 1 2 ASP C C 4.655 3.702 0.298 1.00 . A A . 2 ASP C 1 1 17 9235 1 1 2 ASP CA C 4.702 2.190 0.074 1.00 . A A . 2 ASP CA 1 1 17 9236 1 1 2 ASP CB C 6.169 1.776 -0.057 1.00 . A A . 2 ASP CB 1 1 17 9237 1 1 2 ASP CG C 6.686 0.861 1.055 1.00 . A A . 2 ASP CG 1 1 17 9238 1 1 2 ASP H H 4.023 2.530 -1.865 1.00 . A A . 2 ASP H 1 1 17 9239 1 1 2 ASP HA H 4.215 1.635 0.876 1.00 . A A . 2 ASP HA 1 1 17 9240 1 1 2 ASP HB2 H 6.305 1.273 -1.014 1.00 . A A . 2 ASP HB2 1 1 17 9241 1 1 2 ASP HB3 H 6.784 2.676 -0.080 1.00 . A A . 2 ASP HB3 1 1 17 9242 1 1 2 ASP HD2 H 7.103 -0.825 0.324 1.00 . A A . 2 ASP HD2 1 1 17 9243 1 1 2 ASP N N 3.955 1.859 -1.127 1.00 . A A . 2 ASP N 1 1 17 9244 1 1 2 ASP O O 5.272 4.463 -0.447 1.00 . A A . 2 ASP O 1 1 17 9245 1 1 2 ASP OD1 O 6.272 0.973 2.218 1.00 . A A . 2 ASP OD1 1 1 17 9246 1 1 2 ASP OD2 O 7.561 -0.010 0.682 1.00 . A A . 2 ASP OD2 1 1 17 9247 1 1 3 ILE C C 3.404 5.640 3.134 1.00 . A A . 3 ILE C 1 1 17 9248 1 1 3 ILE CA C 3.781 5.502 1.658 1.00 . A A . 3 ILE CA 1 1 17 9249 1 1 3 ILE CB C 2.798 6.184 0.704 1.00 . A A . 3 ILE CB 1 1 17 9250 1 1 3 ILE CD1 C 3.122 5.560 -1.717 1.00 . A A . 3 ILE CD1 1 1 17 9251 1 1 3 ILE CG1 C 3.481 6.557 -0.614 1.00 . A A . 3 ILE CG1 1 1 17 9252 1 1 3 ILE CG2 C 2.138 7.393 1.370 1.00 . A A . 3 ILE CG2 1 1 17 9253 1 1 3 ILE H H 3.419 3.468 1.927 1.00 . A A . 3 ILE H 1 1 17 9254 1 1 3 ILE HA H 4.755 5.968 1.504 1.00 . A A . 3 ILE HA 1 1 17 9255 1 1 3 ILE HB H 2.005 5.475 0.467 1.00 . A A . 3 ILE HB 1 1 17 9256 1 1 3 ILE HD11 H 3.893 5.579 -2.488 1.00 . A A . 3 ILE HD11 1 1 17 9257 1 1 3 ILE HD12 H 3.057 4.558 -1.295 1.00 . A A . 3 ILE HD12 1 1 17 9258 1 1 3 ILE HD13 H 2.163 5.832 -2.156 1.00 . A A . 3 ILE HD13 1 1 17 9259 1 1 3 ILE HG12 H 3.177 7.561 -0.913 1.00 . A A . 3 ILE HG12 1 1 17 9260 1 1 3 ILE HG13 H 4.561 6.578 -0.474 1.00 . A A . 3 ILE HG13 1 1 17 9261 1 1 3 ILE HG21 H 1.435 7.852 0.675 1.00 . A A . 3 ILE HG21 1 1 17 9262 1 1 3 ILE HG22 H 1.606 7.070 2.265 1.00 . A A . 3 ILE HG22 1 1 17 9263 1 1 3 ILE HG23 H 2.904 8.119 1.645 1.00 . A A . 3 ILE HG23 1 1 17 9264 1 1 3 ILE N N 3.918 4.094 1.327 1.00 . A A . 3 ILE N 1 1 17 9265 1 1 3 ILE O O 2.618 4.872 3.682 1.00 . A A . 3 ILE O 1 1 17 9266 1 1 4 TYR C C 3.043 8.263 5.330 1.00 . A A . 4 TYR C 1 1 17 9267 1 1 4 TYR CA C 3.741 6.919 5.175 1.00 . A A . 4 TYR CA 1 1 17 9268 1 1 4 TYR CB C 5.063 6.906 5.939 1.00 . A A . 4 TYR CB 1 1 17 9269 1 1 4 TYR CD1 C 4.842 4.663 7.067 1.00 . A A . 4 TYR CD1 1 1 17 9270 1 1 4 TYR CD2 C 6.782 5.080 5.674 1.00 . A A . 4 TYR CD2 1 1 17 9271 1 1 4 TYR CE1 C 5.316 3.373 7.340 1.00 . A A . 4 TYR CE1 1 1 17 9272 1 1 4 TYR CE2 C 7.256 3.793 5.946 1.00 . A A . 4 TYR CE2 1 1 17 9273 1 1 4 TYR CG C 5.574 5.516 6.233 1.00 . A A . 4 TYR CG 1 1 17 9274 1 1 4 TYR CZ C 6.523 2.938 6.779 1.00 . A A . 4 TYR CZ 1 1 17 9275 1 1 4 TYR H H 4.633 7.258 3.277 1.00 . A A . 4 TYR H 1 1 17 9276 1 1 4 TYR HA H 3.095 6.137 5.574 1.00 . A A . 4 TYR HA 1 1 17 9277 1 1 4 TYR HB2 H 5.812 7.434 5.348 1.00 . A A . 4 TYR HB2 1 1 17 9278 1 1 4 TYR HB3 H 4.925 7.433 6.883 1.00 . A A . 4 TYR HB3 1 1 17 9279 1 1 4 TYR HD1 H 3.910 4.998 7.499 1.00 . A A . 4 TYR HD1 1 1 17 9280 1 1 4 TYR HD2 H 7.348 5.739 5.031 1.00 . A A . 4 TYR HD2 1 1 17 9281 1 1 4 TYR HE1 H 4.751 2.715 7.982 1.00 . A A . 4 TYR HE1 1 1 17 9282 1 1 4 TYR HE2 H 8.187 3.457 5.515 1.00 . A A . 4 TYR HE2 1 1 17 9283 1 1 4 TYR HH H 6.358 1.151 7.541 1.00 . A A . 4 TYR HH 1 1 17 9284 1 1 4 TYR N N 3.992 6.654 3.774 1.00 . A A . 4 TYR N 1 1 17 9285 1 1 4 TYR O O 3.727 9.275 5.471 1.00 . A A . 4 TYR O 1 1 17 9286 1 1 4 TYR OH O 6.984 1.682 7.045 1.00 . A A . 4 TYR OH 1 1 17 9287 1 1 5 VAL C C 0.524 9.644 6.899 1.00 . A A . 5 VAL C 1 1 17 9288 1 1 5 VAL CA C 0.955 9.478 5.441 1.00 . A A . 5 VAL CA 1 1 17 9289 1 1 5 VAL CB C -0.225 9.474 4.466 1.00 . A A . 5 VAL CB 1 1 17 9290 1 1 5 VAL CG1 C -1.076 10.735 4.630 1.00 . A A . 5 VAL CG1 1 1 17 9291 1 1 5 VAL CG2 C 0.259 9.323 3.022 1.00 . A A . 5 VAL CG2 1 1 17 9292 1 1 5 VAL H H 1.170 7.422 5.187 1.00 . A A . 5 VAL H 1 1 17 9293 1 1 5 VAL HA H 1.612 10.306 5.172 1.00 . A A . 5 VAL HA 1 1 17 9294 1 1 5 VAL HB H -0.851 8.613 4.701 1.00 . A A . 5 VAL HB 1 1 17 9295 1 1 5 VAL HG11 H -0.968 11.116 5.646 1.00 . A A . 5 VAL HG11 1 1 17 9296 1 1 5 VAL HG12 H -0.744 11.492 3.920 1.00 . A A . 5 VAL HG12 1 1 17 9297 1 1 5 VAL HG13 H -2.122 10.493 4.442 1.00 . A A . 5 VAL HG13 1 1 17 9298 1 1 5 VAL HG21 H 0.070 8.305 2.680 1.00 . A A . 5 VAL HG21 1 1 17 9299 1 1 5 VAL HG22 H -0.279 10.024 2.384 1.00 . A A . 5 VAL HG22 1 1 17 9300 1 1 5 VAL HG23 H 1.327 9.531 2.972 1.00 . A A . 5 VAL HG23 1 1 17 9301 1 1 5 VAL N N 1.719 8.250 5.302 1.00 . A A . 5 VAL N 1 1 17 9302 1 1 5 VAL O O -0.203 8.808 7.434 1.00 . A A . 5 VAL O 1 1 17 9303 1 1 6 CYS C C -0.858 11.109 9.012 1.00 . A A . 6 CYS C 1 1 17 9304 1 1 6 CYS CA C 0.664 11.013 8.888 1.00 . A A . 6 CYS CA 1 1 17 9305 1 1 6 CYS CB C 1.358 12.283 9.383 1.00 . A A . 6 CYS CB 1 1 17 9306 1 1 6 CYS H H 1.583 11.401 7.060 1.00 . A A . 6 CYS H 1 1 17 9307 1 1 6 CYS HA H 1.049 10.181 9.479 1.00 . A A . 6 CYS HA 1 1 17 9308 1 1 6 CYS HB2 H 2.399 12.260 9.062 1.00 . A A . 6 CYS HB2 1 1 17 9309 1 1 6 CYS HB3 H 0.894 13.144 8.903 1.00 . A A . 6 CYS HB3 1 1 17 9310 1 1 6 CYS N N 0.992 10.727 7.502 1.00 . A A . 6 CYS N 1 1 17 9311 1 1 6 CYS O O -1.539 11.487 8.061 1.00 . A A . 6 CYS O 1 1 17 9312 1 1 6 CYS SG S 1.310 12.527 11.197 1.00 . A A . 6 CYS SG 1 1 17 9313 1 1 7 THR C C -3.107 11.934 11.426 1.00 . A A . 7 THR C 1 1 17 9314 1 1 7 THR CA C -2.775 10.801 10.453 1.00 . A A . 7 THR CA 1 1 17 9315 1 1 7 THR CB C -3.205 9.421 10.958 1.00 . A A . 7 THR CB 1 1 17 9316 1 1 7 THR CG2 C -2.934 8.314 9.937 1.00 . A A . 7 THR CG2 1 1 17 9317 1 1 7 THR H H -0.787 10.452 10.962 1.00 . A A . 7 THR H 1 1 17 9318 1 1 7 THR HA H -3.289 11.022 9.518 1.00 . A A . 7 THR HA 1 1 17 9319 1 1 7 THR HB H -4.252 9.426 11.260 1.00 . A A . 7 THR HB 1 1 17 9320 1 1 7 THR HG1 H -2.436 9.792 12.768 1.00 . A A . 7 THR HG1 1 1 17 9321 1 1 7 THR HG21 H -2.311 7.545 10.392 1.00 . A A . 7 THR HG21 1 1 17 9322 1 1 7 THR HG22 H -3.880 7.875 9.620 1.00 . A A . 7 THR HG22 1 1 17 9323 1 1 7 THR HG23 H -2.420 8.734 9.073 1.00 . A A . 7 THR HG23 1 1 17 9324 1 1 7 THR N N -1.347 10.758 10.193 1.00 . A A . 7 THR N 1 1 17 9325 1 1 7 THR O O -4.183 11.950 12.023 1.00 . A A . 7 THR O 1 1 17 9326 1 1 7 THR OG1 O -2.298 9.143 12.020 1.00 . A A . 7 THR OG1 1 1 17 9327 1 1 8 VAL C C -2.446 15.271 11.618 1.00 . A A . 8 VAL C 1 1 17 9328 1 1 8 VAL CA C -2.341 13.989 12.447 1.00 . A A . 8 VAL CA 1 1 17 9329 1 1 8 VAL CB C -1.208 14.032 13.474 1.00 . A A . 8 VAL CB 1 1 17 9330 1 1 8 VAL CG1 C -1.227 15.346 14.257 1.00 . A A . 8 VAL CG1 1 1 17 9331 1 1 8 VAL CG2 C -1.276 12.829 14.417 1.00 . A A . 8 VAL CG2 1 1 17 9332 1 1 8 VAL H H -1.291 12.834 11.068 1.00 . A A . 8 VAL H 1 1 17 9333 1 1 8 VAL HA H -3.278 13.841 12.984 1.00 . A A . 8 VAL HA 1 1 17 9334 1 1 8 VAL HB H -0.264 13.979 12.932 1.00 . A A . 8 VAL HB 1 1 17 9335 1 1 8 VAL HG11 H -1.384 16.176 13.569 1.00 . A A . 8 VAL HG11 1 1 17 9336 1 1 8 VAL HG12 H -2.036 15.321 14.988 1.00 . A A . 8 VAL HG12 1 1 17 9337 1 1 8 VAL HG13 H -0.276 15.475 14.773 1.00 . A A . 8 VAL HG13 1 1 17 9338 1 1 8 VAL HG21 H -1.435 11.921 13.836 1.00 . A A . 8 VAL HG21 1 1 17 9339 1 1 8 VAL HG22 H -0.341 12.748 14.971 1.00 . A A . 8 VAL HG22 1 1 17 9340 1 1 8 VAL HG23 H -2.102 12.962 15.116 1.00 . A A . 8 VAL HG23 1 1 17 9341 1 1 8 VAL N N -2.163 12.854 11.557 1.00 . A A . 8 VAL N 1 1 17 9342 1 1 8 VAL O O -3.393 16.040 11.776 1.00 . A A . 8 VAL O 1 1 17 9343 1 1 9 CYS C C -1.746 16.197 8.467 1.00 . A A . 9 CYS C 1 1 17 9344 1 1 9 CYS CA C -1.432 16.635 9.899 1.00 . A A . 9 CYS CA 1 1 17 9345 1 1 9 CYS CB C -0.091 17.366 9.990 1.00 . A A . 9 CYS CB 1 1 17 9346 1 1 9 CYS H H -0.696 14.828 10.631 1.00 . A A . 9 CYS H 1 1 17 9347 1 1 9 CYS HA H -2.198 17.314 10.273 1.00 . A A . 9 CYS HA 1 1 17 9348 1 1 9 CYS HB2 H 0.021 18.004 9.114 1.00 . A A . 9 CYS HB2 1 1 17 9349 1 1 9 CYS HB3 H -0.109 18.022 10.861 1.00 . A A . 9 CYS HB3 1 1 17 9350 1 1 9 CYS N N -1.461 15.460 10.753 1.00 . A A . 9 CYS N 1 1 17 9351 1 1 9 CYS O O -2.169 17.007 7.644 1.00 . A A . 9 CYS O 1 1 17 9352 1 1 9 CYS SG S 1.373 16.275 10.112 1.00 . A A . 9 CYS SG 1 1 17 9353 1 1 10 GLY C C -0.542 14.473 6.003 1.00 . A A . 10 GLY C 1 1 17 9354 1 1 10 GLY CA C -1.781 14.360 6.895 1.00 . A A . 10 GLY CA 1 1 17 9355 1 1 10 GLY H H -1.181 14.262 8.887 1.00 . A A . 10 GLY H 1 1 17 9356 1 1 10 GLY HA2 H -2.072 13.314 6.987 1.00 . A A . 10 GLY HA2 1 1 17 9357 1 1 10 GLY HA3 H -2.616 14.884 6.430 1.00 . A A . 10 GLY HA3 1 1 17 9358 1 1 10 GLY N N -1.525 14.915 8.212 1.00 . A A . 10 GLY N 1 1 17 9359 1 1 10 GLY O O -0.614 14.439 4.777 1.00 . A A . 10 GLY O 1 1 17 9360 1 1 11 TYR C C 2.049 13.564 4.996 1.00 . A A . 11 TYR C 1 1 17 9361 1 1 11 TYR CA C 1.877 14.731 5.959 1.00 . A A . 11 TYR CA 1 1 17 9362 1 1 11 TYR CB C 3.017 14.766 6.973 1.00 . A A . 11 TYR CB 1 1 17 9363 1 1 11 TYR CD1 C 4.535 16.059 5.431 1.00 . A A . 11 TYR CD1 1 1 17 9364 1 1 11 TYR CD2 C 5.458 14.207 6.693 1.00 . A A . 11 TYR CD2 1 1 17 9365 1 1 11 TYR CE1 C 5.789 16.292 4.854 1.00 . A A . 11 TYR CE1 1 1 17 9366 1 1 11 TYR CE2 C 6.712 14.439 6.117 1.00 . A A . 11 TYR CE2 1 1 17 9367 1 1 11 TYR CG C 4.370 15.017 6.351 1.00 . A A . 11 TYR CG 1 1 17 9368 1 1 11 TYR CZ C 6.878 15.481 5.197 1.00 . A A . 11 TYR CZ 1 1 17 9369 1 1 11 TYR H H 0.620 14.630 7.668 1.00 . A A . 11 TYR H 1 1 17 9370 1 1 11 TYR HA H 1.880 15.661 5.391 1.00 . A A . 11 TYR HA 1 1 17 9371 1 1 11 TYR HB2 H 2.815 15.557 7.696 1.00 . A A . 11 TYR HB2 1 1 17 9372 1 1 11 TYR HB3 H 3.047 13.812 7.498 1.00 . A A . 11 TYR HB3 1 1 17 9373 1 1 11 TYR HD1 H 3.695 16.686 5.167 1.00 . A A . 11 TYR HD1 1 1 17 9374 1 1 11 TYR HD2 H 5.331 13.402 7.403 1.00 . A A . 11 TYR HD2 1 1 17 9375 1 1 11 TYR HE1 H 5.917 17.096 4.145 1.00 . A A . 11 TYR HE1 1 1 17 9376 1 1 11 TYR HE2 H 7.552 13.814 6.381 1.00 . A A . 11 TYR HE2 1 1 17 9377 1 1 11 TYR HH H 8.471 14.925 4.218 1.00 . A A . 11 TYR HH 1 1 17 9378 1 1 11 TYR N N 0.614 14.609 6.658 1.00 . A A . 11 TYR N 1 1 17 9379 1 1 11 TYR O O 1.492 12.497 5.250 1.00 . A A . 11 TYR O 1 1 17 9380 1 1 11 TYR OH O 8.100 15.706 4.635 1.00 . A A . 11 TYR OH 1 1 17 9381 1 1 12 GLU C C 4.526 12.435 2.828 1.00 . A A . 12 GLU C 1 1 17 9382 1 1 12 GLU CA C 3.030 12.735 2.947 1.00 . A A . 12 GLU CA 1 1 17 9383 1 1 12 GLU CB C 2.439 13.118 1.589 1.00 . A A . 12 GLU CB 1 1 17 9384 1 1 12 GLU CD C -0.019 13.512 1.183 1.00 . A A . 12 GLU CD 1 1 17 9385 1 1 12 GLU CG C 1.073 12.460 1.381 1.00 . A A . 12 GLU CG 1 1 17 9386 1 1 12 GLU H H 3.251 14.653 3.729 1.00 . A A . 12 GLU H 1 1 17 9387 1 1 12 GLU HA H 2.507 11.859 3.331 1.00 . A A . 12 GLU HA 1 1 17 9388 1 1 12 GLU HB2 H 2.337 14.201 1.525 1.00 . A A . 12 GLU HB2 1 1 17 9389 1 1 12 GLU HB3 H 3.118 12.814 0.793 1.00 . A A . 12 GLU HB3 1 1 17 9390 1 1 12 GLU HE2 H -0.403 13.397 3.023 1.00 . A A . 12 GLU HE2 1 1 17 9391 1 1 12 GLU HG2 H 1.112 11.802 0.511 1.00 . A A . 12 GLU HG2 1 1 17 9392 1 1 12 GLU HG3 H 0.831 11.836 2.241 1.00 . A A . 12 GLU HG3 1 1 17 9393 1 1 12 GLU N N 2.802 13.782 3.928 1.00 . A A . 12 GLU N 1 1 17 9394 1 1 12 GLU O O 5.351 13.314 2.588 1.00 . A A . 12 GLU O 1 1 17 9395 1 1 12 GLU OE1 O -0.416 13.787 0.041 1.00 . A A . 12 GLU OE1 1 1 17 9396 1 1 12 GLU OE2 O -0.459 14.052 2.269 1.00 . A A . 12 GLU OE2 1 1 17 9397 1 1 13 TYR C C 6.398 9.732 1.770 1.00 . A A . 13 TYR C 1 1 17 9398 1 1 13 TYR CA C 6.237 10.709 2.928 1.00 . A A . 13 TYR CA 1 1 17 9399 1 1 13 TYR CB C 6.633 10.053 4.247 1.00 . A A . 13 TYR CB 1 1 17 9400 1 1 13 TYR CD1 C 9.080 10.649 4.366 1.00 . A A . 13 TYR CD1 1 1 17 9401 1 1 13 TYR CD2 C 8.451 8.308 4.316 1.00 . A A . 13 TYR CD2 1 1 17 9402 1 1 13 TYR CE1 C 10.430 10.285 4.425 1.00 . A A . 13 TYR CE1 1 1 17 9403 1 1 13 TYR CE2 C 9.800 7.944 4.376 1.00 . A A . 13 TYR CE2 1 1 17 9404 1 1 13 TYR CG C 8.090 9.660 4.311 1.00 . A A . 13 TYR CG 1 1 17 9405 1 1 13 TYR CZ C 10.791 8.932 4.430 1.00 . A A . 13 TYR CZ 1 1 17 9406 1 1 13 TYR H H 4.144 10.471 3.202 1.00 . A A . 13 TYR H 1 1 17 9407 1 1 13 TYR HA H 6.879 11.571 2.754 1.00 . A A . 13 TYR HA 1 1 17 9408 1 1 13 TYR HB2 H 6.424 10.750 5.059 1.00 . A A . 13 TYR HB2 1 1 17 9409 1 1 13 TYR HB3 H 6.026 9.159 4.389 1.00 . A A . 13 TYR HB3 1 1 17 9410 1 1 13 TYR HD1 H 8.801 11.692 4.362 1.00 . A A . 13 TYR HD1 1 1 17 9411 1 1 13 TYR HD2 H 7.687 7.545 4.275 1.00 . A A . 13 TYR HD2 1 1 17 9412 1 1 13 TYR HE1 H 11.194 11.047 4.467 1.00 . A A . 13 TYR HE1 1 1 17 9413 1 1 13 TYR HE2 H 10.079 6.900 4.379 1.00 . A A . 13 TYR HE2 1 1 17 9414 1 1 13 TYR HH H 12.338 7.890 3.858 1.00 . A A . 13 TYR HH 1 1 17 9415 1 1 13 TYR N N 4.861 11.155 3.006 1.00 . A A . 13 TYR N 1 1 17 9416 1 1 13 TYR O O 5.390 9.278 1.232 1.00 . A A . 13 TYR O 1 1 17 9417 1 1 13 TYR OH O 12.107 8.577 4.488 1.00 . A A . 13 TYR OH 1 1 17 9418 1 1 14 ASP C C 9.076 7.605 0.699 1.00 . A A . 14 ASP C 1 1 17 9419 1 1 14 ASP CA C 7.903 8.512 0.323 1.00 . A A . 14 ASP CA 1 1 17 9420 1 1 14 ASP CB C 8.278 9.265 -0.955 1.00 . A A . 14 ASP CB 1 1 17 9421 1 1 14 ASP CG C 7.973 8.521 -2.257 1.00 . A A . 14 ASP CG 1 1 17 9422 1 1 14 ASP H H 8.453 9.808 1.858 1.00 . A A . 14 ASP H 1 1 17 9423 1 1 14 ASP HA H 6.974 7.957 0.186 1.00 . A A . 14 ASP HA 1 1 17 9424 1 1 14 ASP HB2 H 7.748 10.218 -0.966 1.00 . A A . 14 ASP HB2 1 1 17 9425 1 1 14 ASP HB3 H 9.343 9.494 -0.924 1.00 . A A . 14 ASP HB3 1 1 17 9426 1 1 14 ASP HD2 H 9.294 7.182 -2.343 1.00 . A A . 14 ASP HD2 1 1 17 9427 1 1 14 ASP N N 7.639 9.434 1.415 1.00 . A A . 14 ASP N 1 1 17 9428 1 1 14 ASP O O 10.241 7.912 0.456 1.00 . A A . 14 ASP O 1 1 17 9429 1 1 14 ASP OD1 O 7.450 9.105 -3.219 1.00 . A A . 14 ASP OD1 1 1 17 9430 1 1 14 ASP OD2 O 8.301 7.274 -2.261 1.00 . A A . 14 ASP OD2 1 1 17 9431 1 1 15 PRO C C 10.830 5.372 0.751 1.00 . A A . 15 PRO C 1 1 17 9432 1 1 15 PRO CA C 9.683 5.463 1.746 1.00 . A A . 15 PRO CA 1 1 17 9433 1 1 15 PRO CB C 8.884 4.160 1.781 1.00 . A A . 15 PRO CB 1 1 17 9434 1 1 15 PRO CD C 7.377 6.074 1.607 1.00 . A A . 15 PRO CD 1 1 17 9435 1 1 15 PRO CG C 7.496 4.689 2.238 1.00 . A A . 15 PRO CG 1 1 17 9436 1 1 15 PRO HA H 10.069 5.698 2.738 1.00 . A A . 15 PRO HA 1 1 17 9437 1 1 15 PRO HB2 H 8.888 3.647 0.820 1.00 . A A . 15 PRO HB2 1 1 17 9438 1 1 15 PRO HB3 H 9.284 3.516 2.564 1.00 . A A . 15 PRO HB3 1 1 17 9439 1 1 15 PRO HD2 H 6.761 6.039 0.708 1.00 . A A . 15 PRO HD2 1 1 17 9440 1 1 15 PRO HD3 H 6.955 6.774 2.329 1.00 . A A . 15 PRO HD3 1 1 17 9441 1 1 15 PRO HG2 H 6.769 4.020 1.777 1.00 . A A . 15 PRO HG2 1 1 17 9442 1 1 15 PRO HG3 H 7.365 4.714 3.319 1.00 . A A . 15 PRO HG3 1 1 17 9443 1 1 15 PRO N N 8.737 6.465 1.305 1.00 . A A . 15 PRO N 1 1 17 9444 1 1 15 PRO O O 10.599 4.969 -0.388 1.00 . A A . 15 PRO O 1 1 17 9445 1 1 16 ALA C C 14.316 6.524 0.936 1.00 . A A . 16 ALA C 1 1 17 9446 1 1 16 ALA CA C 13.187 5.695 0.318 1.00 . A A . 16 ALA CA 1 1 17 9447 1 1 16 ALA CB C 12.800 6.188 -1.078 1.00 . A A . 16 ALA CB 1 1 17 9448 1 1 16 ALA H H 12.206 6.068 2.116 1.00 . A A . 16 ALA H 1 1 17 9449 1 1 16 ALA HA H 13.507 4.656 0.247 1.00 . A A . 16 ALA HA 1 1 17 9450 1 1 16 ALA HB1 H 12.429 5.351 -1.669 1.00 . A A . 16 ALA HB1 1 1 17 9451 1 1 16 ALA HB2 H 12.023 6.947 -0.993 1.00 . A A . 16 ALA HB2 1 1 17 9452 1 1 16 ALA HB3 H 13.675 6.618 -1.567 1.00 . A A . 16 ALA HB3 1 1 17 9453 1 1 16 ALA N N 12.025 5.742 1.188 1.00 . A A . 16 ALA N 1 1 17 9454 1 1 16 ALA O O 14.639 7.603 0.444 1.00 . A A . 16 ALA O 1 1 17 9455 1 1 17 PHE C C 16.969 5.652 3.265 1.00 . A A . 17 PHE C 1 1 17 9456 1 1 17 PHE CA C 15.969 6.661 2.696 1.00 . A A . 17 PHE CA 1 1 17 9457 1 1 17 PHE CB C 15.344 7.448 3.850 1.00 . A A . 17 PHE CB 1 1 17 9458 1 1 17 PHE CD1 C 15.792 9.612 2.673 1.00 . A A . 17 PHE CD1 1 1 17 9459 1 1 17 PHE CD2 C 15.908 9.587 5.025 1.00 . A A . 17 PHE CD2 1 1 17 9460 1 1 17 PHE CE1 C 16.118 10.995 2.672 1.00 . A A . 17 PHE CE1 1 1 17 9461 1 1 17 PHE CE2 C 16.233 10.968 5.025 1.00 . A A . 17 PHE CE2 1 1 17 9462 1 1 17 PHE CG C 15.695 8.937 3.849 1.00 . A A . 17 PHE CG 1 1 17 9463 1 1 17 PHE CZ C 16.331 11.643 3.847 1.00 . A A . 17 PHE CZ 1 1 17 9464 1 1 17 PHE H H 14.615 5.107 2.399 1.00 . A A . 17 PHE H 1 1 17 9465 1 1 17 PHE HA H 16.472 7.296 1.966 1.00 . A A . 17 PHE HA 1 1 17 9466 1 1 17 PHE HB2 H 14.261 7.340 3.804 1.00 . A A . 17 PHE HB2 1 1 17 9467 1 1 17 PHE HB3 H 15.669 7.009 4.793 1.00 . A A . 17 PHE HB3 1 1 17 9468 1 1 17 PHE HD1 H 15.621 9.092 1.729 1.00 . A A . 17 PHE HD1 1 1 17 9469 1 1 17 PHE HD2 H 15.829 9.045 5.968 1.00 . A A . 17 PHE HD2 1 1 17 9470 1 1 17 PHE HE1 H 16.196 11.536 1.728 1.00 . A A . 17 PHE HE1 1 1 17 9471 1 1 17 PHE HE2 H 16.404 11.489 5.967 1.00 . A A . 17 PHE HE2 1 1 17 9472 1 1 17 PHE HZ H 16.581 12.704 3.847 1.00 . A A . 17 PHE HZ 1 1 17 9473 1 1 17 PHE N N 14.885 5.985 2.005 1.00 . A A . 17 PHE N 1 1 17 9474 1 1 17 PHE O O 16.685 4.457 3.325 1.00 . A A . 17 PHE O 1 1 17 9475 1 1 18 GLU C C 18.701 4.729 5.560 1.00 . A A . 18 GLU C 1 1 17 9476 1 1 18 GLU CA C 19.163 5.331 4.230 1.00 . A A . 18 GLU CA 1 1 17 9477 1 1 18 GLU CB C 20.464 6.116 4.407 1.00 . A A . 18 GLU CB 1 1 17 9478 1 1 18 GLU CD C 20.724 8.624 4.335 1.00 . A A . 18 GLU CD 1 1 17 9479 1 1 18 GLU CG C 20.215 7.431 5.148 1.00 . A A . 18 GLU CG 1 1 17 9480 1 1 18 GLU H H 18.343 7.144 3.616 1.00 . A A . 18 GLU H 1 1 17 9481 1 1 18 GLU HA H 19.321 4.537 3.501 1.00 . A A . 18 GLU HA 1 1 17 9482 1 1 18 GLU HB2 H 21.185 5.513 4.960 1.00 . A A . 18 GLU HB2 1 1 17 9483 1 1 18 GLU HB3 H 20.904 6.322 3.431 1.00 . A A . 18 GLU HB3 1 1 17 9484 1 1 18 GLU HE2 H 20.402 10.142 5.400 1.00 . A A . 18 GLU HE2 1 1 17 9485 1 1 18 GLU HG2 H 19.148 7.547 5.340 1.00 . A A . 18 GLU HG2 1 1 17 9486 1 1 18 GLU HG3 H 20.713 7.407 6.117 1.00 . A A . 18 GLU HG3 1 1 17 9487 1 1 18 GLU N N 18.120 6.171 3.668 1.00 . A A . 18 GLU N 1 1 17 9488 1 1 18 GLU O O 17.550 4.900 5.955 1.00 . A A . 18 GLU O 1 1 17 9489 1 1 18 GLU OE1 O 20.689 8.590 3.096 1.00 . A A . 18 GLU OE1 1 1 17 9490 1 1 18 GLU OE2 O 21.167 9.611 5.036 1.00 . A A . 18 GLU OE2 1 1 17 9491 1 1 19 ASP C C 18.488 4.366 8.338 1.00 . A A . 19 ASP C 1 1 17 9492 1 1 19 ASP CA C 19.327 3.410 7.488 1.00 . A A . 19 ASP CA 1 1 17 9493 1 1 19 ASP CB C 20.611 3.094 8.259 1.00 . A A . 19 ASP CB 1 1 17 9494 1 1 19 ASP CG C 20.399 2.604 9.693 1.00 . A A . 19 ASP CG 1 1 17 9495 1 1 19 ASP H H 20.560 3.904 5.883 1.00 . A A . 19 ASP H 1 1 17 9496 1 1 19 ASP HA H 18.792 2.494 7.238 1.00 . A A . 19 ASP HA 1 1 17 9497 1 1 19 ASP HB2 H 21.169 2.335 7.710 1.00 . A A . 19 ASP HB2 1 1 17 9498 1 1 19 ASP HB3 H 21.231 3.990 8.284 1.00 . A A . 19 ASP HB3 1 1 17 9499 1 1 19 ASP HD2 H 21.433 1.197 10.398 1.00 . A A . 19 ASP HD2 1 1 17 9500 1 1 19 ASP N N 19.625 4.037 6.211 1.00 . A A . 19 ASP N 1 1 17 9501 1 1 19 ASP O O 18.981 5.400 8.786 1.00 . A A . 19 ASP O 1 1 17 9502 1 1 19 ASP OD1 O 20.065 3.389 10.593 1.00 . A A . 19 ASP OD1 1 1 17 9503 1 1 19 ASP OD2 O 20.594 1.341 9.872 1.00 . A A . 19 ASP OD2 1 1 17 9504 1 1 20 LEU C C 16.699 4.689 10.802 1.00 . A A . 20 LEU C 1 1 17 9505 1 1 20 LEU CA C 16.321 4.797 9.323 1.00 . A A . 20 LEU CA 1 1 17 9506 1 1 20 LEU CB C 14.870 4.409 9.029 1.00 . A A . 20 LEU CB 1 1 17 9507 1 1 20 LEU CD1 C 13.213 5.363 7.384 1.00 . A A . 20 LEU CD1 1 1 17 9508 1 1 20 LEU CD2 C 12.918 5.764 9.872 1.00 . A A . 20 LEU CD2 1 1 17 9509 1 1 20 LEU CG C 13.915 5.565 8.729 1.00 . A A . 20 LEU CG 1 1 17 9510 1 1 20 LEU H H 16.840 3.144 8.166 1.00 . A A . 20 LEU H 1 1 17 9511 1 1 20 LEU HA H 16.448 5.831 9.008 1.00 . A A . 20 LEU HA 1 1 17 9512 1 1 20 LEU HB2 H 14.862 3.728 8.178 1.00 . A A . 20 LEU HB2 1 1 17 9513 1 1 20 LEU HB3 H 14.482 3.856 9.884 1.00 . A A . 20 LEU HB3 1 1 17 9514 1 1 20 LEU HD11 H 13.038 4.299 7.223 1.00 . A A . 20 LEU HD11 1 1 17 9515 1 1 20 LEU HD12 H 12.259 5.890 7.389 1.00 . A A . 20 LEU HD12 1 1 17 9516 1 1 20 LEU HD13 H 13.841 5.754 6.584 1.00 . A A . 20 LEU HD13 1 1 17 9517 1 1 20 LEU HD21 H 12.809 6.829 10.079 1.00 . A A . 20 LEU HD21 1 1 17 9518 1 1 20 LEU HD22 H 11.952 5.349 9.588 1.00 . A A . 20 LEU HD22 1 1 17 9519 1 1 20 LEU HD23 H 13.284 5.256 10.765 1.00 . A A . 20 LEU HD23 1 1 17 9520 1 1 20 LEU HG H 14.501 6.481 8.650 1.00 . A A . 20 LEU HG 1 1 17 9521 1 1 20 LEU N N 17.234 3.985 8.534 1.00 . A A . 20 LEU N 1 1 17 9522 1 1 20 LEU O O 17.171 3.661 11.281 1.00 . A A . 20 LEU O 1 1 17 9523 1 1 21 PRO C C 15.628 5.274 13.736 1.00 . A A . 21 PRO C 1 1 17 9524 1 1 21 PRO CA C 16.755 5.911 12.936 1.00 . A A . 21 PRO CA 1 1 17 9525 1 1 21 PRO CB C 16.829 7.415 13.195 1.00 . A A . 21 PRO CB 1 1 17 9526 1 1 21 PRO CD C 15.920 7.016 10.989 1.00 . A A . 21 PRO CD 1 1 17 9527 1 1 21 PRO CG C 15.843 7.965 12.184 1.00 . A A . 21 PRO CG 1 1 17 9528 1 1 21 PRO HA H 17.703 5.436 13.189 1.00 . A A . 21 PRO HA 1 1 17 9529 1 1 21 PRO HB2 H 16.566 7.672 14.221 1.00 . A A . 21 PRO HB2 1 1 17 9530 1 1 21 PRO HB3 H 17.829 7.772 12.951 1.00 . A A . 21 PRO HB3 1 1 17 9531 1 1 21 PRO HD2 H 14.932 6.854 10.558 1.00 . A A . 21 PRO HD2 1 1 17 9532 1 1 21 PRO HD3 H 16.601 7.420 10.240 1.00 . A A . 21 PRO HD3 1 1 17 9533 1 1 21 PRO HG2 H 14.844 7.916 12.618 1.00 . A A . 21 PRO HG2 1 1 17 9534 1 1 21 PRO HG3 H 16.096 8.991 11.915 1.00 . A A . 21 PRO HG3 1 1 17 9535 1 1 21 PRO N N 16.474 5.791 11.522 1.00 . A A . 21 PRO N 1 1 17 9536 1 1 21 PRO O O 14.653 4.826 13.136 1.00 . A A . 21 PRO O 1 1 17 9537 1 1 22 ASP C C 14.073 5.764 16.710 1.00 . A A . 22 ASP C 1 1 17 9538 1 1 22 ASP CA C 14.760 4.657 15.908 1.00 . A A . 22 ASP CA 1 1 17 9539 1 1 22 ASP CB C 15.378 3.668 16.899 1.00 . A A . 22 ASP CB 1 1 17 9540 1 1 22 ASP CG C 16.656 4.153 17.585 1.00 . A A . 22 ASP CG 1 1 17 9541 1 1 22 ASP H H 16.574 5.610 15.534 1.00 . A A . 22 ASP H 1 1 17 9542 1 1 22 ASP HA H 14.076 4.147 15.230 1.00 . A A . 22 ASP HA 1 1 17 9543 1 1 22 ASP HB2 H 14.638 3.435 17.665 1.00 . A A . 22 ASP HB2 1 1 17 9544 1 1 22 ASP HB3 H 15.595 2.739 16.373 1.00 . A A . 22 ASP HB3 1 1 17 9545 1 1 22 ASP HD2 H 17.394 4.785 19.198 1.00 . A A . 22 ASP HD2 1 1 17 9546 1 1 22 ASP N N 15.777 5.244 15.053 1.00 . A A . 22 ASP N 1 1 17 9547 1 1 22 ASP O O 14.086 5.744 17.941 1.00 . A A . 22 ASP O 1 1 17 9548 1 1 22 ASP OD1 O 17.720 4.256 16.954 1.00 . A A . 22 ASP OD1 1 1 17 9549 1 1 22 ASP OD2 O 16.530 4.435 18.837 1.00 . A A . 22 ASP OD2 1 1 17 9550 1 1 23 ASP C C 12.570 8.920 15.575 1.00 . A A . 23 ASP C 1 1 17 9551 1 1 23 ASP CA C 12.799 7.816 16.610 1.00 . A A . 23 ASP CA 1 1 17 9552 1 1 23 ASP CB C 13.629 8.406 17.753 1.00 . A A . 23 ASP CB 1 1 17 9553 1 1 23 ASP CG C 13.263 7.894 19.147 1.00 . A A . 23 ASP CG 1 1 17 9554 1 1 23 ASP H H 13.483 6.713 14.982 1.00 . A A . 23 ASP H 1 1 17 9555 1 1 23 ASP HA H 11.865 7.398 16.987 1.00 . A A . 23 ASP HA 1 1 17 9556 1 1 23 ASP HB2 H 14.681 8.190 17.567 1.00 . A A . 23 ASP HB2 1 1 17 9557 1 1 23 ASP HB3 H 13.520 9.490 17.739 1.00 . A A . 23 ASP HB3 1 1 17 9558 1 1 23 ASP HD2 H 11.496 7.252 19.045 1.00 . A A . 23 ASP HD2 1 1 17 9559 1 1 23 ASP N N 13.490 6.703 15.982 1.00 . A A . 23 ASP N 1 1 17 9560 1 1 23 ASP O O 13.245 9.948 15.599 1.00 . A A . 23 ASP O 1 1 17 9561 1 1 23 ASP OD1 O 14.127 7.418 19.900 1.00 . A A . 23 ASP OD1 1 1 17 9562 1 1 23 ASP OD2 O 12.016 8.001 19.458 1.00 . A A . 23 ASP OD2 1 1 17 9563 1 1 24 TRP C C 9.992 10.332 14.043 1.00 . A A . 24 TRP C 1 1 17 9564 1 1 24 TRP CA C 11.291 9.628 13.648 1.00 . A A . 24 TRP CA 1 1 17 9565 1 1 24 TRP CB C 11.209 8.946 12.282 1.00 . A A . 24 TRP CB 1 1 17 9566 1 1 24 TRP CD1 C 12.526 10.651 10.862 1.00 . A A . 24 TRP CD1 1 1 17 9567 1 1 24 TRP CD2 C 10.552 10.136 9.999 1.00 . A A . 24 TRP CD2 1 1 17 9568 1 1 24 TRP CE2 C 11.147 11.048 9.151 1.00 . A A . 24 TRP CE2 1 1 17 9569 1 1 24 TRP CE3 C 9.277 9.608 9.730 1.00 . A A . 24 TRP CE3 1 1 17 9570 1 1 24 TRP CG C 11.452 9.888 11.100 1.00 . A A . 24 TRP CG 1 1 17 9571 1 1 24 TRP CH2 C 9.271 10.998 7.687 1.00 . A A . 24 TRP CH2 1 1 17 9572 1 1 24 TRP CZ2 C 10.542 11.510 7.977 1.00 . A A . 24 TRP CZ2 1 1 17 9573 1 1 24 TRP CZ3 C 8.685 10.080 8.552 1.00 . A A . 24 TRP CZ3 1 1 17 9574 1 1 24 TRP H H 11.072 7.830 14.677 1.00 . A A . 24 TRP H 1 1 17 9575 1 1 24 TRP HA H 12.105 10.351 13.594 1.00 . A A . 24 TRP HA 1 1 17 9576 1 1 24 TRP HB2 H 11.941 8.138 12.246 1.00 . A A . 24 TRP HB2 1 1 17 9577 1 1 24 TRP HB3 H 10.225 8.489 12.173 1.00 . A A . 24 TRP HB3 1 1 17 9578 1 1 24 TRP HD1 H 13.402 10.699 11.510 1.00 . A A . 24 TRP HD1 1 1 17 9579 1 1 24 TRP HE1 H 13.112 12.065 9.271 1.00 . A A . 24 TRP HE1 1 1 17 9580 1 1 24 TRP HE3 H 8.786 8.886 10.383 1.00 . A A . 24 TRP HE3 1 1 17 9581 1 1 24 TRP HH2 H 8.744 11.317 6.789 1.00 . A A . 24 TRP HH2 1 1 17 9582 1 1 24 TRP HZ2 H 11.033 12.232 7.324 1.00 . A A . 24 TRP HZ2 1 1 17 9583 1 1 24 TRP HZ3 H 7.696 9.702 8.296 1.00 . A A . 24 TRP HZ3 1 1 17 9584 1 1 24 TRP N N 11.617 8.669 14.690 1.00 . A A . 24 TRP N 1 1 17 9585 1 1 24 TRP NE1 N 12.386 11.371 9.692 1.00 . A A . 24 TRP NE1 1 1 17 9586 1 1 24 TRP O O 9.028 9.683 14.448 1.00 . A A . 24 TRP O 1 1 17 9587 1 1 25 ALA C C 8.474 13.338 13.060 1.00 . A A . 25 ALA C 1 1 17 9588 1 1 25 ALA CA C 8.840 12.450 14.250 1.00 . A A . 25 ALA CA 1 1 17 9589 1 1 25 ALA CB C 9.127 13.259 15.516 1.00 . A A . 25 ALA CB 1 1 17 9590 1 1 25 ALA H H 10.793 12.170 13.582 1.00 . A A . 25 ALA H 1 1 17 9591 1 1 25 ALA HA H 8.016 11.765 14.451 1.00 . A A . 25 ALA HA 1 1 17 9592 1 1 25 ALA HB1 H 9.380 14.284 15.242 1.00 . A A . 25 ALA HB1 1 1 17 9593 1 1 25 ALA HB2 H 8.243 13.262 16.154 1.00 . A A . 25 ALA HB2 1 1 17 9594 1 1 25 ALA HB3 H 9.962 12.811 16.054 1.00 . A A . 25 ALA HB3 1 1 17 9595 1 1 25 ALA N N 10.006 11.650 13.912 1.00 . A A . 25 ALA N 1 1 17 9596 1 1 25 ALA O O 9.352 13.884 12.395 1.00 . A A . 25 ALA O 1 1 17 9597 1 1 26 CYS C C 7.278 15.668 11.862 1.00 . A A . 26 CYS C 1 1 17 9598 1 1 26 CYS CA C 6.680 14.266 11.729 1.00 . A A . 26 CYS CA 1 1 17 9599 1 1 26 CYS CB C 5.151 14.299 11.692 1.00 . A A . 26 CYS CB 1 1 17 9600 1 1 26 CYS H H 6.466 13.006 13.373 1.00 . A A . 26 CYS H 1 1 17 9601 1 1 26 CYS HA H 7.018 13.787 10.809 1.00 . A A . 26 CYS HA 1 1 17 9602 1 1 26 CYS HB2 H 4.773 13.352 12.076 1.00 . A A . 26 CYS HB2 1 1 17 9603 1 1 26 CYS HB3 H 4.802 15.080 12.368 1.00 . A A . 26 CYS HB3 1 1 17 9604 1 1 26 CYS N N 7.175 13.454 12.827 1.00 . A A . 26 CYS N 1 1 17 9605 1 1 26 CYS O O 7.278 16.279 12.928 1.00 . A A . 26 CYS O 1 1 17 9606 1 1 26 CYS SG S 4.429 14.592 10.036 1.00 . A A . 26 CYS SG 1 1 17 9607 1 1 27 PRO C C 7.338 18.553 10.734 1.00 . A A . 27 PRO C 1 1 17 9608 1 1 27 PRO CA C 8.409 17.477 10.634 1.00 . A A . 27 PRO CA 1 1 17 9609 1 1 27 PRO CB C 9.073 17.490 9.259 1.00 . A A . 27 PRO CB 1 1 17 9610 1 1 27 PRO CD C 7.813 15.479 9.467 1.00 . A A . 27 PRO CD 1 1 17 9611 1 1 27 PRO CG C 8.153 16.554 8.438 1.00 . A A . 27 PRO CG 1 1 17 9612 1 1 27 PRO HA H 9.153 17.623 11.417 1.00 . A A . 27 PRO HA 1 1 17 9613 1 1 27 PRO HB2 H 9.105 18.490 8.825 1.00 . A A . 27 PRO HB2 1 1 17 9614 1 1 27 PRO HB3 H 10.076 17.071 9.341 1.00 . A A . 27 PRO HB3 1 1 17 9615 1 1 27 PRO HD2 H 6.848 15.021 9.247 1.00 . A A . 27 PRO HD2 1 1 17 9616 1 1 27 PRO HD3 H 8.597 14.722 9.484 1.00 . A A . 27 PRO HD3 1 1 17 9617 1 1 27 PRO HG2 H 7.230 16.996 8.061 1.00 . A A . 27 PRO HG2 1 1 17 9618 1 1 27 PRO HG3 H 8.759 16.167 7.618 1.00 . A A . 27 PRO HG3 1 1 17 9619 1 1 27 PRO N N 7.795 16.170 10.738 1.00 . A A . 27 PRO N 1 1 17 9620 1 1 27 PRO O O 7.680 19.735 10.718 1.00 . A A . 27 PRO O 1 1 17 9621 1 1 28 VAL C C 4.416 19.050 12.348 1.00 . A A . 28 VAL C 1 1 17 9622 1 1 28 VAL CA C 4.986 19.082 10.929 1.00 . A A . 28 VAL CA 1 1 17 9623 1 1 28 VAL CB C 3.937 18.781 9.857 1.00 . A A . 28 VAL CB 1 1 17 9624 1 1 28 VAL CG1 C 2.781 19.781 9.923 1.00 . A A . 28 VAL CG1 1 1 17 9625 1 1 28 VAL CG2 C 4.569 18.765 8.463 1.00 . A A . 28 VAL CG2 1 1 17 9626 1 1 28 VAL H H 5.815 17.173 10.844 1.00 . A A . 28 VAL H 1 1 17 9627 1 1 28 VAL HA H 5.390 20.077 10.737 1.00 . A A . 28 VAL HA 1 1 17 9628 1 1 28 VAL HB H 3.533 17.788 10.053 1.00 . A A . 28 VAL HB 1 1 17 9629 1 1 28 VAL HG11 H 2.654 20.121 10.951 1.00 . A A . 28 VAL HG11 1 1 17 9630 1 1 28 VAL HG12 H 3.002 20.636 9.283 1.00 . A A . 28 VAL HG12 1 1 17 9631 1 1 28 VAL HG13 H 1.865 19.300 9.583 1.00 . A A . 28 VAL HG13 1 1 17 9632 1 1 28 VAL HG21 H 4.739 17.733 8.154 1.00 . A A . 28 VAL HG21 1 1 17 9633 1 1 28 VAL HG22 H 3.898 19.250 7.754 1.00 . A A . 28 VAL HG22 1 1 17 9634 1 1 28 VAL HG23 H 5.518 19.299 8.488 1.00 . A A . 28 VAL HG23 1 1 17 9635 1 1 28 VAL N N 6.084 18.136 10.831 1.00 . A A . 28 VAL N 1 1 17 9636 1 1 28 VAL O O 4.894 19.761 13.231 1.00 . A A . 28 VAL O 1 1 17 9637 1 1 29 CYS C C 3.850 17.893 14.879 1.00 . A A . 29 CYS C 1 1 17 9638 1 1 29 CYS CA C 2.760 18.081 13.822 1.00 . A A . 29 CYS CA 1 1 17 9639 1 1 29 CYS CB C 1.746 16.936 13.836 1.00 . A A . 29 CYS CB 1 1 17 9640 1 1 29 CYS H H 3.017 17.641 11.803 1.00 . A A . 29 CYS H 1 1 17 9641 1 1 29 CYS HA H 2.208 19.004 13.996 1.00 . A A . 29 CYS HA 1 1 17 9642 1 1 29 CYS HB2 H 1.343 16.838 14.844 1.00 . A A . 29 CYS HB2 1 1 17 9643 1 1 29 CYS HB3 H 0.914 17.197 13.183 1.00 . A A . 29 CYS HB3 1 1 17 9644 1 1 29 CYS N N 3.401 18.217 12.525 1.00 . A A . 29 CYS N 1 1 17 9645 1 1 29 CYS O O 3.865 18.591 15.892 1.00 . A A . 29 CYS O 1 1 17 9646 1 1 29 CYS SG S 2.415 15.314 13.313 1.00 . A A . 29 CYS SG 1 1 17 9647 1 1 30 GLY C C 5.603 15.321 16.237 1.00 . A A . 30 GLY C 1 1 17 9648 1 1 30 GLY CA C 5.826 16.656 15.523 1.00 . A A . 30 GLY CA 1 1 17 9649 1 1 30 GLY H H 4.715 16.381 13.782 1.00 . A A . 30 GLY H 1 1 17 9650 1 1 30 GLY HA2 H 6.767 16.625 14.974 1.00 . A A . 30 GLY HA2 1 1 17 9651 1 1 30 GLY HA3 H 5.911 17.456 16.258 1.00 . A A . 30 GLY HA3 1 1 17 9652 1 1 30 GLY N N 4.734 16.945 14.607 1.00 . A A . 30 GLY N 1 1 17 9653 1 1 30 GLY O O 6.503 14.810 16.901 1.00 . A A . 30 GLY O 1 1 17 9654 1 1 31 ALA C C 5.056 12.463 16.283 1.00 . A A . 31 ALA C 1 1 17 9655 1 1 31 ALA CA C 4.044 13.531 16.700 1.00 . A A . 31 ALA CA 1 1 17 9656 1 1 31 ALA CB C 2.610 13.156 16.318 1.00 . A A . 31 ALA CB 1 1 17 9657 1 1 31 ALA H H 3.670 15.218 15.537 1.00 . A A . 31 ALA H 1 1 17 9658 1 1 31 ALA HA H 4.095 13.665 17.780 1.00 . A A . 31 ALA HA 1 1 17 9659 1 1 31 ALA HB1 H 2.560 12.090 16.095 1.00 . A A . 31 ALA HB1 1 1 17 9660 1 1 31 ALA HB2 H 1.941 13.386 17.147 1.00 . A A . 31 ALA HB2 1 1 17 9661 1 1 31 ALA HB3 H 2.308 13.725 15.438 1.00 . A A . 31 ALA HB3 1 1 17 9662 1 1 31 ALA N N 4.397 14.795 16.078 1.00 . A A . 31 ALA N 1 1 17 9663 1 1 31 ALA O O 5.795 12.645 15.317 1.00 . A A . 31 ALA O 1 1 17 9664 1 1 32 SER C C 5.472 9.476 15.542 1.00 . A A . 32 SER C 1 1 17 9665 1 1 32 SER CA C 5.967 10.272 16.752 1.00 . A A . 32 SER CA 1 1 17 9666 1 1 32 SER CB C 6.114 9.353 17.967 1.00 . A A . 32 SER CB 1 1 17 9667 1 1 32 SER H H 4.454 11.228 17.816 1.00 . A A . 32 SER H 1 1 17 9668 1 1 32 SER HA H 6.927 10.740 16.534 1.00 . A A . 32 SER HA 1 1 17 9669 1 1 32 SER HB2 H 6.930 8.651 17.795 1.00 . A A . 32 SER HB2 1 1 17 9670 1 1 32 SER HB3 H 6.383 9.948 18.839 1.00 . A A . 32 SER HB3 1 1 17 9671 1 1 32 SER HG H 4.426 9.053 19.000 1.00 . A A . 32 SER HG 1 1 17 9672 1 1 32 SER N N 5.058 11.370 17.032 1.00 . A A . 32 SER N 1 1 17 9673 1 1 32 SER O O 4.359 9.695 15.065 1.00 . A A . 32 SER O 1 1 17 9674 1 1 32 SER OG O 4.916 8.631 18.237 1.00 . A A . 32 SER OG 1 1 17 9675 1 1 33 LYS C C 5.123 6.565 14.401 1.00 . A A . 33 LYS C 1 1 17 9676 1 1 33 LYS CA C 5.983 7.741 13.937 1.00 . A A . 33 LYS CA 1 1 17 9677 1 1 33 LYS CB C 7.249 7.320 13.187 1.00 . A A . 33 LYS CB 1 1 17 9678 1 1 33 LYS CD C 9.059 5.587 13.468 1.00 . A A . 33 LYS CD 1 1 17 9679 1 1 33 LYS CE C 9.230 4.395 14.410 1.00 . A A . 33 LYS CE 1 1 17 9680 1 1 33 LYS CG C 8.276 6.713 14.145 1.00 . A A . 33 LYS CG 1 1 17 9681 1 1 33 LYS H H 7.224 8.398 15.475 1.00 . A A . 33 LYS H 1 1 17 9682 1 1 33 LYS HA H 5.393 8.353 13.253 1.00 . A A . 33 LYS HA 1 1 17 9683 1 1 33 LYS HB2 H 6.994 6.595 12.414 1.00 . A A . 33 LYS HB2 1 1 17 9684 1 1 33 LYS HB3 H 7.682 8.185 12.683 1.00 . A A . 33 LYS HB3 1 1 17 9685 1 1 33 LYS HD2 H 8.537 5.269 12.564 1.00 . A A . 33 LYS HD2 1 1 17 9686 1 1 33 LYS HD3 H 10.037 5.954 13.158 1.00 . A A . 33 LYS HD3 1 1 17 9687 1 1 33 LYS HE2 H 9.443 4.748 15.418 1.00 . A A . 33 LYS HE2 1 1 17 9688 1 1 33 LYS HE3 H 8.300 3.827 14.461 1.00 . A A . 33 LYS HE3 1 1 17 9689 1 1 33 LYS HG2 H 8.965 7.488 14.483 1.00 . A A . 33 LYS HG2 1 1 17 9690 1 1 33 LYS HG3 H 7.771 6.329 15.030 1.00 . A A . 33 LYS HG3 1 1 17 9691 1 1 33 LYS HZ1 H 10.807 3.905 13.138 1.00 . A A . 33 LYS HZ1 1 1 17 9692 1 1 33 LYS HZ2 H 11.029 3.371 14.661 1.00 . A A . 33 LYS HZ2 1 1 17 9693 1 1 33 LYS N N 6.321 8.570 15.081 1.00 . A A . 33 LYS N 1 1 17 9694 1 1 33 LYS NZ N 10.327 3.517 13.943 1.00 . A A . 33 LYS NZ 1 1 17 9695 1 1 33 LYS O O 5.430 5.411 14.103 1.00 . A A . 33 LYS O 1 1 17 9696 1 1 34 ASP C C 1.779 6.067 14.992 1.00 . A A . 34 ASP C 1 1 17 9697 1 1 34 ASP CA C 3.156 5.881 15.631 1.00 . A A . 34 ASP CA 1 1 17 9698 1 1 34 ASP CB C 2.993 5.998 17.148 1.00 . A A . 34 ASP CB 1 1 17 9699 1 1 34 ASP CG C 2.112 4.924 17.789 1.00 . A A . 34 ASP CG 1 1 17 9700 1 1 34 ASP H H 3.820 7.837 15.361 1.00 . A A . 34 ASP H 1 1 17 9701 1 1 34 ASP HA H 3.614 4.929 15.365 1.00 . A A . 34 ASP HA 1 1 17 9702 1 1 34 ASP HB2 H 3.980 5.959 17.609 1.00 . A A . 34 ASP HB2 1 1 17 9703 1 1 34 ASP HB3 H 2.572 6.977 17.379 1.00 . A A . 34 ASP HB3 1 1 17 9704 1 1 34 ASP HD2 H 2.227 4.910 19.668 1.00 . A A . 34 ASP HD2 1 1 17 9705 1 1 34 ASP N N 4.062 6.896 15.123 1.00 . A A . 34 ASP N 1 1 17 9706 1 1 34 ASP O O 1.099 5.091 14.678 1.00 . A A . 34 ASP O 1 1 17 9707 1 1 34 ASP OD1 O 1.904 3.843 17.216 1.00 . A A . 34 ASP OD1 1 1 17 9708 1 1 34 ASP OD2 O 1.623 5.235 18.941 1.00 . A A . 34 ASP OD2 1 1 17 9709 1 1 35 ALA C C 0.178 7.376 12.719 1.00 . A A . 35 ALA C 1 1 17 9710 1 1 35 ALA CA C 0.123 7.654 14.223 1.00 . A A . 35 ALA CA 1 1 17 9711 1 1 35 ALA CB C -0.229 9.110 14.534 1.00 . A A . 35 ALA CB 1 1 17 9712 1 1 35 ALA H H 1.966 8.116 15.077 1.00 . A A . 35 ALA H 1 1 17 9713 1 1 35 ALA HA H -0.627 7.006 14.676 1.00 . A A . 35 ALA HA 1 1 17 9714 1 1 35 ALA HB1 H 0.013 9.328 15.575 1.00 . A A . 35 ALA HB1 1 1 17 9715 1 1 35 ALA HB2 H 0.342 9.770 13.882 1.00 . A A . 35 ALA HB2 1 1 17 9716 1 1 35 ALA HB3 H -1.295 9.269 14.368 1.00 . A A . 35 ALA HB3 1 1 17 9717 1 1 35 ALA N N 1.407 7.327 14.819 1.00 . A A . 35 ALA N 1 1 17 9718 1 1 35 ALA O O -0.858 7.253 12.068 1.00 . A A . 35 ALA O 1 1 17 9719 1 1 36 PHE C C 1.087 5.637 10.414 1.00 . A A . 36 PHE C 1 1 17 9720 1 1 36 PHE CA C 1.603 7.026 10.796 1.00 . A A . 36 PHE CA 1 1 17 9721 1 1 36 PHE CB C 3.111 7.084 10.544 1.00 . A A . 36 PHE CB 1 1 17 9722 1 1 36 PHE CD1 C 3.872 9.291 11.450 1.00 . A A . 36 PHE CD1 1 1 17 9723 1 1 36 PHE CD2 C 3.929 8.973 9.116 1.00 . A A . 36 PHE CD2 1 1 17 9724 1 1 36 PHE CE1 C 4.378 10.607 11.282 1.00 . A A . 36 PHE CE1 1 1 17 9725 1 1 36 PHE CE2 C 4.436 10.288 8.949 1.00 . A A . 36 PHE CE2 1 1 17 9726 1 1 36 PHE CG C 3.657 8.502 10.363 1.00 . A A . 36 PHE CG 1 1 17 9727 1 1 36 PHE CZ C 4.650 11.077 10.036 1.00 . A A . 36 PHE CZ 1 1 17 9728 1 1 36 PHE H H 2.237 7.388 12.747 1.00 . A A . 36 PHE H 1 1 17 9729 1 1 36 PHE HA H 1.045 7.783 10.244 1.00 . A A . 36 PHE HA 1 1 17 9730 1 1 36 PHE HB2 H 3.627 6.610 11.378 1.00 . A A . 36 PHE HB2 1 1 17 9731 1 1 36 PHE HB3 H 3.342 6.501 9.653 1.00 . A A . 36 PHE HB3 1 1 17 9732 1 1 36 PHE HD1 H 3.654 8.914 12.449 1.00 . A A . 36 PHE HD1 1 1 17 9733 1 1 36 PHE HD2 H 3.757 8.340 8.245 1.00 . A A . 36 PHE HD2 1 1 17 9734 1 1 36 PHE HE1 H 4.550 11.240 12.153 1.00 . A A . 36 PHE HE1 1 1 17 9735 1 1 36 PHE HE2 H 4.653 10.665 7.949 1.00 . A A . 36 PHE HE2 1 1 17 9736 1 1 36 PHE HZ H 5.040 12.088 9.907 1.00 . A A . 36 PHE HZ 1 1 17 9737 1 1 36 PHE N N 1.399 7.287 12.211 1.00 . A A . 36 PHE N 1 1 17 9738 1 1 36 PHE O O 1.363 4.657 11.104 1.00 . A A . 36 PHE O 1 1 17 9739 1 1 37 GLU C C -0.119 4.275 7.308 1.00 . A A . 37 GLU C 1 1 17 9740 1 1 37 GLU CA C -0.210 4.345 8.834 1.00 . A A . 37 GLU CA 1 1 17 9741 1 1 37 GLU CB C -1.654 4.170 9.306 1.00 . A A . 37 GLU CB 1 1 17 9742 1 1 37 GLU CD C -3.641 2.617 9.380 1.00 . A A . 37 GLU CD 1 1 17 9743 1 1 37 GLU CG C -2.221 2.824 8.848 1.00 . A A . 37 GLU CG 1 1 17 9744 1 1 37 GLU H H 0.128 6.398 8.759 1.00 . A A . 37 GLU H 1 1 17 9745 1 1 37 GLU HA H 0.408 3.563 9.277 1.00 . A A . 37 GLU HA 1 1 17 9746 1 1 37 GLU HB2 H -1.696 4.235 10.392 1.00 . A A . 37 GLU HB2 1 1 17 9747 1 1 37 GLU HB3 H -2.270 4.980 8.913 1.00 . A A . 37 GLU HB3 1 1 17 9748 1 1 37 GLU HE2 H -4.068 1.374 10.727 1.00 . A A . 37 GLU HE2 1 1 17 9749 1 1 37 GLU HG2 H -2.227 2.779 7.759 1.00 . A A . 37 GLU HG2 1 1 17 9750 1 1 37 GLU HG3 H -1.577 2.017 9.197 1.00 . A A . 37 GLU HG3 1 1 17 9751 1 1 37 GLU N N 0.348 5.597 9.315 1.00 . A A . 37 GLU N 1 1 17 9752 1 1 37 GLU O O -0.336 5.274 6.623 1.00 . A A . 37 GLU O 1 1 17 9753 1 1 37 GLU OE1 O -4.426 3.575 9.439 1.00 . A A . 37 GLU OE1 1 1 17 9754 1 1 37 GLU OE2 O -3.918 1.410 9.740 1.00 . A A . 37 GLU OE2 1 1 17 9755 1 1 38 LYS C C -1.042 3.059 4.729 1.00 . A A . 38 LYS C 1 1 17 9756 1 1 38 LYS CA C 0.326 2.874 5.388 1.00 . A A . 38 LYS CA 1 1 17 9757 1 1 38 LYS CB C 0.968 1.515 5.100 1.00 . A A . 38 LYS CB 1 1 17 9758 1 1 38 LYS CD C 1.327 -0.249 3.334 1.00 . A A . 38 LYS CD 1 1 17 9759 1 1 38 LYS CE C 2.765 -0.375 2.825 1.00 . A A . 38 LYS CE 1 1 17 9760 1 1 38 LYS CG C 0.968 1.215 3.600 1.00 . A A . 38 LYS CG 1 1 17 9761 1 1 38 LYS H H 0.379 2.279 7.383 1.00 . A A . 38 LYS H 1 1 17 9762 1 1 38 LYS HA H 1.002 3.637 5.000 1.00 . A A . 38 LYS HA 1 1 17 9763 1 1 38 LYS HB2 H 1.990 1.504 5.476 1.00 . A A . 38 LYS HB2 1 1 17 9764 1 1 38 LYS HB3 H 0.425 0.733 5.632 1.00 . A A . 38 LYS HB3 1 1 17 9765 1 1 38 LYS HD2 H 1.209 -0.828 4.249 1.00 . A A . 38 LYS HD2 1 1 17 9766 1 1 38 LYS HD3 H 0.639 -0.668 2.599 1.00 . A A . 38 LYS HD3 1 1 17 9767 1 1 38 LYS HE2 H 2.883 0.196 1.904 1.00 . A A . 38 LYS HE2 1 1 17 9768 1 1 38 LYS HE3 H 3.454 0.049 3.554 1.00 . A A . 38 LYS HE3 1 1 17 9769 1 1 38 LYS HG2 H -0.015 1.433 3.182 1.00 . A A . 38 LYS HG2 1 1 17 9770 1 1 38 LYS HG3 H 1.680 1.866 3.095 1.00 . A A . 38 LYS HG3 1 1 17 9771 1 1 38 LYS HZ1 H 3.116 -2.336 3.439 1.00 . A A . 38 LYS HZ1 1 1 17 9772 1 1 38 LYS HZ2 H 2.440 -2.244 1.960 1.00 . A A . 38 LYS HZ2 1 1 17 9773 1 1 38 LYS N N 0.204 3.087 6.819 1.00 . A A . 38 LYS N 1 1 17 9774 1 1 38 LYS NZ N 3.105 -1.795 2.581 1.00 . A A . 38 LYS NZ 1 1 17 9775 1 1 38 LYS O O -2.061 2.638 5.277 1.00 . A A . 38 LYS O 1 1 17 9776 1 1 39 GLN C C -2.013 3.758 1.325 1.00 . A A . 39 GLN C 1 1 17 9777 1 1 39 GLN CA C -2.251 3.935 2.827 1.00 . A A . 39 GLN CA 1 1 17 9778 1 1 39 GLN CB C -2.805 5.328 3.132 1.00 . A A . 39 GLN CB 1 1 17 9779 1 1 39 GLN CD C -2.433 7.226 1.515 1.00 . A A . 39 GLN CD 1 1 17 9780 1 1 39 GLN CG C -1.837 6.417 2.668 1.00 . A A . 39 GLN CG 1 1 17 9781 1 1 39 GLN H H -0.191 4.028 3.125 1.00 . A A . 39 GLN H 1 1 17 9782 1 1 39 GLN HA H -2.958 3.184 3.180 1.00 . A A . 39 GLN HA 1 1 17 9783 1 1 39 GLN HB2 H -3.767 5.457 2.637 1.00 . A A . 39 GLN HB2 1 1 17 9784 1 1 39 GLN HB3 H -2.982 5.426 4.203 1.00 . A A . 39 GLN HB3 1 1 17 9785 1 1 39 GLN HE21 H -3.601 8.191 2.857 1.00 . A A . 39 GLN HE21 1 1 17 9786 1 1 39 GLN HE22 H -3.805 8.683 1.209 1.00 . A A . 39 GLN HE22 1 1 17 9787 1 1 39 GLN HG2 H -1.604 7.081 3.501 1.00 . A A . 39 GLN HG2 1 1 17 9788 1 1 39 GLN HG3 H -0.897 5.963 2.352 1.00 . A A . 39 GLN HG3 1 1 17 9789 1 1 39 GLN N N -1.024 3.689 3.564 1.00 . A A . 39 GLN N 1 1 17 9790 1 1 39 GLN NE2 N -3.355 8.107 1.892 1.00 . A A . 39 GLN NE2 1 1 17 9791 1 1 39 GLN O O -2.497 2.799 0.726 1.00 . A A . 39 GLN O 1 1 17 9792 1 1 39 GLN OE1 O -2.078 7.062 0.359 1.00 . A A . 39 GLN OE1 1 1 18 9793 1 1 1 MET C C 3.301 1.384 -1.849 1.00 . A A . 1 MET C 1 1 18 9794 1 1 1 MET CA C 2.405 1.271 -3.084 1.00 . A A . 1 MET CA 1 1 18 9795 1 1 1 MET CB C 3.192 1.692 -4.327 1.00 . A A . 1 MET CB 1 1 18 9796 1 1 1 MET CE C 5.581 -0.361 -6.338 1.00 . A A . 1 MET CE 1 1 18 9797 1 1 1 MET CG C 3.200 0.579 -5.376 1.00 . A A . 1 MET CG 1 1 18 9798 1 1 1 MET H1 H 1.399 3.031 -2.609 1.00 . A A . 1 MET H1 1 1 18 9799 1 1 1 MET HA H 2.032 0.251 -3.178 1.00 . A A . 1 MET HA 1 1 18 9800 1 1 1 MET HB2 H 2.752 2.594 -4.752 1.00 . A A . 1 MET HB2 1 1 18 9801 1 1 1 MET HB3 H 4.217 1.940 -4.046 1.00 . A A . 1 MET HB3 1 1 18 9802 1 1 1 MET HE1 H 5.102 -1.159 -5.771 1.00 . A A . 1 MET HE1 1 1 18 9803 1 1 1 MET HE2 H 5.940 -0.757 -7.288 1.00 . A A . 1 MET HE2 1 1 18 9804 1 1 1 MET HE3 H 6.421 0.036 -5.769 1.00 . A A . 1 MET HE3 1 1 18 9805 1 1 1 MET HG2 H 3.435 -0.375 -4.904 1.00 . A A . 1 MET HG2 1 1 18 9806 1 1 1 MET HG3 H 2.209 0.478 -5.819 1.00 . A A . 1 MET HG3 1 1 18 9807 1 1 1 MET N N 1.225 2.108 -2.951 1.00 . A A . 1 MET N 1 1 18 9808 1 1 1 MET O O 3.571 0.388 -1.180 1.00 . A A . 1 MET O 1 1 18 9809 1 1 1 MET SD S 4.401 0.942 -6.644 1.00 . A A . 1 MET SD 1 1 18 9810 1 1 2 ASP C C 4.536 4.350 -0.087 1.00 . A A . 2 ASP C 1 1 18 9811 1 1 2 ASP CA C 4.597 2.863 -0.441 1.00 . A A . 2 ASP CA 1 1 18 9812 1 1 2 ASP CB C 6.052 2.511 -0.756 1.00 . A A . 2 ASP CB 1 1 18 9813 1 1 2 ASP CG C 6.243 1.260 -1.618 1.00 . A A . 2 ASP CG 1 1 18 9814 1 1 2 ASP H H 3.513 3.412 -2.134 1.00 . A A . 2 ASP H 1 1 18 9815 1 1 2 ASP HA H 4.210 2.228 0.356 1.00 . A A . 2 ASP HA 1 1 18 9816 1 1 2 ASP HB2 H 6.514 3.357 -1.265 1.00 . A A . 2 ASP HB2 1 1 18 9817 1 1 2 ASP HB3 H 6.588 2.373 0.182 1.00 . A A . 2 ASP HB3 1 1 18 9818 1 1 2 ASP HD2 H 6.386 2.343 -3.152 1.00 . A A . 2 ASP HD2 1 1 18 9819 1 1 2 ASP N N 3.737 2.607 -1.584 1.00 . A A . 2 ASP N 1 1 18 9820 1 1 2 ASP O O 5.299 5.151 -0.624 1.00 . A A . 2 ASP O 1 1 18 9821 1 1 2 ASP OD1 O 6.550 0.173 -1.106 1.00 . A A . 2 ASP OD1 1 1 18 9822 1 1 2 ASP OD2 O 6.061 1.437 -2.882 1.00 . A A . 2 ASP OD2 1 1 18 9823 1 1 3 ILE C C 3.243 6.082 2.765 1.00 . A A . 3 ILE C 1 1 18 9824 1 1 3 ILE CA C 3.453 6.050 1.249 1.00 . A A . 3 ILE CA 1 1 18 9825 1 1 3 ILE CB C 2.331 6.726 0.458 1.00 . A A . 3 ILE CB 1 1 18 9826 1 1 3 ILE CD1 C 1.856 5.892 -1.874 1.00 . A A . 3 ILE CD1 1 1 18 9827 1 1 3 ILE CG1 C 2.698 6.844 -1.022 1.00 . A A . 3 ILE CG1 1 1 18 9828 1 1 3 ILE CG2 C 1.969 8.082 1.069 1.00 . A A . 3 ILE CG2 1 1 18 9829 1 1 3 ILE H H 3.006 4.015 1.249 1.00 . A A . 3 ILE H 1 1 18 9830 1 1 3 ILE HA H 4.375 6.581 1.017 1.00 . A A . 3 ILE HA 1 1 18 9831 1 1 3 ILE HB H 1.442 6.097 0.521 1.00 . A A . 3 ILE HB 1 1 18 9832 1 1 3 ILE HD11 H 2.285 5.822 -2.873 1.00 . A A . 3 ILE HD11 1 1 18 9833 1 1 3 ILE HD12 H 1.847 4.904 -1.413 1.00 . A A . 3 ILE HD12 1 1 18 9834 1 1 3 ILE HD13 H 0.836 6.270 -1.942 1.00 . A A . 3 ILE HD13 1 1 18 9835 1 1 3 ILE HG12 H 2.544 7.870 -1.358 1.00 . A A . 3 ILE HG12 1 1 18 9836 1 1 3 ILE HG13 H 3.756 6.620 -1.157 1.00 . A A . 3 ILE HG13 1 1 18 9837 1 1 3 ILE HG21 H 0.997 8.402 0.692 1.00 . A A . 3 ILE HG21 1 1 18 9838 1 1 3 ILE HG22 H 1.925 7.991 2.155 1.00 . A A . 3 ILE HG22 1 1 18 9839 1 1 3 ILE HG23 H 2.725 8.816 0.796 1.00 . A A . 3 ILE HG23 1 1 18 9840 1 1 3 ILE N N 3.623 4.674 0.816 1.00 . A A . 3 ILE N 1 1 18 9841 1 1 3 ILE O O 2.597 5.217 3.352 1.00 . A A . 3 ILE O 1 1 18 9842 1 1 4 TYR C C 2.932 8.560 5.137 1.00 . A A . 4 TYR C 1 1 18 9843 1 1 4 TYR CA C 3.706 7.287 4.826 1.00 . A A . 4 TYR CA 1 1 18 9844 1 1 4 TYR CB C 5.104 7.342 5.435 1.00 . A A . 4 TYR CB 1 1 18 9845 1 1 4 TYR CD1 C 5.213 5.028 6.430 1.00 . A A . 4 TYR CD1 1 1 18 9846 1 1 4 TYR CD2 C 6.907 5.688 4.826 1.00 . A A . 4 TYR CD2 1 1 18 9847 1 1 4 TYR CE1 C 5.818 3.772 6.553 1.00 . A A . 4 TYR CE1 1 1 18 9848 1 1 4 TYR CE2 C 7.512 4.431 4.949 1.00 . A A . 4 TYR CE2 1 1 18 9849 1 1 4 TYR CG C 5.757 5.987 5.566 1.00 . A A . 4 TYR CG 1 1 18 9850 1 1 4 TYR CZ C 6.967 3.474 5.811 1.00 . A A . 4 TYR CZ 1 1 18 9851 1 1 4 TYR H H 4.331 7.799 2.862 1.00 . A A . 4 TYR H 1 1 18 9852 1 1 4 TYR HA H 3.170 6.436 5.247 1.00 . A A . 4 TYR HA 1 1 18 9853 1 1 4 TYR HB2 H 5.734 7.971 4.805 1.00 . A A . 4 TYR HB2 1 1 18 9854 1 1 4 TYR HB3 H 5.037 7.793 6.424 1.00 . A A . 4 TYR HB3 1 1 18 9855 1 1 4 TYR HD1 H 4.326 5.258 7.002 1.00 . A A . 4 TYR HD1 1 1 18 9856 1 1 4 TYR HD2 H 7.327 6.428 4.160 1.00 . A A . 4 TYR HD2 1 1 18 9857 1 1 4 TYR HE1 H 5.398 3.033 7.219 1.00 . A A . 4 TYR HE1 1 1 18 9858 1 1 4 TYR HE2 H 8.399 4.201 4.376 1.00 . A A . 4 TYR HE2 1 1 18 9859 1 1 4 TYR HH H 8.435 2.292 6.316 1.00 . A A . 4 TYR HH 1 1 18 9860 1 1 4 TYR N N 3.811 7.114 3.392 1.00 . A A . 4 TYR N 1 1 18 9861 1 1 4 TYR O O 3.527 9.637 5.119 1.00 . A A . 4 TYR O 1 1 18 9862 1 1 4 TYR OH O 7.557 2.249 5.931 1.00 . A A . 4 TYR OH 1 1 18 9863 1 1 5 VAL C C 0.469 9.558 7.214 1.00 . A A . 5 VAL C 1 1 18 9864 1 1 5 VAL CA C 0.815 9.571 5.725 1.00 . A A . 5 VAL CA 1 1 18 9865 1 1 5 VAL CB C -0.423 9.583 4.825 1.00 . A A . 5 VAL CB 1 1 18 9866 1 1 5 VAL CG1 C -1.249 10.853 5.045 1.00 . A A . 5 VAL CG1 1 1 18 9867 1 1 5 VAL CG2 C -0.032 9.432 3.353 1.00 . A A . 5 VAL CG2 1 1 18 9868 1 1 5 VAL H H 1.167 7.539 5.426 1.00 . A A . 5 VAL H 1 1 18 9869 1 1 5 VAL HA H 1.398 10.465 5.507 1.00 . A A . 5 VAL HA 1 1 18 9870 1 1 5 VAL HB H -1.043 8.729 5.096 1.00 . A A . 5 VAL HB 1 1 18 9871 1 1 5 VAL HG11 H -1.926 10.704 5.886 1.00 . A A . 5 VAL HG11 1 1 18 9872 1 1 5 VAL HG12 H -0.581 11.687 5.259 1.00 . A A . 5 VAL HG12 1 1 18 9873 1 1 5 VAL HG13 H -1.827 11.070 4.147 1.00 . A A . 5 VAL HG13 1 1 18 9874 1 1 5 VAL HG21 H -0.844 9.796 2.722 1.00 . A A . 5 VAL HG21 1 1 18 9875 1 1 5 VAL HG22 H 0.869 10.011 3.155 1.00 . A A . 5 VAL HG22 1 1 18 9876 1 1 5 VAL HG23 H 0.155 8.381 3.133 1.00 . A A . 5 VAL HG23 1 1 18 9877 1 1 5 VAL N N 1.644 8.420 5.414 1.00 . A A . 5 VAL N 1 1 18 9878 1 1 5 VAL O O -0.234 8.665 7.685 1.00 . A A . 5 VAL O 1 1 18 9879 1 1 6 CYS C C -0.775 10.794 9.564 1.00 . A A . 6 CYS C 1 1 18 9880 1 1 6 CYS CA C 0.735 10.674 9.344 1.00 . A A . 6 CYS CA 1 1 18 9881 1 1 6 CYS CB C 1.495 11.852 9.956 1.00 . A A . 6 CYS CB 1 1 18 9882 1 1 6 CYS H H 1.550 11.282 7.526 1.00 . A A . 6 CYS H 1 1 18 9883 1 1 6 CYS HA H 1.122 9.765 9.803 1.00 . A A . 6 CYS HA 1 1 18 9884 1 1 6 CYS HB2 H 2.430 11.985 9.411 1.00 . A A . 6 CYS HB2 1 1 18 9885 1 1 6 CYS HB3 H 0.909 12.760 9.809 1.00 . A A . 6 CYS HB3 1 1 18 9886 1 1 6 CYS N N 0.980 10.559 7.917 1.00 . A A . 6 CYS N 1 1 18 9887 1 1 6 CYS O O -1.499 11.256 8.684 1.00 . A A . 6 CYS O 1 1 18 9888 1 1 6 CYS SG S 1.874 11.679 11.737 1.00 . A A . 6 CYS SG 1 1 18 9889 1 1 7 THR C C -2.862 11.494 12.154 1.00 . A A . 7 THR C 1 1 18 9890 1 1 7 THR CA C -2.614 10.422 11.090 1.00 . A A . 7 THR CA 1 1 18 9891 1 1 7 THR CB C -3.047 9.021 11.527 1.00 . A A . 7 THR CB 1 1 18 9892 1 1 7 THR CG2 C -2.823 7.972 10.436 1.00 . A A . 7 THR CG2 1 1 18 9893 1 1 7 THR H H -0.609 9.994 11.454 1.00 . A A . 7 THR H 1 1 18 9894 1 1 7 THR HA H -3.175 10.716 10.203 1.00 . A A . 7 THR HA 1 1 18 9895 1 1 7 THR HB H -4.085 9.021 11.859 1.00 . A A . 7 THR HB 1 1 18 9896 1 1 7 THR HG1 H -2.183 9.310 13.309 1.00 . A A . 7 THR HG1 1 1 18 9897 1 1 7 THR HG21 H -3.070 8.400 9.465 1.00 . A A . 7 THR HG21 1 1 18 9898 1 1 7 THR HG22 H -1.777 7.661 10.441 1.00 . A A . 7 THR HG22 1 1 18 9899 1 1 7 THR HG23 H -3.459 7.108 10.626 1.00 . A A . 7 THR HG23 1 1 18 9900 1 1 7 THR N N -1.204 10.369 10.744 1.00 . A A . 7 THR N 1 1 18 9901 1 1 7 THR O O -3.948 11.566 12.726 1.00 . A A . 7 THR O 1 1 18 9902 1 1 7 THR OG1 O -2.113 8.671 12.543 1.00 . A A . 7 THR OG1 1 1 18 9903 1 1 8 VAL C C -1.761 14.714 12.673 1.00 . A A . 8 VAL C 1 1 18 9904 1 1 8 VAL CA C -1.928 13.363 13.371 1.00 . A A . 8 VAL CA 1 1 18 9905 1 1 8 VAL CB C -0.904 13.135 14.486 1.00 . A A . 8 VAL CB 1 1 18 9906 1 1 8 VAL CG1 C 0.492 13.587 14.048 1.00 . A A . 8 VAL CG1 1 1 18 9907 1 1 8 VAL CG2 C -1.330 13.842 15.774 1.00 . A A . 8 VAL CG2 1 1 18 9908 1 1 8 VAL H H -0.955 12.233 11.917 1.00 . A A . 8 VAL H 1 1 18 9909 1 1 8 VAL HA H -2.923 13.318 13.813 1.00 . A A . 8 VAL HA 1 1 18 9910 1 1 8 VAL HB H -0.862 12.065 14.688 1.00 . A A . 8 VAL HB 1 1 18 9911 1 1 8 VAL HG11 H 1.202 12.778 14.212 1.00 . A A . 8 VAL HG11 1 1 18 9912 1 1 8 VAL HG12 H 0.474 13.847 12.990 1.00 . A A . 8 VAL HG12 1 1 18 9913 1 1 8 VAL HG13 H 0.791 14.458 14.631 1.00 . A A . 8 VAL HG13 1 1 18 9914 1 1 8 VAL HG21 H -0.488 13.872 16.467 1.00 . A A . 8 VAL HG21 1 1 18 9915 1 1 8 VAL HG22 H -1.646 14.859 15.543 1.00 . A A . 8 VAL HG22 1 1 18 9916 1 1 8 VAL HG23 H -2.157 13.297 16.230 1.00 . A A . 8 VAL HG23 1 1 18 9917 1 1 8 VAL N N -1.835 12.299 12.387 1.00 . A A . 8 VAL N 1 1 18 9918 1 1 8 VAL O O -1.675 15.750 13.330 1.00 . A A . 8 VAL O 1 1 18 9919 1 1 9 CYS C C -1.932 15.538 9.107 1.00 . A A . 9 CYS C 1 1 18 9920 1 1 9 CYS CA C -1.564 15.866 10.555 1.00 . A A . 9 CYS CA 1 1 18 9921 1 1 9 CYS CB C -0.151 16.441 10.669 1.00 . A A . 9 CYS CB 1 1 18 9922 1 1 9 CYS H H -1.790 13.812 10.823 1.00 . A A . 9 CYS H 1 1 18 9923 1 1 9 CYS HA H -2.250 16.605 10.970 1.00 . A A . 9 CYS HA 1 1 18 9924 1 1 9 CYS HB2 H -0.037 17.236 9.932 1.00 . A A . 9 CYS HB2 1 1 18 9925 1 1 9 CYS HB3 H -0.038 16.898 11.652 1.00 . A A . 9 CYS HB3 1 1 18 9926 1 1 9 CYS N N -1.719 14.660 11.350 1.00 . A A . 9 CYS N 1 1 18 9927 1 1 9 CYS O O -2.611 16.319 8.442 1.00 . A A . 9 CYS O 1 1 18 9928 1 1 9 CYS SG S 1.193 15.223 10.430 1.00 . A A . 9 CYS SG 1 1 18 9929 1 1 10 GLY C C -0.518 14.147 6.404 1.00 . A A . 10 GLY C 1 1 18 9930 1 1 10 GLY CA C -1.739 13.939 7.302 1.00 . A A . 10 GLY CA 1 1 18 9931 1 1 10 GLY H H -0.917 13.750 9.206 1.00 . A A . 10 GLY H 1 1 18 9932 1 1 10 GLY HA2 H -2.017 12.884 7.307 1.00 . A A . 10 GLY HA2 1 1 18 9933 1 1 10 GLY HA3 H -2.589 14.490 6.900 1.00 . A A . 10 GLY HA3 1 1 18 9934 1 1 10 GLY N N -1.468 14.380 8.659 1.00 . A A . 10 GLY N 1 1 18 9935 1 1 10 GLY O O -0.574 14.007 5.184 1.00 . A A . 10 GLY O 1 1 18 9936 1 1 11 TYR C C 1.996 13.712 5.210 1.00 . A A . 11 TYR C 1 1 18 9937 1 1 11 TYR CA C 1.844 14.724 6.336 1.00 . A A . 11 TYR CA 1 1 18 9938 1 1 11 TYR CB C 3.012 14.624 7.314 1.00 . A A . 11 TYR CB 1 1 18 9939 1 1 11 TYR CD1 C 4.515 15.975 5.807 1.00 . A A . 11 TYR CD1 1 1 18 9940 1 1 11 TYR CD2 C 5.440 14.051 6.957 1.00 . A A . 11 TYR CD2 1 1 18 9941 1 1 11 TYR CE1 C 5.761 16.222 5.218 1.00 . A A . 11 TYR CE1 1 1 18 9942 1 1 11 TYR CE2 C 6.686 14.297 6.367 1.00 . A A . 11 TYR CE2 1 1 18 9943 1 1 11 TYR CG C 4.355 14.890 6.678 1.00 . A A . 11 TYR CG 1 1 18 9944 1 1 11 TYR CZ C 6.846 15.382 5.497 1.00 . A A . 11 TYR CZ 1 1 18 9945 1 1 11 TYR H H 0.594 14.592 8.049 1.00 . A A . 11 TYR H 1 1 18 9946 1 1 11 TYR HA H 1.825 15.727 5.909 1.00 . A A . 11 TYR HA 1 1 18 9947 1 1 11 TYR HB2 H 2.857 15.347 8.116 1.00 . A A . 11 TYR HB2 1 1 18 9948 1 1 11 TYR HB3 H 3.022 13.622 7.743 1.00 . A A . 11 TYR HB3 1 1 18 9949 1 1 11 TYR HD1 H 3.679 16.623 5.593 1.00 . A A . 11 TYR HD1 1 1 18 9950 1 1 11 TYR HD2 H 5.317 13.214 7.628 1.00 . A A . 11 TYR HD2 1 1 18 9951 1 1 11 TYR HE1 H 5.884 17.058 4.547 1.00 . A A . 11 TYR HE1 1 1 18 9952 1 1 11 TYR HE2 H 7.522 13.649 6.582 1.00 . A A . 11 TYR HE2 1 1 18 9953 1 1 11 TYR HH H 8.487 16.411 5.262 1.00 . A A . 11 TYR HH 1 1 18 9954 1 1 11 TYR N N 0.602 14.489 7.044 1.00 . A A . 11 TYR N 1 1 18 9955 1 1 11 TYR O O 1.394 12.642 5.287 1.00 . A A . 11 TYR O 1 1 18 9956 1 1 11 TYR OH O 8.059 15.621 4.922 1.00 . A A . 11 TYR OH 1 1 18 9957 1 1 12 GLU C C 4.492 13.012 2.796 1.00 . A A . 12 GLU C 1 1 18 9958 1 1 12 GLU CA C 2.996 13.166 3.076 1.00 . A A . 12 GLU CA 1 1 18 9959 1 1 12 GLU CB C 2.253 13.662 1.833 1.00 . A A . 12 GLU CB 1 1 18 9960 1 1 12 GLU CD C 0.719 12.411 0.271 1.00 . A A . 12 GLU CD 1 1 18 9961 1 1 12 GLU CG C 0.901 12.963 1.687 1.00 . A A . 12 GLU CG 1 1 18 9962 1 1 12 GLU H H 3.268 14.932 4.147 1.00 . A A . 12 GLU H 1 1 18 9963 1 1 12 GLU HA H 2.576 12.207 3.383 1.00 . A A . 12 GLU HA 1 1 18 9964 1 1 12 GLU HB2 H 2.104 14.740 1.902 1.00 . A A . 12 GLU HB2 1 1 18 9965 1 1 12 GLU HB3 H 2.859 13.480 0.946 1.00 . A A . 12 GLU HB3 1 1 18 9966 1 1 12 GLU HE2 H -0.999 12.997 -0.228 1.00 . A A . 12 GLU HE2 1 1 18 9967 1 1 12 GLU HG2 H 0.827 12.150 2.410 1.00 . A A . 12 GLU HG2 1 1 18 9968 1 1 12 GLU HG3 H 0.098 13.664 1.912 1.00 . A A . 12 GLU HG3 1 1 18 9969 1 1 12 GLU N N 2.782 14.059 4.202 1.00 . A A . 12 GLU N 1 1 18 9970 1 1 12 GLU O O 5.197 13.965 2.475 1.00 . A A . 12 GLU O 1 1 18 9971 1 1 12 GLU OE1 O 1.286 11.359 -0.061 1.00 . A A . 12 GLU OE1 1 1 18 9972 1 1 12 GLU OE2 O -0.042 13.115 -0.495 1.00 . A A . 12 GLU OE2 1 1 18 9973 1 1 13 TYR C C 6.488 10.456 1.561 1.00 . A A . 13 TYR C 1 1 18 9974 1 1 13 TYR CA C 6.363 11.459 2.699 1.00 . A A . 13 TYR CA 1 1 18 9975 1 1 13 TYR CB C 6.973 10.902 3.982 1.00 . A A . 13 TYR CB 1 1 18 9976 1 1 13 TYR CD1 C 9.421 11.292 3.520 1.00 . A A . 13 TYR CD1 1 1 18 9977 1 1 13 TYR CD2 C 8.658 9.026 3.928 1.00 . A A . 13 TYR CD2 1 1 18 9978 1 1 13 TYR CE1 C 10.730 10.822 3.356 1.00 . A A . 13 TYR CE1 1 1 18 9979 1 1 13 TYR CE2 C 9.966 8.557 3.764 1.00 . A A . 13 TYR CE2 1 1 18 9980 1 1 13 TYR CG C 8.385 10.394 3.805 1.00 . A A . 13 TYR CG 1 1 18 9981 1 1 13 TYR CZ C 11.002 9.454 3.478 1.00 . A A . 13 TYR CZ 1 1 18 9982 1 1 13 TYR H H 4.343 11.022 3.194 1.00 . A A . 13 TYR H 1 1 18 9983 1 1 13 TYR HA H 6.889 12.373 2.425 1.00 . A A . 13 TYR HA 1 1 18 9984 1 1 13 TYR HB2 H 6.978 11.688 4.736 1.00 . A A . 13 TYR HB2 1 1 18 9985 1 1 13 TYR HB3 H 6.351 10.081 4.337 1.00 . A A . 13 TYR HB3 1 1 18 9986 1 1 13 TYR HD1 H 9.210 12.347 3.426 1.00 . A A . 13 TYR HD1 1 1 18 9987 1 1 13 TYR HD2 H 7.858 8.335 4.148 1.00 . A A . 13 TYR HD2 1 1 18 9988 1 1 13 TYR HE1 H 11.528 11.514 3.136 1.00 . A A . 13 TYR HE1 1 1 18 9989 1 1 13 TYR HE2 H 10.177 7.502 3.858 1.00 . A A . 13 TYR HE2 1 1 18 9990 1 1 13 TYR HH H 12.576 9.030 2.406 1.00 . A A . 13 TYR HH 1 1 18 9991 1 1 13 TYR N N 4.965 11.771 2.928 1.00 . A A . 13 TYR N 1 1 18 9992 1 1 13 TYR O O 5.507 9.783 1.251 1.00 . A A . 13 TYR O 1 1 18 9993 1 1 13 TYR OH O 12.277 8.995 3.318 1.00 . A A . 13 TYR OH 1 1 18 9994 1 1 14 ASP C C 9.074 8.534 0.219 1.00 . A A . 14 ASP C 1 1 18 9995 1 1 14 ASP CA C 7.897 9.450 -0.127 1.00 . A A . 14 ASP CA 1 1 18 9996 1 1 14 ASP CB C 8.244 10.198 -1.415 1.00 . A A . 14 ASP CB 1 1 18 9997 1 1 14 ASP CG C 8.033 9.399 -2.703 1.00 . A A . 14 ASP CG 1 1 18 9998 1 1 14 ASP H H 8.464 10.926 1.229 1.00 . A A . 14 ASP H 1 1 18 9999 1 1 14 ASP HA H 6.961 8.903 -0.237 1.00 . A A . 14 ASP HA 1 1 18 10000 1 1 14 ASP HB2 H 7.640 11.104 -1.465 1.00 . A A . 14 ASP HB2 1 1 18 10001 1 1 14 ASP HB3 H 9.286 10.512 -1.367 1.00 . A A . 14 ASP HB3 1 1 18 10002 1 1 14 ASP HD2 H 9.707 8.562 -2.907 1.00 . A A . 14 ASP HD2 1 1 18 10003 1 1 14 ASP N N 7.671 10.375 0.970 1.00 . A A . 14 ASP N 1 1 18 10004 1 1 14 ASP O O 10.241 8.875 0.040 1.00 . A A . 14 ASP O 1 1 18 10005 1 1 14 ASP OD1 O 7.232 9.783 -3.569 1.00 . A A . 14 ASP OD1 1 1 18 10006 1 1 14 ASP OD2 O 8.741 8.325 -2.801 1.00 . A A . 14 ASP OD2 1 1 18 10007 1 1 15 PRO C C 10.870 6.338 0.167 1.00 . A A . 15 PRO C 1 1 18 10008 1 1 15 PRO CA C 9.682 6.327 1.119 1.00 . A A . 15 PRO CA 1 1 18 10009 1 1 15 PRO CB C 8.910 5.013 1.016 1.00 . A A . 15 PRO CB 1 1 18 10010 1 1 15 PRO CD C 7.372 6.912 0.947 1.00 . A A . 15 PRO CD 1 1 18 10011 1 1 15 PRO CG C 7.494 5.481 1.464 1.00 . A A . 15 PRO CG 1 1 18 10012 1 1 15 PRO HA H 10.027 6.485 2.140 1.00 . A A . 15 PRO HA 1 1 18 10013 1 1 15 PRO HB2 H 8.974 4.572 0.021 1.00 . A A . 15 PRO HB2 1 1 18 10014 1 1 15 PRO HB3 H 9.281 4.319 1.770 1.00 . A A . 15 PRO HB3 1 1 18 10015 1 1 15 PRO HD2 H 6.785 6.946 0.029 1.00 . A A . 15 PRO HD2 1 1 18 10016 1 1 15 PRO HD3 H 6.917 7.544 1.711 1.00 . A A . 15 PRO HD3 1 1 18 10017 1 1 15 PRO HG2 H 6.958 4.810 0.793 1.00 . A A . 15 PRO HG2 1 1 18 10018 1 1 15 PRO HG3 H 7.128 5.377 2.487 1.00 . A A . 15 PRO HG3 1 1 18 10019 1 1 15 PRO N N 8.734 7.346 0.725 1.00 . A A . 15 PRO N 1 1 18 10020 1 1 15 PRO O O 10.704 5.961 -0.993 1.00 . A A . 15 PRO O 1 1 18 10021 1 1 16 ALA C C 14.390 7.329 0.671 1.00 . A A . 16 ALA C 1 1 18 10022 1 1 16 ALA CA C 13.218 6.813 -0.166 1.00 . A A . 16 ALA CA 1 1 18 10023 1 1 16 ALA CB C 12.951 7.684 -1.395 1.00 . A A . 16 ALA CB 1 1 18 10024 1 1 16 ALA H H 12.149 7.065 1.605 1.00 . A A . 16 ALA H 1 1 18 10025 1 1 16 ALA HA H 13.437 5.797 -0.496 1.00 . A A . 16 ALA HA 1 1 18 10026 1 1 16 ALA HB1 H 13.875 7.806 -1.961 1.00 . A A . 16 ALA HB1 1 1 18 10027 1 1 16 ALA HB2 H 12.201 7.204 -2.023 1.00 . A A . 16 ALA HB2 1 1 18 10028 1 1 16 ALA HB3 H 12.589 8.661 -1.076 1.00 . A A . 16 ALA HB3 1 1 18 10029 1 1 16 ALA N N 12.023 6.761 0.661 1.00 . A A . 16 ALA N 1 1 18 10030 1 1 16 ALA O O 15.110 8.230 0.246 1.00 . A A . 16 ALA O 1 1 18 10031 1 1 17 PHE C C 16.581 5.958 2.984 1.00 . A A . 17 PHE C 1 1 18 10032 1 1 17 PHE CA C 15.617 7.123 2.745 1.00 . A A . 17 PHE CA 1 1 18 10033 1 1 17 PHE CB C 14.967 7.510 4.075 1.00 . A A . 17 PHE CB 1 1 18 10034 1 1 17 PHE CD1 C 15.751 9.883 3.921 1.00 . A A . 17 PHE CD1 1 1 18 10035 1 1 17 PHE CD2 C 15.826 8.826 6.024 1.00 . A A . 17 PHE CD2 1 1 18 10036 1 1 17 PHE CE1 C 16.279 11.069 4.499 1.00 . A A . 17 PHE CE1 1 1 18 10037 1 1 17 PHE CE2 C 16.355 10.010 6.602 1.00 . A A . 17 PHE CE2 1 1 18 10038 1 1 17 PHE CG C 15.536 8.787 4.696 1.00 . A A . 17 PHE CG 1 1 18 10039 1 1 17 PHE CZ C 16.570 11.107 5.827 1.00 . A A . 17 PHE CZ 1 1 18 10040 1 1 17 PHE H H 13.954 6.001 2.183 1.00 . A A . 17 PHE H 1 1 18 10041 1 1 17 PHE HA H 16.153 7.946 2.273 1.00 . A A . 17 PHE HA 1 1 18 10042 1 1 17 PHE HB2 H 13.895 7.641 3.919 1.00 . A A . 17 PHE HB2 1 1 18 10043 1 1 17 PHE HB3 H 15.088 6.689 4.781 1.00 . A A . 17 PHE HB3 1 1 18 10044 1 1 17 PHE HD1 H 15.518 9.852 2.857 1.00 . A A . 17 PHE HD1 1 1 18 10045 1 1 17 PHE HD2 H 15.654 7.947 6.646 1.00 . A A . 17 PHE HD2 1 1 18 10046 1 1 17 PHE HE1 H 16.452 11.947 3.877 1.00 . A A . 17 PHE HE1 1 1 18 10047 1 1 17 PHE HE2 H 16.588 10.041 7.666 1.00 . A A . 17 PHE HE2 1 1 18 10048 1 1 17 PHE HZ H 16.976 12.017 6.269 1.00 . A A . 17 PHE HZ 1 1 18 10049 1 1 17 PHE N N 14.544 6.734 1.845 1.00 . A A . 17 PHE N 1 1 18 10050 1 1 17 PHE O O 16.618 5.009 2.202 1.00 . A A . 17 PHE O 1 1 18 10051 1 1 18 GLU C C 18.400 4.903 5.937 1.00 . A A . 18 GLU C 1 1 18 10052 1 1 18 GLU CA C 18.298 5.039 4.417 1.00 . A A . 18 GLU CA 1 1 18 10053 1 1 18 GLU CB C 19.668 5.333 3.801 1.00 . A A . 18 GLU CB 1 1 18 10054 1 1 18 GLU CD C 21.949 4.402 3.267 1.00 . A A . 18 GLU CD 1 1 18 10055 1 1 18 GLU CG C 20.598 4.125 3.929 1.00 . A A . 18 GLU CG 1 1 18 10056 1 1 18 GLU H H 17.300 6.846 4.696 1.00 . A A . 18 GLU H 1 1 18 10057 1 1 18 GLU HA H 17.904 4.117 3.988 1.00 . A A . 18 GLU HA 1 1 18 10058 1 1 18 GLU HB2 H 19.548 5.594 2.749 1.00 . A A . 18 GLU HB2 1 1 18 10059 1 1 18 GLU HB3 H 20.114 6.196 4.295 1.00 . A A . 18 GLU HB3 1 1 18 10060 1 1 18 GLU HE2 H 22.641 6.015 3.949 1.00 . A A . 18 GLU HE2 1 1 18 10061 1 1 18 GLU HG2 H 20.747 3.888 4.983 1.00 . A A . 18 GLU HG2 1 1 18 10062 1 1 18 GLU HG3 H 20.134 3.253 3.468 1.00 . A A . 18 GLU HG3 1 1 18 10063 1 1 18 GLU N N 17.337 6.070 4.066 1.00 . A A . 18 GLU N 1 1 18 10064 1 1 18 GLU O O 18.095 3.847 6.492 1.00 . A A . 18 GLU O 1 1 18 10065 1 1 18 GLU OE1 O 22.156 4.028 2.103 1.00 . A A . 18 GLU OE1 1 1 18 10066 1 1 18 GLU OE2 O 22.800 5.029 4.006 1.00 . A A . 18 GLU OE2 1 1 18 10067 1 1 19 ASP C C 17.726 5.385 8.655 1.00 . A A . 19 ASP C 1 1 18 10068 1 1 19 ASP CA C 18.972 6.000 8.015 1.00 . A A . 19 ASP CA 1 1 18 10069 1 1 19 ASP CB C 19.116 7.430 8.540 1.00 . A A . 19 ASP CB 1 1 18 10070 1 1 19 ASP CG C 20.229 7.632 9.569 1.00 . A A . 19 ASP CG 1 1 18 10071 1 1 19 ASP H H 19.073 6.840 6.112 1.00 . A A . 19 ASP H 1 1 18 10072 1 1 19 ASP HA H 19.873 5.422 8.219 1.00 . A A . 19 ASP HA 1 1 18 10073 1 1 19 ASP HB2 H 19.298 8.094 7.695 1.00 . A A . 19 ASP HB2 1 1 18 10074 1 1 19 ASP HB3 H 18.169 7.735 8.985 1.00 . A A . 19 ASP HB3 1 1 18 10075 1 1 19 ASP HD2 H 22.003 8.239 9.756 1.00 . A A . 19 ASP HD2 1 1 18 10076 1 1 19 ASP N N 18.827 5.985 6.569 1.00 . A A . 19 ASP N 1 1 18 10077 1 1 19 ASP O O 17.789 4.297 9.225 1.00 . A A . 19 ASP O 1 1 18 10078 1 1 19 ASP OD1 O 20.175 7.091 10.684 1.00 . A A . 19 ASP OD1 1 1 18 10079 1 1 19 ASP OD2 O 21.197 8.394 9.184 1.00 . A A . 19 ASP OD2 1 1 18 10080 1 1 20 LEU C C 15.625 4.977 10.449 1.00 . A A . 20 LEU C 1 1 18 10081 1 1 20 LEU CA C 15.363 5.647 9.098 1.00 . A A . 20 LEU CA 1 1 18 10082 1 1 20 LEU CB C 14.629 4.751 8.099 1.00 . A A . 20 LEU CB 1 1 18 10083 1 1 20 LEU CD1 C 12.777 4.359 9.765 1.00 . A A . 20 LEU CD1 1 1 18 10084 1 1 20 LEU CD2 C 12.855 3.027 7.608 1.00 . A A . 20 LEU CD2 1 1 18 10085 1 1 20 LEU CG C 13.671 3.720 8.700 1.00 . A A . 20 LEU CG 1 1 18 10086 1 1 20 LEU H H 16.580 6.993 8.073 1.00 . A A . 20 LEU H 1 1 18 10087 1 1 20 LEU HA H 14.738 6.526 9.264 1.00 . A A . 20 LEU HA 1 1 18 10088 1 1 20 LEU HB2 H 14.065 5.388 7.417 1.00 . A A . 20 LEU HB2 1 1 18 10089 1 1 20 LEU HB3 H 15.371 4.223 7.501 1.00 . A A . 20 LEU HB3 1 1 18 10090 1 1 20 LEU HD11 H 12.734 3.710 10.639 1.00 . A A . 20 LEU HD11 1 1 18 10091 1 1 20 LEU HD12 H 13.187 5.327 10.052 1.00 . A A . 20 LEU HD12 1 1 18 10092 1 1 20 LEU HD13 H 11.773 4.495 9.363 1.00 . A A . 20 LEU HD13 1 1 18 10093 1 1 20 LEU HD21 H 11.994 2.533 8.056 1.00 . A A . 20 LEU HD21 1 1 18 10094 1 1 20 LEU HD22 H 12.514 3.768 6.884 1.00 . A A . 20 LEU HD22 1 1 18 10095 1 1 20 LEU HD23 H 13.478 2.287 7.104 1.00 . A A . 20 LEU HD23 1 1 18 10096 1 1 20 LEU HG H 14.263 2.952 9.196 1.00 . A A . 20 LEU HG 1 1 18 10097 1 1 20 LEU N N 16.622 6.109 8.539 1.00 . A A . 20 LEU N 1 1 18 10098 1 1 20 LEU O O 15.782 3.764 10.555 1.00 . A A . 20 LEU O 1 1 18 10099 1 1 21 PRO C C 14.623 4.802 13.436 1.00 . A A . 21 PRO C 1 1 18 10100 1 1 21 PRO CA C 15.901 5.392 12.858 1.00 . A A . 21 PRO CA 1 1 18 10101 1 1 21 PRO CB C 16.297 6.670 13.595 1.00 . A A . 21 PRO CB 1 1 18 10102 1 1 21 PRO CD C 15.489 7.242 11.403 1.00 . A A . 21 PRO CD 1 1 18 10103 1 1 21 PRO CG C 15.630 7.747 12.837 1.00 . A A . 21 PRO CG 1 1 18 10104 1 1 21 PRO HA H 16.706 4.658 12.912 1.00 . A A . 21 PRO HA 1 1 18 10105 1 1 21 PRO HB2 H 16.011 6.646 14.647 1.00 . A A . 21 PRO HB2 1 1 18 10106 1 1 21 PRO HB3 H 17.371 6.826 13.491 1.00 . A A . 21 PRO HB3 1 1 18 10107 1 1 21 PRO HD2 H 14.511 7.499 10.995 1.00 . A A . 21 PRO HD2 1 1 18 10108 1 1 21 PRO HD3 H 16.280 7.662 10.783 1.00 . A A . 21 PRO HD3 1 1 18 10109 1 1 21 PRO HG2 H 14.646 7.781 13.304 1.00 . A A . 21 PRO HG2 1 1 18 10110 1 1 21 PRO HG3 H 16.116 8.721 12.887 1.00 . A A . 21 PRO HG3 1 1 18 10111 1 1 21 PRO N N 15.669 5.809 11.493 1.00 . A A . 21 PRO N 1 1 18 10112 1 1 21 PRO O O 13.567 4.962 12.828 1.00 . A A . 21 PRO O 1 1 18 10113 1 1 22 ASP C C 12.928 4.555 16.151 1.00 . A A . 22 ASP C 1 1 18 10114 1 1 22 ASP CA C 13.580 3.536 15.213 1.00 . A A . 22 ASP CA 1 1 18 10115 1 1 22 ASP CB C 13.981 2.317 16.046 1.00 . A A . 22 ASP CB 1 1 18 10116 1 1 22 ASP CG C 15.308 2.454 16.796 1.00 . A A . 22 ASP CG 1 1 18 10117 1 1 22 ASP H H 15.603 4.014 15.068 1.00 . A A . 22 ASP H 1 1 18 10118 1 1 22 ASP HA H 12.923 3.245 14.394 1.00 . A A . 22 ASP HA 1 1 18 10119 1 1 22 ASP HB2 H 13.191 2.114 16.770 1.00 . A A . 22 ASP HB2 1 1 18 10120 1 1 22 ASP HB3 H 14.041 1.450 15.388 1.00 . A A . 22 ASP HB3 1 1 18 10121 1 1 22 ASP HD2 H 16.322 1.980 15.281 1.00 . A A . 22 ASP HD2 1 1 18 10122 1 1 22 ASP N N 14.739 4.140 14.578 1.00 . A A . 22 ASP N 1 1 18 10123 1 1 22 ASP O O 12.708 4.270 17.328 1.00 . A A . 22 ASP O 1 1 18 10124 1 1 22 ASP OD1 O 15.389 3.130 17.831 1.00 . A A . 22 ASP OD1 1 1 18 10125 1 1 22 ASP OD2 O 16.299 1.821 16.268 1.00 . A A . 22 ASP OD2 1 1 18 10126 1 1 23 ASP C C 11.947 8.054 15.515 1.00 . A A . 23 ASP C 1 1 18 10127 1 1 23 ASP CA C 12.019 6.786 16.368 1.00 . A A . 23 ASP CA 1 1 18 10128 1 1 23 ASP CB C 12.834 7.105 17.622 1.00 . A A . 23 ASP CB 1 1 18 10129 1 1 23 ASP CG C 12.378 8.345 18.392 1.00 . A A . 23 ASP CG 1 1 18 10130 1 1 23 ASP H H 12.823 5.947 14.639 1.00 . A A . 23 ASP H 1 1 18 10131 1 1 23 ASP HA H 11.033 6.407 16.634 1.00 . A A . 23 ASP HA 1 1 18 10132 1 1 23 ASP HB2 H 12.795 6.245 18.291 1.00 . A A . 23 ASP HB2 1 1 18 10133 1 1 23 ASP HB3 H 13.878 7.237 17.335 1.00 . A A . 23 ASP HB3 1 1 18 10134 1 1 23 ASP HD2 H 12.730 9.456 19.871 1.00 . A A . 23 ASP HD2 1 1 18 10135 1 1 23 ASP N N 12.641 5.722 15.596 1.00 . A A . 23 ASP N 1 1 18 10136 1 1 23 ASP O O 12.463 9.100 15.907 1.00 . A A . 23 ASP O 1 1 18 10137 1 1 23 ASP OD1 O 11.368 8.977 18.045 1.00 . A A . 23 ASP OD1 1 1 18 10138 1 1 23 ASP OD2 O 13.116 8.662 19.402 1.00 . A A . 23 ASP OD2 1 1 18 10139 1 1 24 TRP C C 9.899 9.815 13.852 1.00 . A A . 24 TRP C 1 1 18 10140 1 1 24 TRP CA C 11.158 9.043 13.454 1.00 . A A . 24 TRP CA 1 1 18 10141 1 1 24 TRP CB C 11.133 8.568 11.999 1.00 . A A . 24 TRP CB 1 1 18 10142 1 1 24 TRP CD1 C 12.563 10.442 10.949 1.00 . A A . 24 TRP CD1 1 1 18 10143 1 1 24 TRP CD2 C 10.679 10.058 9.848 1.00 . A A . 24 TRP CD2 1 1 18 10144 1 1 24 TRP CE2 C 11.344 11.072 9.188 1.00 . A A . 24 TRP CE2 1 1 18 10145 1 1 24 TRP CE3 C 9.439 9.579 9.392 1.00 . A A . 24 TRP CE3 1 1 18 10146 1 1 24 TRP CG C 11.477 9.660 10.983 1.00 . A A . 24 TRP CG 1 1 18 10147 1 1 24 TRP CH2 C 9.611 11.231 7.565 1.00 . A A . 24 TRP CH2 1 1 18 10148 1 1 24 TRP CZ2 C 10.846 11.693 8.036 1.00 . A A . 24 TRP CZ2 1 1 18 10149 1 1 24 TRP CZ3 C 8.955 10.209 8.240 1.00 . A A . 24 TRP CZ3 1 1 18 10150 1 1 24 TRP H H 10.887 7.066 14.053 1.00 . A A . 24 TRP H 1 1 18 10151 1 1 24 TRP HA H 12.036 9.678 13.564 1.00 . A A . 24 TRP HA 1 1 18 10152 1 1 24 TRP HB2 H 11.837 7.744 11.884 1.00 . A A . 24 TRP HB2 1 1 18 10153 1 1 24 TRP HB3 H 10.141 8.175 11.773 1.00 . A A . 24 TRP HB3 1 1 18 10154 1 1 24 TRP HD1 H 13.375 10.397 11.675 1.00 . A A . 24 TRP HD1 1 1 18 10155 1 1 24 TRP HE1 H 13.283 12.054 9.623 1.00 . A A . 24 TRP HE1 1 1 18 10156 1 1 24 TRP HE3 H 8.895 8.779 9.896 1.00 . A A . 24 TRP HE3 1 1 18 10157 1 1 24 TRP HH2 H 9.167 11.671 6.672 1.00 . A A . 24 TRP HH2 1 1 18 10158 1 1 24 TRP HZ2 H 11.390 12.492 7.533 1.00 . A A . 24 TRP HZ2 1 1 18 10159 1 1 24 TRP HZ3 H 7.995 9.874 7.845 1.00 . A A . 24 TRP HZ3 1 1 18 10160 1 1 24 TRP N N 11.304 7.920 14.365 1.00 . A A . 24 TRP N 1 1 18 10161 1 1 24 TRP NE1 N 12.526 11.313 9.879 1.00 . A A . 24 TRP NE1 1 1 18 10162 1 1 24 TRP O O 8.885 9.217 14.208 1.00 . A A . 24 TRP O 1 1 18 10163 1 1 25 ALA C C 8.577 12.922 12.953 1.00 . A A . 25 ALA C 1 1 18 10164 1 1 25 ALA CA C 8.888 11.995 14.130 1.00 . A A . 25 ALA CA 1 1 18 10165 1 1 25 ALA CB C 9.219 12.767 15.409 1.00 . A A . 25 ALA CB 1 1 18 10166 1 1 25 ALA H H 10.834 11.614 13.491 1.00 . A A . 25 ALA H 1 1 18 10167 1 1 25 ALA HA H 8.024 11.358 14.318 1.00 . A A . 25 ALA HA 1 1 18 10168 1 1 25 ALA HB1 H 9.961 12.214 15.985 1.00 . A A . 25 ALA HB1 1 1 18 10169 1 1 25 ALA HB2 H 9.618 13.747 15.148 1.00 . A A . 25 ALA HB2 1 1 18 10170 1 1 25 ALA HB3 H 8.313 12.890 16.004 1.00 . A A . 25 ALA HB3 1 1 18 10171 1 1 25 ALA N N 10.006 11.134 13.781 1.00 . A A . 25 ALA N 1 1 18 10172 1 1 25 ALA O O 9.487 13.428 12.299 1.00 . A A . 25 ALA O 1 1 18 10173 1 1 26 CYS C C 7.647 15.274 11.689 1.00 . A A . 26 CYS C 1 1 18 10174 1 1 26 CYS CA C 6.844 13.973 11.632 1.00 . A A . 26 CYS CA 1 1 18 10175 1 1 26 CYS CB C 5.337 14.228 11.692 1.00 . A A . 26 CYS CB 1 1 18 10176 1 1 26 CYS H H 6.553 12.699 13.255 1.00 . A A . 26 CYS H 1 1 18 10177 1 1 26 CYS HA H 7.045 13.434 10.707 1.00 . A A . 26 CYS HA 1 1 18 10178 1 1 26 CYS HB2 H 4.897 13.552 12.424 1.00 . A A . 26 CYS HB2 1 1 18 10179 1 1 26 CYS HB3 H 5.168 15.243 12.053 1.00 . A A . 26 CYS HB3 1 1 18 10180 1 1 26 CYS N N 7.287 13.115 12.719 1.00 . A A . 26 CYS N 1 1 18 10181 1 1 26 CYS O O 7.932 15.819 12.753 1.00 . A A . 26 CYS O 1 1 18 10182 1 1 26 CYS SG S 4.459 14.020 10.099 1.00 . A A . 26 CYS SG 1 1 18 10183 1 1 27 PRO C C 7.836 18.184 10.405 1.00 . A A . 27 PRO C 1 1 18 10184 1 1 27 PRO CA C 8.769 16.984 10.321 1.00 . A A . 27 PRO CA 1 1 18 10185 1 1 27 PRO CB C 9.380 16.860 8.927 1.00 . A A . 27 PRO CB 1 1 18 10186 1 1 27 PRO CD C 7.690 15.151 9.232 1.00 . A A . 27 PRO CD 1 1 18 10187 1 1 27 PRO CG C 8.205 16.130 8.180 1.00 . A A . 27 PRO CG 1 1 18 10188 1 1 27 PRO HA H 9.553 17.072 11.074 1.00 . A A . 27 PRO HA 1 1 18 10189 1 1 27 PRO HB2 H 9.635 17.830 8.500 1.00 . A A . 27 PRO HB2 1 1 18 10190 1 1 27 PRO HB3 H 10.258 16.217 8.978 1.00 . A A . 27 PRO HB3 1 1 18 10191 1 1 27 PRO HD2 H 6.616 14.992 9.122 1.00 . A A . 27 PRO HD2 1 1 18 10192 1 1 27 PRO HD3 H 8.225 14.205 9.149 1.00 . A A . 27 PRO HD3 1 1 18 10193 1 1 27 PRO HG2 H 7.371 16.721 7.800 1.00 . A A . 27 PRO HG2 1 1 18 10194 1 1 27 PRO HG3 H 8.726 15.627 7.365 1.00 . A A . 27 PRO HG3 1 1 18 10195 1 1 27 PRO N N 8.008 15.766 10.503 1.00 . A A . 27 PRO N 1 1 18 10196 1 1 27 PRO O O 8.248 19.282 10.035 1.00 . A A . 27 PRO O 1 1 18 10197 1 1 28 VAL C C 5.021 18.999 12.390 1.00 . A A . 28 VAL C 1 1 18 10198 1 1 28 VAL CA C 5.653 19.037 10.997 1.00 . A A . 28 VAL CA 1 1 18 10199 1 1 28 VAL CB C 4.622 18.941 9.870 1.00 . A A . 28 VAL CB 1 1 18 10200 1 1 28 VAL CG1 C 3.946 20.292 9.628 1.00 . A A . 28 VAL CG1 1 1 18 10201 1 1 28 VAL CG2 C 5.260 18.410 8.586 1.00 . A A . 28 VAL CG2 1 1 18 10202 1 1 28 VAL H H 6.292 17.063 11.177 1.00 . A A . 28 VAL H 1 1 18 10203 1 1 28 VAL HA H 6.192 19.978 10.881 1.00 . A A . 28 VAL HA 1 1 18 10204 1 1 28 VAL HB H 3.852 18.233 10.179 1.00 . A A . 28 VAL HB 1 1 18 10205 1 1 28 VAL HG11 H 4.708 21.064 9.513 1.00 . A A . 28 VAL HG11 1 1 18 10206 1 1 28 VAL HG12 H 3.342 20.240 8.722 1.00 . A A . 28 VAL HG12 1 1 18 10207 1 1 28 VAL HG13 H 3.308 20.537 10.476 1.00 . A A . 28 VAL HG13 1 1 18 10208 1 1 28 VAL HG21 H 4.536 18.459 7.772 1.00 . A A . 28 VAL HG21 1 1 18 10209 1 1 28 VAL HG22 H 6.130 19.017 8.335 1.00 . A A . 28 VAL HG22 1 1 18 10210 1 1 28 VAL HG23 H 5.570 17.375 8.735 1.00 . A A . 28 VAL HG23 1 1 18 10211 1 1 28 VAL N N 6.620 17.960 10.878 1.00 . A A . 28 VAL N 1 1 18 10212 1 1 28 VAL O O 5.322 19.842 13.234 1.00 . A A . 28 VAL O 1 1 18 10213 1 1 29 CYS C C 4.535 17.535 14.927 1.00 . A A . 29 CYS C 1 1 18 10214 1 1 29 CYS CA C 3.483 17.854 13.864 1.00 . A A . 29 CYS CA 1 1 18 10215 1 1 29 CYS CB C 2.393 16.781 13.797 1.00 . A A . 29 CYS CB 1 1 18 10216 1 1 29 CYS H H 3.920 17.331 11.895 1.00 . A A . 29 CYS H 1 1 18 10217 1 1 29 CYS HA H 2.992 18.803 14.078 1.00 . A A . 29 CYS HA 1 1 18 10218 1 1 29 CYS HB2 H 1.876 16.750 14.755 1.00 . A A . 29 CYS HB2 1 1 18 10219 1 1 29 CYS HB3 H 1.660 17.076 13.047 1.00 . A A . 29 CYS HB3 1 1 18 10220 1 1 29 CYS N N 4.159 18.013 12.586 1.00 . A A . 29 CYS N 1 1 18 10221 1 1 29 CYS O O 4.465 18.041 16.047 1.00 . A A . 29 CYS O 1 1 18 10222 1 1 29 CYS SG S 2.996 15.100 13.401 1.00 . A A . 29 CYS SG 1 1 18 10223 1 1 30 GLY C C 6.091 15.176 16.377 1.00 . A A . 30 GLY C 1 1 18 10224 1 1 30 GLY CA C 6.550 16.302 15.449 1.00 . A A . 30 GLY CA 1 1 18 10225 1 1 30 GLY H H 5.534 16.288 13.629 1.00 . A A . 30 GLY H 1 1 18 10226 1 1 30 GLY HA2 H 7.418 15.975 14.875 1.00 . A A . 30 GLY HA2 1 1 18 10227 1 1 30 GLY HA3 H 6.864 17.162 16.040 1.00 . A A . 30 GLY HA3 1 1 18 10228 1 1 30 GLY N N 5.485 16.696 14.541 1.00 . A A . 30 GLY N 1 1 18 10229 1 1 30 GLY O O 6.512 15.109 17.531 1.00 . A A . 30 GLY O 1 1 18 10230 1 1 31 ALA C C 5.557 11.958 16.320 1.00 . A A . 31 ALA C 1 1 18 10231 1 1 31 ALA CA C 4.714 13.202 16.606 1.00 . A A . 31 ALA CA 1 1 18 10232 1 1 31 ALA CB C 3.236 12.994 16.268 1.00 . A A . 31 ALA CB 1 1 18 10233 1 1 31 ALA H H 4.897 14.383 14.900 1.00 . A A . 31 ALA H 1 1 18 10234 1 1 31 ALA HA H 4.799 13.455 17.662 1.00 . A A . 31 ALA HA 1 1 18 10235 1 1 31 ALA HB1 H 2.638 13.754 16.770 1.00 . A A . 31 ALA HB1 1 1 18 10236 1 1 31 ALA HB2 H 3.095 13.075 15.190 1.00 . A A . 31 ALA HB2 1 1 18 10237 1 1 31 ALA HB3 H 2.923 12.005 16.601 1.00 . A A . 31 ALA HB3 1 1 18 10238 1 1 31 ALA N N 5.234 14.321 15.840 1.00 . A A . 31 ALA N 1 1 18 10239 1 1 31 ALA O O 6.150 11.838 15.249 1.00 . A A . 31 ALA O 1 1 18 10240 1 1 32 SER C C 5.809 9.009 15.994 1.00 . A A . 32 SER C 1 1 18 10241 1 1 32 SER CA C 6.346 9.832 17.165 1.00 . A A . 32 SER CA 1 1 18 10242 1 1 32 SER CB C 6.299 9.014 18.456 1.00 . A A . 32 SER CB 1 1 18 10243 1 1 32 SER H H 5.100 11.169 18.165 1.00 . A A . 32 SER H 1 1 18 10244 1 1 32 SER HA H 7.372 10.148 16.972 1.00 . A A . 32 SER HA 1 1 18 10245 1 1 32 SER HB2 H 6.761 8.041 18.286 1.00 . A A . 32 SER HB2 1 1 18 10246 1 1 32 SER HB3 H 6.885 9.516 19.226 1.00 . A A . 32 SER HB3 1 1 18 10247 1 1 32 SER HG H 4.706 9.584 19.525 1.00 . A A . 32 SER HG 1 1 18 10248 1 1 32 SER N N 5.586 11.064 17.297 1.00 . A A . 32 SER N 1 1 18 10249 1 1 32 SER O O 4.607 9.009 15.729 1.00 . A A . 32 SER O 1 1 18 10250 1 1 32 SER OG O 4.965 8.829 18.922 1.00 . A A . 32 SER OG 1 1 18 10251 1 1 33 LYS C C 5.046 6.772 14.491 1.00 . A A . 33 LYS C 1 1 18 10252 1 1 33 LYS CA C 6.357 7.499 14.186 1.00 . A A . 33 LYS CA 1 1 18 10253 1 1 33 LYS CB C 7.507 6.561 13.812 1.00 . A A . 33 LYS CB 1 1 18 10254 1 1 33 LYS CD C 8.217 4.908 12.044 1.00 . A A . 33 LYS CD 1 1 18 10255 1 1 33 LYS CE C 8.640 5.859 10.924 1.00 . A A . 33 LYS CE 1 1 18 10256 1 1 33 LYS CG C 7.038 5.482 12.835 1.00 . A A . 33 LYS CG 1 1 18 10257 1 1 33 LYS H H 7.700 8.331 15.544 1.00 . A A . 33 LYS H 1 1 18 10258 1 1 33 LYS HA H 6.195 8.164 13.337 1.00 . A A . 33 LYS HA 1 1 18 10259 1 1 33 LYS HB2 H 8.319 7.135 13.363 1.00 . A A . 33 LYS HB2 1 1 18 10260 1 1 33 LYS HB3 H 7.907 6.094 14.711 1.00 . A A . 33 LYS HB3 1 1 18 10261 1 1 33 LYS HD2 H 9.058 4.732 12.715 1.00 . A A . 33 LYS HD2 1 1 18 10262 1 1 33 LYS HD3 H 7.940 3.942 11.621 1.00 . A A . 33 LYS HD3 1 1 18 10263 1 1 33 LYS HE2 H 8.611 6.888 11.282 1.00 . A A . 33 LYS HE2 1 1 18 10264 1 1 33 LYS HE3 H 9.670 5.652 10.633 1.00 . A A . 33 LYS HE3 1 1 18 10265 1 1 33 LYS HG2 H 6.540 4.682 13.382 1.00 . A A . 33 LYS HG2 1 1 18 10266 1 1 33 LYS HG3 H 6.305 5.902 12.146 1.00 . A A . 33 LYS HG3 1 1 18 10267 1 1 33 LYS HZ1 H 7.738 6.543 9.173 1.00 . A A . 33 LYS HZ1 1 1 18 10268 1 1 33 LYS HZ2 H 8.029 4.941 9.156 1.00 . A A . 33 LYS HZ2 1 1 18 10269 1 1 33 LYS N N 6.724 8.325 15.323 1.00 . A A . 33 LYS N 1 1 18 10270 1 1 33 LYS NZ N 7.748 5.711 9.752 1.00 . A A . 33 LYS NZ 1 1 18 10271 1 1 33 LYS O O 4.144 6.735 13.655 1.00 . A A . 33 LYS O 1 1 18 10272 1 1 34 ASP C C 2.559 6.354 15.865 1.00 . A A . 34 ASP C 1 1 18 10273 1 1 34 ASP CA C 3.796 5.490 16.116 1.00 . A A . 34 ASP CA 1 1 18 10274 1 1 34 ASP CB C 3.852 5.171 17.612 1.00 . A A . 34 ASP CB 1 1 18 10275 1 1 34 ASP CG C 4.150 6.368 18.517 1.00 . A A . 34 ASP CG 1 1 18 10276 1 1 34 ASP H H 5.719 6.249 16.364 1.00 . A A . 34 ASP H 1 1 18 10277 1 1 34 ASP HA H 3.792 4.574 15.526 1.00 . A A . 34 ASP HA 1 1 18 10278 1 1 34 ASP HB2 H 2.899 4.736 17.911 1.00 . A A . 34 ASP HB2 1 1 18 10279 1 1 34 ASP HB3 H 4.616 4.411 17.777 1.00 . A A . 34 ASP HB3 1 1 18 10280 1 1 34 ASP HD2 H 5.424 6.956 19.774 1.00 . A A . 34 ASP HD2 1 1 18 10281 1 1 34 ASP N N 4.982 6.213 15.690 1.00 . A A . 34 ASP N 1 1 18 10282 1 1 34 ASP O O 2.178 7.162 16.710 1.00 . A A . 34 ASP O 1 1 18 10283 1 1 34 ASP OD1 O 3.256 7.163 18.839 1.00 . A A . 34 ASP OD1 1 1 18 10284 1 1 34 ASP OD2 O 5.378 6.468 18.902 1.00 . A A . 34 ASP OD2 1 1 18 10285 1 1 35 ALA C C 0.585 6.823 12.808 1.00 . A A . 35 ALA C 1 1 18 10286 1 1 35 ALA CA C 0.778 6.907 14.323 1.00 . A A . 35 ALA CA 1 1 18 10287 1 1 35 ALA CB C 0.910 8.349 14.815 1.00 . A A . 35 ALA CB 1 1 18 10288 1 1 35 ALA H H 2.280 5.496 14.014 1.00 . A A . 35 ALA H 1 1 18 10289 1 1 35 ALA HA H -0.077 6.443 14.815 1.00 . A A . 35 ALA HA 1 1 18 10290 1 1 35 ALA HB1 H 0.444 9.022 14.097 1.00 . A A . 35 ALA HB1 1 1 18 10291 1 1 35 ALA HB2 H 0.416 8.449 15.782 1.00 . A A . 35 ALA HB2 1 1 18 10292 1 1 35 ALA HB3 H 1.966 8.603 14.919 1.00 . A A . 35 ALA HB3 1 1 18 10293 1 1 35 ALA N N 1.965 6.155 14.697 1.00 . A A . 35 ALA N 1 1 18 10294 1 1 35 ALA O O -0.540 6.909 12.317 1.00 . A A . 35 ALA O 1 1 18 10295 1 1 36 PHE C C 1.030 5.244 10.211 1.00 . A A . 36 PHE C 1 1 18 10296 1 1 36 PHE CA C 1.665 6.563 10.659 1.00 . A A . 36 PHE CA 1 1 18 10297 1 1 36 PHE CB C 3.115 6.607 10.174 1.00 . A A . 36 PHE CB 1 1 18 10298 1 1 36 PHE CD1 C 3.943 8.733 11.208 1.00 . A A . 36 PHE CD1 1 1 18 10299 1 1 36 PHE CD2 C 3.962 8.563 8.858 1.00 . A A . 36 PHE CD2 1 1 18 10300 1 1 36 PHE CE1 C 4.480 10.044 11.117 1.00 . A A . 36 PHE CE1 1 1 18 10301 1 1 36 PHE CE2 C 4.499 9.875 8.768 1.00 . A A . 36 PHE CE2 1 1 18 10302 1 1 36 PHE CG C 3.695 8.020 10.077 1.00 . A A . 36 PHE CG 1 1 18 10303 1 1 36 PHE CZ C 4.747 10.587 9.900 1.00 . A A . 36 PHE CZ 1 1 18 10304 1 1 36 PHE H H 2.609 6.589 12.516 1.00 . A A . 36 PHE H 1 1 18 10305 1 1 36 PHE HA H 1.064 7.395 10.294 1.00 . A A . 36 PHE HA 1 1 18 10306 1 1 36 PHE HB2 H 3.733 6.019 10.853 1.00 . A A . 36 PHE HB2 1 1 18 10307 1 1 36 PHE HB3 H 3.175 6.133 9.195 1.00 . A A . 36 PHE HB3 1 1 18 10308 1 1 36 PHE HD1 H 3.730 8.298 12.184 1.00 . A A . 36 PHE HD1 1 1 18 10309 1 1 36 PHE HD2 H 3.763 7.992 7.952 1.00 . A A . 36 PHE HD2 1 1 18 10310 1 1 36 PHE HE1 H 4.680 10.616 12.024 1.00 . A A . 36 PHE HE1 1 1 18 10311 1 1 36 PHE HE2 H 4.713 10.309 7.792 1.00 . A A . 36 PHE HE2 1 1 18 10312 1 1 36 PHE HZ H 5.160 11.594 9.829 1.00 . A A . 36 PHE HZ 1 1 18 10313 1 1 36 PHE N N 1.698 6.657 12.108 1.00 . A A . 36 PHE N 1 1 18 10314 1 1 36 PHE O O 1.264 4.200 10.818 1.00 . A A . 36 PHE O 1 1 18 10315 1 1 37 GLU C C -0.179 4.051 7.109 1.00 . A A . 37 GLU C 1 1 18 10316 1 1 37 GLU CA C -0.429 4.162 8.614 1.00 . A A . 37 GLU CA 1 1 18 10317 1 1 37 GLU CB C -1.927 4.197 8.921 1.00 . A A . 37 GLU CB 1 1 18 10318 1 1 37 GLU CD C -3.363 2.415 9.978 1.00 . A A . 37 GLU CD 1 1 18 10319 1 1 37 GLU CG C -2.557 2.815 8.740 1.00 . A A . 37 GLU CG 1 1 18 10320 1 1 37 GLU H H 0.056 6.187 8.662 1.00 . A A . 37 GLU H 1 1 18 10321 1 1 37 GLU HA H 0.020 3.312 9.127 1.00 . A A . 37 GLU HA 1 1 18 10322 1 1 37 GLU HB2 H -2.086 4.542 9.942 1.00 . A A . 37 GLU HB2 1 1 18 10323 1 1 37 GLU HB3 H -2.419 4.915 8.262 1.00 . A A . 37 GLU HB3 1 1 18 10324 1 1 37 GLU HE2 H -4.682 1.245 10.640 1.00 . A A . 37 GLU HE2 1 1 18 10325 1 1 37 GLU HG2 H -3.206 2.818 7.864 1.00 . A A . 37 GLU HG2 1 1 18 10326 1 1 37 GLU HG3 H -1.776 2.077 8.555 1.00 . A A . 37 GLU HG3 1 1 18 10327 1 1 37 GLU N N 0.241 5.335 9.151 1.00 . A A . 37 GLU N 1 1 18 10328 1 1 37 GLU O O -0.490 4.972 6.355 1.00 . A A . 37 GLU O 1 1 18 10329 1 1 37 GLU OE1 O -3.123 2.944 11.072 1.00 . A A . 37 GLU OE1 1 1 18 10330 1 1 37 GLU OE2 O -4.269 1.519 9.771 1.00 . A A . 37 GLU OE2 1 1 18 10331 1 1 38 LYS C C -0.630 2.682 4.514 1.00 . A A . 38 LYS C 1 1 18 10332 1 1 38 LYS CA C 0.674 2.673 5.314 1.00 . A A . 38 LYS CA 1 1 18 10333 1 1 38 LYS CB C 1.484 1.384 5.152 1.00 . A A . 38 LYS CB 1 1 18 10334 1 1 38 LYS CD C 3.237 0.541 3.547 1.00 . A A . 38 LYS CD 1 1 18 10335 1 1 38 LYS CE C 4.276 1.635 3.292 1.00 . A A . 38 LYS CE 1 1 18 10336 1 1 38 LYS CG C 1.835 1.138 3.684 1.00 . A A . 38 LYS CG 1 1 18 10337 1 1 38 LYS H H 0.629 2.172 7.336 1.00 . A A . 38 LYS H 1 1 18 10338 1 1 38 LYS HA H 1.301 3.493 4.965 1.00 . A A . 38 LYS HA 1 1 18 10339 1 1 38 LYS HB2 H 2.399 1.449 5.742 1.00 . A A . 38 LYS HB2 1 1 18 10340 1 1 38 LYS HB3 H 0.914 0.540 5.540 1.00 . A A . 38 LYS HB3 1 1 18 10341 1 1 38 LYS HD2 H 3.494 -0.004 4.456 1.00 . A A . 38 LYS HD2 1 1 18 10342 1 1 38 LYS HD3 H 3.253 -0.178 2.729 1.00 . A A . 38 LYS HD3 1 1 18 10343 1 1 38 LYS HE2 H 3.913 2.317 2.522 1.00 . A A . 38 LYS HE2 1 1 18 10344 1 1 38 LYS HE3 H 4.422 2.225 4.196 1.00 . A A . 38 LYS HE3 1 1 18 10345 1 1 38 LYS HG2 H 1.104 0.462 3.240 1.00 . A A . 38 LYS HG2 1 1 18 10346 1 1 38 LYS HG3 H 1.780 2.075 3.130 1.00 . A A . 38 LYS HG3 1 1 18 10347 1 1 38 LYS HZ1 H 5.971 0.462 3.593 1.00 . A A . 38 LYS HZ1 1 1 18 10348 1 1 38 LYS HZ2 H 5.457 0.451 2.048 1.00 . A A . 38 LYS HZ2 1 1 18 10349 1 1 38 LYS N N 0.380 2.915 6.715 1.00 . A A . 38 LYS N 1 1 18 10350 1 1 38 LYS NZ N 5.563 1.039 2.867 1.00 . A A . 38 LYS NZ 1 1 18 10351 1 1 38 LYS O O -1.486 1.822 4.706 1.00 . A A . 38 LYS O 1 1 18 10352 1 1 39 GLN C C -1.588 3.485 1.346 1.00 . A A . 39 GLN C 1 1 18 10353 1 1 39 GLN CA C -1.924 3.802 2.805 1.00 . A A . 39 GLN CA 1 1 18 10354 1 1 39 GLN CB C -2.531 5.200 2.936 1.00 . A A . 39 GLN CB 1 1 18 10355 1 1 39 GLN CD C -4.453 6.642 2.171 1.00 . A A . 39 GLN CD 1 1 18 10356 1 1 39 GLN CG C -3.985 5.214 2.462 1.00 . A A . 39 GLN CG 1 1 18 10357 1 1 39 GLN H H -0.037 4.365 3.485 1.00 . A A . 39 GLN H 1 1 18 10358 1 1 39 GLN HA H -2.631 3.068 3.189 1.00 . A A . 39 GLN HA 1 1 18 10359 1 1 39 GLN HB2 H -2.479 5.526 3.975 1.00 . A A . 39 GLN HB2 1 1 18 10360 1 1 39 GLN HB3 H -1.946 5.911 2.351 1.00 . A A . 39 GLN HB3 1 1 18 10361 1 1 39 GLN HE21 H -5.600 6.554 3.837 1.00 . A A . 39 GLN HE21 1 1 18 10362 1 1 39 GLN HE22 H -5.680 8.046 2.961 1.00 . A A . 39 GLN HE22 1 1 18 10363 1 1 39 GLN HG2 H -4.084 4.605 1.564 1.00 . A A . 39 GLN HG2 1 1 18 10364 1 1 39 GLN HG3 H -4.623 4.766 3.223 1.00 . A A . 39 GLN HG3 1 1 18 10365 1 1 39 GLN N N -0.739 3.668 3.634 1.00 . A A . 39 GLN N 1 1 18 10366 1 1 39 GLN NE2 N -5.316 7.121 3.064 1.00 . A A . 39 GLN NE2 1 1 18 10367 1 1 39 GLN O O -1.061 2.416 1.045 1.00 . A A . 39 GLN O 1 1 18 10368 1 1 39 GLN OE1 O -4.058 7.267 1.202 1.00 . A A . 39 GLN OE1 1 1 19 10369 1 1 1 MET C C 3.682 1.971 -0.971 1.00 . A A . 1 MET C 1 1 19 10370 1 1 1 MET CA C 3.168 1.510 -2.336 1.00 . A A . 1 MET CA 1 1 19 10371 1 1 1 MET CB C 3.595 0.061 -2.579 1.00 . A A . 1 MET CB 1 1 19 10372 1 1 1 MET CE C 1.221 -3.081 -3.832 1.00 . A A . 1 MET CE 1 1 19 10373 1 1 1 MET CG C 2.498 -0.719 -3.307 1.00 . A A . 1 MET CG 1 1 19 10374 1 1 1 MET H1 H 3.421 3.315 -3.342 1.00 . A A . 1 MET H1 1 1 19 10375 1 1 1 MET HA H 2.084 1.616 -2.378 1.00 . A A . 1 MET HA 1 1 19 10376 1 1 1 MET HB2 H 4.511 0.042 -3.169 1.00 . A A . 1 MET HB2 1 1 19 10377 1 1 1 MET HB3 H 3.818 -0.422 -1.627 1.00 . A A . 1 MET HB3 1 1 19 10378 1 1 1 MET HE1 H 0.788 -2.274 -4.422 1.00 . A A . 1 MET HE1 1 1 19 10379 1 1 1 MET HE2 H 1.572 -3.869 -4.498 1.00 . A A . 1 MET HE2 1 1 19 10380 1 1 1 MET HE3 H 0.467 -3.484 -3.157 1.00 . A A . 1 MET HE3 1 1 19 10381 1 1 1 MET HG2 H 1.518 -0.325 -3.036 1.00 . A A . 1 MET HG2 1 1 19 10382 1 1 1 MET HG3 H 2.605 -0.594 -4.384 1.00 . A A . 1 MET HG3 1 1 19 10383 1 1 1 MET N N 3.684 2.352 -3.400 1.00 . A A . 1 MET N 1 1 19 10384 1 1 1 MET O O 2.895 2.279 -0.078 1.00 . A A . 1 MET O 1 1 19 10385 1 1 1 MET SD S 2.595 -2.450 -2.881 1.00 . A A . 1 MET SD 1 1 19 10386 1 1 2 ASP C C 5.375 3.919 0.604 1.00 . A A . 2 ASP C 1 1 19 10387 1 1 2 ASP CA C 5.632 2.426 0.387 1.00 . A A . 2 ASP CA 1 1 19 10388 1 1 2 ASP CB C 7.145 2.210 0.337 1.00 . A A . 2 ASP CB 1 1 19 10389 1 1 2 ASP CG C 7.587 0.848 -0.203 1.00 . A A . 2 ASP CG 1 1 19 10390 1 1 2 ASP H H 5.636 1.756 -1.586 1.00 . A A . 2 ASP H 1 1 19 10391 1 1 2 ASP HA H 5.179 1.808 1.162 1.00 . A A . 2 ASP HA 1 1 19 10392 1 1 2 ASP HB2 H 7.589 2.990 -0.282 1.00 . A A . 2 ASP HB2 1 1 19 10393 1 1 2 ASP HB3 H 7.549 2.334 1.342 1.00 . A A . 2 ASP HB3 1 1 19 10394 1 1 2 ASP HD2 H 6.194 -0.221 0.480 1.00 . A A . 2 ASP HD2 1 1 19 10395 1 1 2 ASP N N 5.002 2.007 -0.854 1.00 . A A . 2 ASP N 1 1 19 10396 1 1 2 ASP O O 6.114 4.761 0.096 1.00 . A A . 2 ASP O 1 1 19 10397 1 1 2 ASP OD1 O 8.271 0.760 -1.233 1.00 . A A . 2 ASP OD1 1 1 19 10398 1 1 2 ASP OD2 O 7.193 -0.166 0.491 1.00 . A A . 2 ASP OD2 1 1 19 10399 1 1 3 ILE C C 3.612 5.706 3.136 1.00 . A A . 3 ILE C 1 1 19 10400 1 1 3 ILE CA C 3.961 5.578 1.652 1.00 . A A . 3 ILE CA 1 1 19 10401 1 1 3 ILE CB C 2.846 6.048 0.716 1.00 . A A . 3 ILE CB 1 1 19 10402 1 1 3 ILE CD1 C 2.247 5.635 -1.699 1.00 . A A . 3 ILE CD1 1 1 19 10403 1 1 3 ILE CG1 C 3.334 6.108 -0.732 1.00 . A A . 3 ILE CG1 1 1 19 10404 1 1 3 ILE CG2 C 2.265 7.384 1.182 1.00 . A A . 3 ILE CG2 1 1 19 10405 1 1 3 ILE H H 3.729 3.512 1.771 1.00 . A A . 3 ILE H 1 1 19 10406 1 1 3 ILE HA H 4.835 6.197 1.448 1.00 . A A . 3 ILE HA 1 1 19 10407 1 1 3 ILE HB H 2.039 5.315 0.753 1.00 . A A . 3 ILE HB 1 1 19 10408 1 1 3 ILE HD11 H 1.726 6.500 -2.110 1.00 . A A . 3 ILE HD11 1 1 19 10409 1 1 3 ILE HD12 H 2.704 5.067 -2.509 1.00 . A A . 3 ILE HD12 1 1 19 10410 1 1 3 ILE HD13 H 1.538 5.002 -1.166 1.00 . A A . 3 ILE HD13 1 1 19 10411 1 1 3 ILE HG12 H 3.626 7.129 -0.979 1.00 . A A . 3 ILE HG12 1 1 19 10412 1 1 3 ILE HG13 H 4.223 5.487 -0.846 1.00 . A A . 3 ILE HG13 1 1 19 10413 1 1 3 ILE HG21 H 2.802 7.726 2.066 1.00 . A A . 3 ILE HG21 1 1 19 10414 1 1 3 ILE HG22 H 2.367 8.122 0.387 1.00 . A A . 3 ILE HG22 1 1 19 10415 1 1 3 ILE HG23 H 1.210 7.257 1.426 1.00 . A A . 3 ILE HG23 1 1 19 10416 1 1 3 ILE N N 4.324 4.201 1.361 1.00 . A A . 3 ILE N 1 1 19 10417 1 1 3 ILE O O 2.865 4.911 3.703 1.00 . A A . 3 ILE O 1 1 19 10418 1 1 4 TYR C C 3.250 8.338 5.342 1.00 . A A . 4 TYR C 1 1 19 10419 1 1 4 TYR CA C 3.951 6.998 5.170 1.00 . A A . 4 TYR CA 1 1 19 10420 1 1 4 TYR CB C 5.285 6.986 5.911 1.00 . A A . 4 TYR CB 1 1 19 10421 1 1 4 TYR CD1 C 5.398 4.474 5.741 1.00 . A A . 4 TYR CD1 1 1 19 10422 1 1 4 TYR CD2 C 6.227 5.545 7.752 1.00 . A A . 4 TYR CD2 1 1 19 10423 1 1 4 TYR CE1 C 5.731 3.221 6.272 1.00 . A A . 4 TYR CE1 1 1 19 10424 1 1 4 TYR CE2 C 6.560 4.293 8.282 1.00 . A A . 4 TYR CE2 1 1 19 10425 1 1 4 TYR CG C 5.645 5.635 6.482 1.00 . A A . 4 TYR CG 1 1 19 10426 1 1 4 TYR CZ C 6.312 3.131 7.542 1.00 . A A . 4 TYR CZ 1 1 19 10427 1 1 4 TYR H H 4.787 7.364 3.252 1.00 . A A . 4 TYR H 1 1 19 10428 1 1 4 TYR HA H 3.314 6.212 5.576 1.00 . A A . 4 TYR HA 1 1 19 10429 1 1 4 TYR HB2 H 6.070 7.292 5.219 1.00 . A A . 4 TYR HB2 1 1 19 10430 1 1 4 TYR HB3 H 5.238 7.707 6.726 1.00 . A A . 4 TYR HB3 1 1 19 10431 1 1 4 TYR HD1 H 4.950 4.543 4.761 1.00 . A A . 4 TYR HD1 1 1 19 10432 1 1 4 TYR HD2 H 6.418 6.442 8.324 1.00 . A A . 4 TYR HD2 1 1 19 10433 1 1 4 TYR HE1 H 5.541 2.325 5.700 1.00 . A A . 4 TYR HE1 1 1 19 10434 1 1 4 TYR HE2 H 7.009 4.223 9.262 1.00 . A A . 4 TYR HE2 1 1 19 10435 1 1 4 TYR HH H 5.881 1.443 8.419 1.00 . A A . 4 TYR HH 1 1 19 10436 1 1 4 TYR N N 4.179 6.740 3.763 1.00 . A A . 4 TYR N 1 1 19 10437 1 1 4 TYR O O 3.926 9.334 5.597 1.00 . A A . 4 TYR O 1 1 19 10438 1 1 4 TYR OH O 6.638 1.911 8.059 1.00 . A A . 4 TYR OH 1 1 19 10439 1 1 5 VAL C C 0.695 9.701 6.795 1.00 . A A . 5 VAL C 1 1 19 10440 1 1 5 VAL CA C 1.168 9.568 5.346 1.00 . A A . 5 VAL CA 1 1 19 10441 1 1 5 VAL CB C 0.017 9.589 4.337 1.00 . A A . 5 VAL CB 1 1 19 10442 1 1 5 VAL CG1 C -0.744 10.914 4.403 1.00 . A A . 5 VAL CG1 1 1 19 10443 1 1 5 VAL CG2 C 0.526 9.317 2.920 1.00 . A A . 5 VAL CG2 1 1 19 10444 1 1 5 VAL H H 1.391 7.527 4.994 1.00 . A A . 5 VAL H 1 1 19 10445 1 1 5 VAL HA H 1.833 10.400 5.116 1.00 . A A . 5 VAL HA 1 1 19 10446 1 1 5 VAL HB H -0.676 8.791 4.604 1.00 . A A . 5 VAL HB 1 1 19 10447 1 1 5 VAL HG11 H -1.816 10.718 4.392 1.00 . A A . 5 VAL HG11 1 1 19 10448 1 1 5 VAL HG12 H -0.481 11.440 5.321 1.00 . A A . 5 VAL HG12 1 1 19 10449 1 1 5 VAL HG13 H -0.478 11.529 3.542 1.00 . A A . 5 VAL HG13 1 1 19 10450 1 1 5 VAL HG21 H 1.579 9.043 2.959 1.00 . A A . 5 VAL HG21 1 1 19 10451 1 1 5 VAL HG22 H -0.047 8.500 2.481 1.00 . A A . 5 VAL HG22 1 1 19 10452 1 1 5 VAL HG23 H 0.405 10.214 2.313 1.00 . A A . 5 VAL HG23 1 1 19 10453 1 1 5 VAL N N 1.933 8.341 5.202 1.00 . A A . 5 VAL N 1 1 19 10454 1 1 5 VAL O O -0.030 8.844 7.298 1.00 . A A . 5 VAL O 1 1 19 10455 1 1 6 CYS C C -0.768 11.147 8.886 1.00 . A A . 6 CYS C 1 1 19 10456 1 1 6 CYS CA C 0.756 11.041 8.809 1.00 . A A . 6 CYS CA 1 1 19 10457 1 1 6 CYS CB C 1.444 12.294 9.356 1.00 . A A . 6 CYS CB 1 1 19 10458 1 1 6 CYS H H 1.715 11.477 7.012 1.00 . A A . 6 CYS H 1 1 19 10459 1 1 6 CYS HA H 1.114 10.193 9.392 1.00 . A A . 6 CYS HA 1 1 19 10460 1 1 6 CYS HB2 H 2.486 12.285 9.037 1.00 . A A . 6 CYS HB2 1 1 19 10461 1 1 6 CYS HB3 H 0.980 13.171 8.905 1.00 . A A . 6 CYS HB3 1 1 19 10462 1 1 6 CYS N N 1.126 10.784 7.427 1.00 . A A . 6 CYS N 1 1 19 10463 1 1 6 CYS O O -1.415 11.566 7.926 1.00 . A A . 6 CYS O 1 1 19 10464 1 1 6 CYS SG S 1.387 12.468 11.176 1.00 . A A . 6 CYS SG 1 1 19 10465 1 1 7 THR C C -3.090 11.919 11.245 1.00 . A A . 7 THR C 1 1 19 10466 1 1 7 THR CA C -2.736 10.810 10.252 1.00 . A A . 7 THR CA 1 1 19 10467 1 1 7 THR CB C -3.192 9.422 10.704 1.00 . A A . 7 THR CB 1 1 19 10468 1 1 7 THR CG2 C -2.929 8.346 9.648 1.00 . A A . 7 THR CG2 1 1 19 10469 1 1 7 THR H H -0.766 10.425 10.813 1.00 . A A . 7 THR H 1 1 19 10470 1 1 7 THR HA H -3.217 11.062 9.306 1.00 . A A . 7 THR HA 1 1 19 10471 1 1 7 THR HB H -4.242 9.433 10.995 1.00 . A A . 7 THR HB 1 1 19 10472 1 1 7 THR HG1 H -2.456 9.697 12.544 1.00 . A A . 7 THR HG1 1 1 19 10473 1 1 7 THR HG21 H -3.836 7.764 9.489 1.00 . A A . 7 THR HG21 1 1 19 10474 1 1 7 THR HG22 H -2.633 8.821 8.712 1.00 . A A . 7 THR HG22 1 1 19 10475 1 1 7 THR HG23 H -2.131 7.688 9.990 1.00 . A A . 7 THR HG23 1 1 19 10476 1 1 7 THR N N -1.299 10.763 10.037 1.00 . A A . 7 THR N 1 1 19 10477 1 1 7 THR O O -4.202 11.955 11.770 1.00 . A A . 7 THR O 1 1 19 10478 1 1 7 THR OG1 O -2.300 9.091 11.765 1.00 . A A . 7 THR OG1 1 1 19 10479 1 1 8 VAL C C -2.393 15.212 11.602 1.00 . A A . 8 VAL C 1 1 19 10480 1 1 8 VAL CA C -2.320 13.904 12.392 1.00 . A A . 8 VAL CA 1 1 19 10481 1 1 8 VAL CB C -1.216 13.906 13.451 1.00 . A A . 8 VAL CB 1 1 19 10482 1 1 8 VAL CG1 C -1.275 15.177 14.303 1.00 . A A . 8 VAL CG1 1 1 19 10483 1 1 8 VAL CG2 C -1.295 12.654 14.328 1.00 . A A . 8 VAL CG2 1 1 19 10484 1 1 8 VAL H H -1.223 12.761 11.040 1.00 . A A . 8 VAL H 1 1 19 10485 1 1 8 VAL HA H -3.273 13.746 12.898 1.00 . A A . 8 VAL HA 1 1 19 10486 1 1 8 VAL HB H -0.257 13.894 12.934 1.00 . A A . 8 VAL HB 1 1 19 10487 1 1 8 VAL HG11 H -2.316 15.434 14.499 1.00 . A A . 8 VAL HG11 1 1 19 10488 1 1 8 VAL HG12 H -0.759 15.005 15.247 1.00 . A A . 8 VAL HG12 1 1 19 10489 1 1 8 VAL HG13 H -0.793 15.995 13.767 1.00 . A A . 8 VAL HG13 1 1 19 10490 1 1 8 VAL HG21 H -0.590 11.909 13.959 1.00 . A A . 8 VAL HG21 1 1 19 10491 1 1 8 VAL HG22 H -1.044 12.915 15.356 1.00 . A A . 8 VAL HG22 1 1 19 10492 1 1 8 VAL HG23 H -2.305 12.249 14.292 1.00 . A A . 8 VAL HG23 1 1 19 10493 1 1 8 VAL N N -2.124 12.797 11.471 1.00 . A A . 8 VAL N 1 1 19 10494 1 1 8 VAL O O -3.330 15.992 11.769 1.00 . A A . 8 VAL O 1 1 19 10495 1 1 9 CYS C C -1.625 16.222 8.491 1.00 . A A . 9 CYS C 1 1 19 10496 1 1 9 CYS CA C -1.330 16.613 9.941 1.00 . A A . 9 CYS CA 1 1 19 10497 1 1 9 CYS CB C 0.018 17.323 10.078 1.00 . A A . 9 CYS CB 1 1 19 10498 1 1 9 CYS H H -0.633 14.774 10.628 1.00 . A A . 9 CYS H 1 1 19 10499 1 1 9 CYS HA H -2.094 17.290 10.323 1.00 . A A . 9 CYS HA 1 1 19 10500 1 1 9 CYS HB2 H 0.175 17.947 9.199 1.00 . A A . 9 CYS HB2 1 1 19 10501 1 1 9 CYS HB3 H -0.025 17.989 10.940 1.00 . A A . 9 CYS HB3 1 1 19 10502 1 1 9 CYS N N -1.392 15.412 10.757 1.00 . A A . 9 CYS N 1 1 19 10503 1 1 9 CYS O O -2.026 17.063 7.687 1.00 . A A . 9 CYS O 1 1 19 10504 1 1 9 CYS SG S 1.456 16.207 10.270 1.00 . A A . 9 CYS SG 1 1 19 10505 1 1 10 GLY C C -0.372 14.470 6.026 1.00 . A A . 10 GLY C 1 1 19 10506 1 1 10 GLY CA C -1.653 14.436 6.862 1.00 . A A . 10 GLY CA 1 1 19 10507 1 1 10 GLY H H -1.089 14.270 8.860 1.00 . A A . 10 GLY H 1 1 19 10508 1 1 10 GLY HA2 H -2.026 13.413 6.920 1.00 . A A . 10 GLY HA2 1 1 19 10509 1 1 10 GLY HA3 H -2.426 15.030 6.374 1.00 . A A . 10 GLY HA3 1 1 19 10510 1 1 10 GLY N N -1.415 14.947 8.200 1.00 . A A . 10 GLY N 1 1 19 10511 1 1 10 GLY O O -0.375 14.244 4.818 1.00 . A A . 10 GLY O 1 1 19 10512 1 1 11 TYR C C 2.170 13.706 5.049 1.00 . A A . 11 TYR C 1 1 19 10513 1 1 11 TYR CA C 2.033 14.835 6.060 1.00 . A A . 11 TYR CA 1 1 19 10514 1 1 11 TYR CB C 3.133 14.753 7.116 1.00 . A A . 11 TYR CB 1 1 19 10515 1 1 11 TYR CD1 C 4.704 16.121 5.697 1.00 . A A . 11 TYR CD1 1 1 19 10516 1 1 11 TYR CD2 C 5.596 14.244 6.949 1.00 . A A . 11 TYR CD2 1 1 19 10517 1 1 11 TYR CE1 C 5.983 16.392 5.194 1.00 . A A . 11 TYR CE1 1 1 19 10518 1 1 11 TYR CE2 C 6.873 14.515 6.446 1.00 . A A . 11 TYR CE2 1 1 19 10519 1 1 11 TYR CG C 4.510 15.047 6.574 1.00 . A A . 11 TYR CG 1 1 19 10520 1 1 11 TYR CZ C 7.067 15.589 5.569 1.00 . A A . 11 TYR CZ 1 1 19 10521 1 1 11 TYR H H 0.686 14.940 7.700 1.00 . A A . 11 TYR H 1 1 19 10522 1 1 11 TYR HA H 2.115 15.789 5.538 1.00 . A A . 11 TYR HA 1 1 19 10523 1 1 11 TYR HB2 H 2.910 15.469 7.907 1.00 . A A . 11 TYR HB2 1 1 19 10524 1 1 11 TYR HB3 H 3.133 13.750 7.541 1.00 . A A . 11 TYR HB3 1 1 19 10525 1 1 11 TYR HD1 H 3.868 16.740 5.408 1.00 . A A . 11 TYR HD1 1 1 19 10526 1 1 11 TYR HD2 H 5.446 13.416 7.626 1.00 . A A . 11 TYR HD2 1 1 19 10527 1 1 11 TYR HE1 H 6.133 17.220 4.518 1.00 . A A . 11 TYR HE1 1 1 19 10528 1 1 11 TYR HE2 H 7.711 13.896 6.735 1.00 . A A . 11 TYR HE2 1 1 19 10529 1 1 11 TYR HH H 8.772 15.067 4.778 1.00 . A A . 11 TYR HH 1 1 19 10530 1 1 11 TYR N N 0.738 14.762 6.707 1.00 . A A . 11 TYR N 1 1 19 10531 1 1 11 TYR O O 1.492 12.690 5.197 1.00 . A A . 11 TYR O 1 1 19 10532 1 1 11 TYR OH O 8.313 15.854 5.079 1.00 . A A . 11 TYR OH 1 1 19 10533 1 1 12 GLU C C 4.718 12.525 2.938 1.00 . A A . 12 GLU C 1 1 19 10534 1 1 12 GLU CA C 3.234 12.882 3.039 1.00 . A A . 12 GLU CA 1 1 19 10535 1 1 12 GLU CB C 2.687 13.343 1.687 1.00 . A A . 12 GLU CB 1 1 19 10536 1 1 12 GLU CD C 0.264 14.028 1.547 1.00 . A A . 12 GLU CD 1 1 19 10537 1 1 12 GLU CG C 1.250 12.859 1.483 1.00 . A A . 12 GLU CG 1 1 19 10538 1 1 12 GLU H H 3.575 14.727 3.945 1.00 . A A . 12 GLU H 1 1 19 10539 1 1 12 GLU HA H 2.666 12.015 3.377 1.00 . A A . 12 GLU HA 1 1 19 10540 1 1 12 GLU HB2 H 2.720 14.431 1.629 1.00 . A A . 12 GLU HB2 1 1 19 10541 1 1 12 GLU HB3 H 3.320 12.962 0.885 1.00 . A A . 12 GLU HB3 1 1 19 10542 1 1 12 GLU HE2 H -1.292 14.774 0.793 1.00 . A A . 12 GLU HE2 1 1 19 10543 1 1 12 GLU HG2 H 1.165 12.360 0.518 1.00 . A A . 12 GLU HG2 1 1 19 10544 1 1 12 GLU HG3 H 0.998 12.124 2.247 1.00 . A A . 12 GLU HG3 1 1 19 10545 1 1 12 GLU N N 3.027 13.898 4.058 1.00 . A A . 12 GLU N 1 1 19 10546 1 1 12 GLU O O 5.594 13.386 2.875 1.00 . A A . 12 GLU O 1 1 19 10547 1 1 12 GLU OE1 O 0.439 14.943 2.365 1.00 . A A . 12 GLU OE1 1 1 19 10548 1 1 12 GLU OE2 O -0.712 13.964 0.707 1.00 . A A . 12 GLU OE2 1 1 19 10549 1 1 13 TYR C C 6.363 9.430 2.019 1.00 . A A . 13 TYR C 1 1 19 10550 1 1 13 TYR CA C 6.341 10.717 2.833 1.00 . A A . 13 TYR CA 1 1 19 10551 1 1 13 TYR CB C 6.888 10.477 4.238 1.00 . A A . 13 TYR CB 1 1 19 10552 1 1 13 TYR CD1 C 9.339 10.934 3.863 1.00 . A A . 13 TYR CD1 1 1 19 10553 1 1 13 TYR CD2 C 8.669 8.746 4.665 1.00 . A A . 13 TYR CD2 1 1 19 10554 1 1 13 TYR CE1 C 10.679 10.530 3.879 1.00 . A A . 13 TYR CE1 1 1 19 10555 1 1 13 TYR CE2 C 10.010 8.341 4.682 1.00 . A A . 13 TYR CE2 1 1 19 10556 1 1 13 TYR CG C 8.333 10.041 4.256 1.00 . A A . 13 TYR CG 1 1 19 10557 1 1 13 TYR CZ C 11.014 9.234 4.289 1.00 . A A . 13 TYR CZ 1 1 19 10558 1 1 13 TYR H H 4.228 10.551 2.978 1.00 . A A . 13 TYR H 1 1 19 10559 1 1 13 TYR HA H 6.961 11.461 2.335 1.00 . A A . 13 TYR HA 1 1 19 10560 1 1 13 TYR HB2 H 6.795 11.401 4.810 1.00 . A A . 13 TYR HB2 1 1 19 10561 1 1 13 TYR HB3 H 6.287 9.706 4.719 1.00 . A A . 13 TYR HB3 1 1 19 10562 1 1 13 TYR HD1 H 9.079 11.934 3.547 1.00 . A A . 13 TYR HD1 1 1 19 10563 1 1 13 TYR HD2 H 7.895 8.058 4.968 1.00 . A A . 13 TYR HD2 1 1 19 10564 1 1 13 TYR HE1 H 11.454 11.218 3.576 1.00 . A A . 13 TYR HE1 1 1 19 10565 1 1 13 TYR HE2 H 10.269 7.342 4.997 1.00 . A A . 13 TYR HE2 1 1 19 10566 1 1 13 TYR HH H 12.520 8.176 3.641 1.00 . A A . 13 TYR HH 1 1 19 10567 1 1 13 TYR N N 4.985 11.218 2.924 1.00 . A A . 13 TYR N 1 1 19 10568 1 1 13 TYR O O 5.305 8.836 1.817 1.00 . A A . 13 TYR O 1 1 19 10569 1 1 13 TYR OH O 12.320 8.841 4.304 1.00 . A A . 13 TYR OH 1 1 19 10570 1 1 14 ASP C C 8.912 7.041 1.256 1.00 . A A . 14 ASP C 1 1 19 10571 1 1 14 ASP CA C 7.676 7.815 0.789 1.00 . A A . 14 ASP CA 1 1 19 10572 1 1 14 ASP CB C 7.853 8.137 -0.697 1.00 . A A . 14 ASP CB 1 1 19 10573 1 1 14 ASP CG C 7.394 7.037 -1.656 1.00 . A A . 14 ASP CG 1 1 19 10574 1 1 14 ASP H H 8.401 9.518 1.744 1.00 . A A . 14 ASP H 1 1 19 10575 1 1 14 ASP HA H 6.751 7.264 0.956 1.00 . A A . 14 ASP HA 1 1 19 10576 1 1 14 ASP HB2 H 7.302 9.049 -0.923 1.00 . A A . 14 ASP HB2 1 1 19 10577 1 1 14 ASP HB3 H 8.906 8.346 -0.885 1.00 . A A . 14 ASP HB3 1 1 19 10578 1 1 14 ASP HD2 H 6.542 7.831 -3.135 1.00 . A A . 14 ASP HD2 1 1 19 10579 1 1 14 ASP N N 7.545 9.029 1.575 1.00 . A A . 14 ASP N 1 1 19 10580 1 1 14 ASP O O 10.022 7.225 0.760 1.00 . A A . 14 ASP O 1 1 19 10581 1 1 14 ASP OD1 O 8.032 5.979 -1.767 1.00 . A A . 14 ASP OD1 1 1 19 10582 1 1 14 ASP OD2 O 6.318 7.303 -2.316 1.00 . A A . 14 ASP OD2 1 1 19 10583 1 1 15 PRO C C 10.723 4.924 1.758 1.00 . A A . 15 PRO C 1 1 19 10584 1 1 15 PRO CA C 9.710 5.321 2.823 1.00 . A A . 15 PRO CA 1 1 19 10585 1 1 15 PRO CB C 8.959 4.099 3.346 1.00 . A A . 15 PRO CB 1 1 19 10586 1 1 15 PRO CD C 7.397 5.919 2.837 1.00 . A A . 15 PRO CD 1 1 19 10587 1 1 15 PRO CG C 7.636 4.796 3.844 1.00 . A A . 15 PRO CG 1 1 19 10588 1 1 15 PRO HA H 10.215 5.836 3.641 1.00 . A A . 15 PRO HA 1 1 19 10589 1 1 15 PRO HB2 H 8.805 3.345 2.574 1.00 . A A . 15 PRO HB2 1 1 19 10590 1 1 15 PRO HB3 H 9.503 3.679 4.193 1.00 . A A . 15 PRO HB3 1 1 19 10591 1 1 15 PRO HD2 H 6.655 5.623 2.094 1.00 . A A . 15 PRO HD2 1 1 19 10592 1 1 15 PRO HD3 H 7.073 6.820 3.358 1.00 . A A . 15 PRO HD3 1 1 19 10593 1 1 15 PRO HG2 H 6.896 4.011 3.688 1.00 . A A . 15 PRO HG2 1 1 19 10594 1 1 15 PRO HG3 H 7.610 5.152 4.874 1.00 . A A . 15 PRO HG3 1 1 19 10595 1 1 15 PRO N N 8.689 6.160 2.233 1.00 . A A . 15 PRO N 1 1 19 10596 1 1 15 PRO O O 10.467 3.976 1.020 1.00 . A A . 15 PRO O 1 1 19 10597 1 1 16 ALA C C 14.055 6.285 0.938 1.00 . A A . 16 ALA C 1 1 19 10598 1 1 16 ALA CA C 12.864 5.350 0.718 1.00 . A A . 16 ALA CA 1 1 19 10599 1 1 16 ALA CB C 12.280 5.472 -0.690 1.00 . A A . 16 ALA CB 1 1 19 10600 1 1 16 ALA H H 12.035 6.414 2.304 1.00 . A A . 16 ALA H 1 1 19 10601 1 1 16 ALA HA H 13.188 4.320 0.875 1.00 . A A . 16 ALA HA 1 1 19 10602 1 1 16 ALA HB1 H 11.191 5.488 -0.632 1.00 . A A . 16 ALA HB1 1 1 19 10603 1 1 16 ALA HB2 H 12.632 6.394 -1.151 1.00 . A A . 16 ALA HB2 1 1 19 10604 1 1 16 ALA HB3 H 12.597 4.620 -1.292 1.00 . A A . 16 ALA HB3 1 1 19 10605 1 1 16 ALA N N 11.834 5.644 1.699 1.00 . A A . 16 ALA N 1 1 19 10606 1 1 16 ALA O O 14.298 7.185 0.135 1.00 . A A . 16 ALA O 1 1 19 10607 1 1 17 PHE C C 17.127 5.970 2.709 1.00 . A A . 17 PHE C 1 1 19 10608 1 1 17 PHE CA C 15.924 6.851 2.365 1.00 . A A . 17 PHE CA 1 1 19 10609 1 1 17 PHE CB C 15.547 7.683 3.592 1.00 . A A . 17 PHE CB 1 1 19 10610 1 1 17 PHE CD1 C 14.787 9.670 2.271 1.00 . A A . 17 PHE CD1 1 1 19 10611 1 1 17 PHE CD2 C 16.150 10.048 4.156 1.00 . A A . 17 PHE CD2 1 1 19 10612 1 1 17 PHE CE1 C 14.736 11.068 2.028 1.00 . A A . 17 PHE CE1 1 1 19 10613 1 1 17 PHE CE2 C 16.099 11.446 3.912 1.00 . A A . 17 PHE CE2 1 1 19 10614 1 1 17 PHE CG C 15.493 9.189 3.330 1.00 . A A . 17 PHE CG 1 1 19 10615 1 1 17 PHE CZ C 15.393 11.926 2.854 1.00 . A A . 17 PHE CZ 1 1 19 10616 1 1 17 PHE H H 14.560 5.307 2.677 1.00 . A A . 17 PHE H 1 1 19 10617 1 1 17 PHE HA H 16.159 7.458 1.490 1.00 . A A . 17 PHE HA 1 1 19 10618 1 1 17 PHE HB2 H 14.575 7.353 3.958 1.00 . A A . 17 PHE HB2 1 1 19 10619 1 1 17 PHE HB3 H 16.270 7.489 4.386 1.00 . A A . 17 PHE HB3 1 1 19 10620 1 1 17 PHE HD1 H 14.261 8.982 1.610 1.00 . A A . 17 PHE HD1 1 1 19 10621 1 1 17 PHE HD2 H 16.716 9.662 5.004 1.00 . A A . 17 PHE HD2 1 1 19 10622 1 1 17 PHE HE1 H 14.171 11.453 1.180 1.00 . A A . 17 PHE HE1 1 1 19 10623 1 1 17 PHE HE2 H 16.626 12.133 4.573 1.00 . A A . 17 PHE HE2 1 1 19 10624 1 1 17 PHE HZ H 15.355 13.000 2.666 1.00 . A A . 17 PHE HZ 1 1 19 10625 1 1 17 PHE N N 14.764 6.041 2.030 1.00 . A A . 17 PHE N 1 1 19 10626 1 1 17 PHE O O 17.024 4.744 2.708 1.00 . A A . 17 PHE O 1 1 19 10627 1 1 18 GLU C C 19.203 4.952 4.499 1.00 . A A . 18 GLU C 1 1 19 10628 1 1 18 GLU CA C 19.460 5.922 3.343 1.00 . A A . 18 GLU CA 1 1 19 10629 1 1 18 GLU CB C 20.583 6.903 3.691 1.00 . A A . 18 GLU CB 1 1 19 10630 1 1 18 GLU CD C 22.019 8.477 2.344 1.00 . A A . 18 GLU CD 1 1 19 10631 1 1 18 GLU CG C 20.590 8.091 2.728 1.00 . A A . 18 GLU CG 1 1 19 10632 1 1 18 GLU H H 18.314 7.627 2.996 1.00 . A A . 18 GLU H 1 1 19 10633 1 1 18 GLU HA H 19.737 5.366 2.447 1.00 . A A . 18 GLU HA 1 1 19 10634 1 1 18 GLU HB2 H 20.455 7.259 4.713 1.00 . A A . 18 GLU HB2 1 1 19 10635 1 1 18 GLU HB3 H 21.544 6.390 3.649 1.00 . A A . 18 GLU HB3 1 1 19 10636 1 1 18 GLU HE2 H 23.572 9.373 2.922 1.00 . A A . 18 GLU HE2 1 1 19 10637 1 1 18 GLU HG2 H 20.024 7.841 1.831 1.00 . A A . 18 GLU HG2 1 1 19 10638 1 1 18 GLU HG3 H 20.091 8.943 3.192 1.00 . A A . 18 GLU HG3 1 1 19 10639 1 1 18 GLU N N 18.239 6.630 2.997 1.00 . A A . 18 GLU N 1 1 19 10640 1 1 18 GLU O O 19.175 3.738 4.299 1.00 . A A . 18 GLU O 1 1 19 10641 1 1 18 GLU OE1 O 22.435 8.256 1.198 1.00 . A A . 18 GLU OE1 1 1 19 10642 1 1 18 GLU OE2 O 22.708 9.028 3.287 1.00 . A A . 18 GLU OE2 1 1 19 10643 1 1 19 ASP C C 17.649 5.375 7.684 1.00 . A A . 19 ASP C 1 1 19 10644 1 1 19 ASP CA C 18.766 4.724 6.866 1.00 . A A . 19 ASP CA 1 1 19 10645 1 1 19 ASP CB C 20.011 4.640 7.751 1.00 . A A . 19 ASP CB 1 1 19 10646 1 1 19 ASP CG C 20.004 3.499 8.769 1.00 . A A . 19 ASP CG 1 1 19 10647 1 1 19 ASP H H 19.045 6.512 5.833 1.00 . A A . 19 ASP H 1 1 19 10648 1 1 19 ASP HA H 18.490 3.738 6.493 1.00 . A A . 19 ASP HA 1 1 19 10649 1 1 19 ASP HB2 H 20.887 4.529 7.111 1.00 . A A . 19 ASP HB2 1 1 19 10650 1 1 19 ASP HB3 H 20.125 5.583 8.285 1.00 . A A . 19 ASP HB3 1 1 19 10651 1 1 19 ASP HD2 H 18.755 2.116 8.502 1.00 . A A . 19 ASP HD2 1 1 19 10652 1 1 19 ASP N N 19.021 5.523 5.679 1.00 . A A . 19 ASP N 1 1 19 10653 1 1 19 ASP O O 17.387 6.569 7.544 1.00 . A A . 19 ASP O 1 1 19 10654 1 1 19 ASP OD1 O 20.271 3.706 9.964 1.00 . A A . 19 ASP OD1 1 1 19 10655 1 1 19 ASP OD2 O 19.705 2.340 8.290 1.00 . A A . 19 ASP OD2 1 1 19 10656 1 1 20 LEU C C 16.324 4.877 10.829 1.00 . A A . 20 LEU C 1 1 19 10657 1 1 20 LEU CA C 15.936 5.042 9.358 1.00 . A A . 20 LEU CA 1 1 19 10658 1 1 20 LEU CB C 14.622 4.350 8.989 1.00 . A A . 20 LEU CB 1 1 19 10659 1 1 20 LEU CD1 C 12.600 4.987 7.623 1.00 . A A . 20 LEU CD1 1 1 19 10660 1 1 20 LEU CD2 C 12.518 5.104 10.156 1.00 . A A . 20 LEU CD2 1 1 19 10661 1 1 20 LEU CG C 13.389 5.252 8.907 1.00 . A A . 20 LEU CG 1 1 19 10662 1 1 20 LEU H H 17.238 3.591 8.626 1.00 . A A . 20 LEU H 1 1 19 10663 1 1 20 LEU HA H 15.809 6.105 9.152 1.00 . A A . 20 LEU HA 1 1 19 10664 1 1 20 LEU HB2 H 14.753 3.859 8.024 1.00 . A A . 20 LEU HB2 1 1 19 10665 1 1 20 LEU HB3 H 14.428 3.568 9.721 1.00 . A A . 20 LEU HB3 1 1 19 10666 1 1 20 LEU HD11 H 12.039 4.058 7.726 1.00 . A A . 20 LEU HD11 1 1 19 10667 1 1 20 LEU HD12 H 11.909 5.811 7.444 1.00 . A A . 20 LEU HD12 1 1 19 10668 1 1 20 LEU HD13 H 13.290 4.902 6.783 1.00 . A A . 20 LEU HD13 1 1 19 10669 1 1 20 LEU HD21 H 13.112 4.678 10.964 1.00 . A A . 20 LEU HD21 1 1 19 10670 1 1 20 LEU HD22 H 12.145 6.083 10.456 1.00 . A A . 20 LEU HD22 1 1 19 10671 1 1 20 LEU HD23 H 11.677 4.446 9.936 1.00 . A A . 20 LEU HD23 1 1 19 10672 1 1 20 LEU HG H 13.725 6.288 8.870 1.00 . A A . 20 LEU HG 1 1 19 10673 1 1 20 LEU N N 17.019 4.561 8.518 1.00 . A A . 20 LEU N 1 1 19 10674 1 1 20 LEU O O 16.959 3.904 11.231 1.00 . A A . 20 LEU O 1 1 19 10675 1 1 21 PRO C C 15.099 5.133 13.795 1.00 . A A . 21 PRO C 1 1 19 10676 1 1 21 PRO CA C 16.178 5.911 13.057 1.00 . A A . 21 PRO CA 1 1 19 10677 1 1 21 PRO CB C 16.124 7.395 13.415 1.00 . A A . 21 PRO CB 1 1 19 10678 1 1 21 PRO CD C 15.174 7.022 11.194 1.00 . A A . 21 PRO CD 1 1 19 10679 1 1 21 PRO CG C 14.954 7.851 12.457 1.00 . A A . 21 PRO CG 1 1 19 10680 1 1 21 PRO HA H 17.159 5.499 13.293 1.00 . A A . 21 PRO HA 1 1 19 10681 1 1 21 PRO HB2 H 15.914 7.559 14.472 1.00 . A A . 21 PRO HB2 1 1 19 10682 1 1 21 PRO HB3 H 17.065 7.867 13.131 1.00 . A A . 21 PRO HB3 1 1 19 10683 1 1 21 PRO HD2 H 14.223 6.738 10.745 1.00 . A A . 21 PRO HD2 1 1 19 10684 1 1 21 PRO HD3 H 15.777 7.586 10.482 1.00 . A A . 21 PRO HD3 1 1 19 10685 1 1 21 PRO HG2 H 13.900 7.816 12.730 1.00 . A A . 21 PRO HG2 1 1 19 10686 1 1 21 PRO HG3 H 15.290 8.881 12.340 1.00 . A A . 21 PRO HG3 1 1 19 10687 1 1 21 PRO N N 15.923 5.864 11.633 1.00 . A A . 21 PRO N 1 1 19 10688 1 1 21 PRO O O 14.146 4.688 13.158 1.00 . A A . 21 PRO O 1 1 19 10689 1 1 22 ASP C C 13.510 5.240 16.768 1.00 . A A . 22 ASP C 1 1 19 10690 1 1 22 ASP CA C 14.293 4.254 15.900 1.00 . A A . 22 ASP CA 1 1 19 10691 1 1 22 ASP CB C 14.984 3.251 16.828 1.00 . A A . 22 ASP CB 1 1 19 10692 1 1 22 ASP CG C 16.260 3.763 17.497 1.00 . A A . 22 ASP CG 1 1 19 10693 1 1 22 ASP H H 16.042 5.347 15.613 1.00 . A A . 22 ASP H 1 1 19 10694 1 1 22 ASP HA H 13.659 3.738 15.179 1.00 . A A . 22 ASP HA 1 1 19 10695 1 1 22 ASP HB2 H 14.278 2.954 17.604 1.00 . A A . 22 ASP HB2 1 1 19 10696 1 1 22 ASP HB3 H 15.225 2.356 16.255 1.00 . A A . 22 ASP HB3 1 1 19 10697 1 1 22 ASP HD2 H 18.137 3.831 17.364 1.00 . A A . 22 ASP HD2 1 1 19 10698 1 1 22 ASP N N 15.265 4.982 15.102 1.00 . A A . 22 ASP N 1 1 19 10699 1 1 22 ASP O O 13.286 4.990 17.951 1.00 . A A . 22 ASP O 1 1 19 10700 1 1 22 ASP OD1 O 16.227 4.292 18.618 1.00 . A A . 22 ASP OD1 1 1 19 10701 1 1 22 ASP OD2 O 17.340 3.598 16.809 1.00 . A A . 22 ASP OD2 1 1 19 10702 1 1 23 ASP C C 12.129 8.555 15.911 1.00 . A A . 23 ASP C 1 1 19 10703 1 1 23 ASP CA C 12.362 7.368 16.849 1.00 . A A . 23 ASP CA 1 1 19 10704 1 1 23 ASP CB C 13.129 7.875 18.072 1.00 . A A . 23 ASP CB 1 1 19 10705 1 1 23 ASP CG C 12.253 8.372 19.224 1.00 . A A . 23 ASP CG 1 1 19 10706 1 1 23 ASP H H 13.301 6.539 15.185 1.00 . A A . 23 ASP H 1 1 19 10707 1 1 23 ASP HA H 11.432 6.885 17.149 1.00 . A A . 23 ASP HA 1 1 19 10708 1 1 23 ASP HB2 H 13.766 7.072 18.441 1.00 . A A . 23 ASP HB2 1 1 19 10709 1 1 23 ASP HB3 H 13.787 8.686 17.760 1.00 . A A . 23 ASP HB3 1 1 19 10710 1 1 23 ASP HD2 H 12.909 10.131 19.374 1.00 . A A . 23 ASP HD2 1 1 19 10711 1 1 23 ASP N N 13.116 6.342 16.148 1.00 . A A . 23 ASP N 1 1 19 10712 1 1 23 ASP O O 12.477 9.688 16.241 1.00 . A A . 23 ASP O 1 1 19 10713 1 1 23 ASP OD1 O 11.132 7.884 19.431 1.00 . A A . 23 ASP OD1 1 1 19 10714 1 1 23 ASP OD2 O 12.773 9.314 19.935 1.00 . A A . 23 ASP OD2 1 1 19 10715 1 1 24 TRP C C 9.959 9.980 14.179 1.00 . A A . 24 TRP C 1 1 19 10716 1 1 24 TRP CA C 11.258 9.281 13.775 1.00 . A A . 24 TRP CA 1 1 19 10717 1 1 24 TRP CB C 11.205 8.688 12.366 1.00 . A A . 24 TRP CB 1 1 19 10718 1 1 24 TRP CD1 C 12.494 10.516 11.078 1.00 . A A . 24 TRP CD1 1 1 19 10719 1 1 24 TRP CD2 C 10.547 10.004 10.154 1.00 . A A . 24 TRP CD2 1 1 19 10720 1 1 24 TRP CE2 C 11.128 10.984 9.375 1.00 . A A . 24 TRP CE2 1 1 19 10721 1 1 24 TRP CE3 C 9.291 9.460 9.832 1.00 . A A . 24 TRP CE3 1 1 19 10722 1 1 24 TRP CG C 11.438 9.709 11.251 1.00 . A A . 24 TRP CG 1 1 19 10723 1 1 24 TRP CH2 C 9.275 10.977 7.883 1.00 . A A . 24 TRP CH2 1 1 19 10724 1 1 24 TRP CZ2 C 10.526 11.505 8.224 1.00 . A A . 24 TRP CZ2 1 1 19 10725 1 1 24 TRP CZ3 C 8.702 9.991 8.678 1.00 . A A . 24 TRP CZ3 1 1 19 10726 1 1 24 TRP H H 11.262 7.329 14.503 1.00 . A A . 24 TRP H 1 1 19 10727 1 1 24 TRP HA H 12.084 9.992 13.789 1.00 . A A . 24 TRP HA 1 1 19 10728 1 1 24 TRP HB2 H 11.955 7.901 12.286 1.00 . A A . 24 TRP HB2 1 1 19 10729 1 1 24 TRP HB3 H 10.234 8.218 12.217 1.00 . A A . 24 TRP HB3 1 1 19 10730 1 1 24 TRP HD1 H 13.359 10.546 11.742 1.00 . A A . 24 TRP HD1 1 1 19 10731 1 1 24 TRP HE1 H 13.062 12.045 9.590 1.00 . A A . 24 TRP HE1 1 1 19 10732 1 1 24 TRP HE3 H 8.811 8.685 10.430 1.00 . A A . 24 TRP HE3 1 1 19 10733 1 1 24 TRP HH2 H 8.751 11.339 6.998 1.00 . A A . 24 TRP HH2 1 1 19 10734 1 1 24 TRP HZ2 H 11.006 12.279 7.626 1.00 . A A . 24 TRP HZ2 1 1 19 10735 1 1 24 TRP HZ3 H 7.728 9.604 8.382 1.00 . A A . 24 TRP HZ3 1 1 19 10736 1 1 24 TRP N N 11.543 8.254 14.762 1.00 . A A . 24 TRP N 1 1 19 10737 1 1 24 TRP NE1 N 12.349 11.305 9.956 1.00 . A A . 24 TRP NE1 1 1 19 10738 1 1 24 TRP O O 8.991 9.324 14.561 1.00 . A A . 24 TRP O 1 1 19 10739 1 1 25 ALA C C 8.481 13.042 13.278 1.00 . A A . 25 ALA C 1 1 19 10740 1 1 25 ALA CA C 8.814 12.095 14.433 1.00 . A A . 25 ALA CA 1 1 19 10741 1 1 25 ALA CB C 9.082 12.843 15.741 1.00 . A A . 25 ALA CB 1 1 19 10742 1 1 25 ALA H H 10.771 11.827 13.771 1.00 . A A . 25 ALA H 1 1 19 10743 1 1 25 ALA HA H 7.980 11.411 14.584 1.00 . A A . 25 ALA HA 1 1 19 10744 1 1 25 ALA HB1 H 10.099 13.234 15.734 1.00 . A A . 25 ALA HB1 1 1 19 10745 1 1 25 ALA HB2 H 8.376 13.668 15.838 1.00 . A A . 25 ALA HB2 1 1 19 10746 1 1 25 ALA HB3 H 8.960 12.160 16.582 1.00 . A A . 25 ALA HB3 1 1 19 10747 1 1 25 ALA N N 9.979 11.301 14.082 1.00 . A A . 25 ALA N 1 1 19 10748 1 1 25 ALA O O 9.377 13.624 12.670 1.00 . A A . 25 ALA O 1 1 19 10749 1 1 26 CYS C C 7.328 15.420 12.150 1.00 . A A . 26 CYS C 1 1 19 10750 1 1 26 CYS CA C 6.726 14.030 11.939 1.00 . A A . 26 CYS CA 1 1 19 10751 1 1 26 CYS CB C 5.198 14.075 11.869 1.00 . A A . 26 CYS CB 1 1 19 10752 1 1 26 CYS H H 6.466 12.688 13.511 1.00 . A A . 26 CYS H 1 1 19 10753 1 1 26 CYS HA H 7.082 13.592 11.007 1.00 . A A . 26 CYS HA 1 1 19 10754 1 1 26 CYS HB2 H 4.807 13.098 12.152 1.00 . A A . 26 CYS HB2 1 1 19 10755 1 1 26 CYS HB3 H 4.835 14.791 12.607 1.00 . A A . 26 CYS HB3 1 1 19 10756 1 1 26 CYS N N 7.189 13.165 13.011 1.00 . A A . 26 CYS N 1 1 19 10757 1 1 26 CYS O O 7.305 15.984 13.242 1.00 . A A . 26 CYS O 1 1 19 10758 1 1 26 CYS SG S 4.519 14.528 10.231 1.00 . A A . 26 CYS SG 1 1 19 10759 1 1 27 PRO C C 7.435 18.352 11.143 1.00 . A A . 27 PRO C 1 1 19 10760 1 1 27 PRO CA C 8.502 17.273 11.035 1.00 . A A . 27 PRO CA 1 1 19 10761 1 1 27 PRO CB C 9.212 17.339 9.685 1.00 . A A . 27 PRO CB 1 1 19 10762 1 1 27 PRO CD C 7.925 15.334 9.765 1.00 . A A . 27 PRO CD 1 1 19 10763 1 1 27 PRO CG C 8.296 16.452 8.793 1.00 . A A . 27 PRO CG 1 1 19 10764 1 1 27 PRO HA H 9.221 17.382 11.848 1.00 . A A . 27 PRO HA 1 1 19 10765 1 1 27 PRO HB2 H 9.274 18.355 9.297 1.00 . A A . 27 PRO HB2 1 1 19 10766 1 1 27 PRO HB3 H 10.206 16.900 9.780 1.00 . A A . 27 PRO HB3 1 1 19 10767 1 1 27 PRO HD2 H 6.964 14.893 9.499 1.00 . A A . 27 PRO HD2 1 1 19 10768 1 1 27 PRO HD3 H 8.705 14.573 9.766 1.00 . A A . 27 PRO HD3 1 1 19 10769 1 1 27 PRO HG2 H 7.385 16.892 8.387 1.00 . A A . 27 PRO HG2 1 1 19 10770 1 1 27 PRO HG3 H 8.947 16.106 7.991 1.00 . A A . 27 PRO HG3 1 1 19 10771 1 1 27 PRO N N 7.878 15.968 11.064 1.00 . A A . 27 PRO N 1 1 19 10772 1 1 27 PRO O O 7.782 19.532 11.168 1.00 . A A . 27 PRO O 1 1 19 10773 1 1 28 VAL C C 4.471 18.808 12.705 1.00 . A A . 28 VAL C 1 1 19 10774 1 1 28 VAL CA C 5.082 18.890 11.304 1.00 . A A . 28 VAL CA 1 1 19 10775 1 1 28 VAL CB C 4.063 18.635 10.192 1.00 . A A . 28 VAL CB 1 1 19 10776 1 1 28 VAL CG1 C 2.913 19.641 10.260 1.00 . A A . 28 VAL CG1 1 1 19 10777 1 1 28 VAL CG2 C 4.734 18.662 8.817 1.00 . A A . 28 VAL CG2 1 1 19 10778 1 1 28 VAL H H 5.903 16.978 11.181 1.00 . A A . 28 VAL H 1 1 19 10779 1 1 28 VAL HA H 5.497 19.886 11.160 1.00 . A A . 28 VAL HA 1 1 19 10780 1 1 28 VAL HB H 3.646 17.639 10.341 1.00 . A A . 28 VAL HB 1 1 19 10781 1 1 28 VAL HG11 H 2.841 20.177 9.313 1.00 . A A . 28 VAL HG11 1 1 19 10782 1 1 28 VAL HG12 H 1.979 19.113 10.451 1.00 . A A . 28 VAL HG12 1 1 19 10783 1 1 28 VAL HG13 H 3.100 20.352 11.065 1.00 . A A . 28 VAL HG13 1 1 19 10784 1 1 28 VAL HG21 H 5.646 19.257 8.869 1.00 . A A . 28 VAL HG21 1 1 19 10785 1 1 28 VAL HG22 H 4.982 17.645 8.513 1.00 . A A . 28 VAL HG22 1 1 19 10786 1 1 28 VAL HG23 H 4.053 19.103 8.088 1.00 . A A . 28 VAL HG23 1 1 19 10787 1 1 28 VAL N N 6.177 17.940 11.202 1.00 . A A . 28 VAL N 1 1 19 10788 1 1 28 VAL O O 4.923 19.488 13.624 1.00 . A A . 28 VAL O 1 1 19 10789 1 1 29 CYS C C 3.832 17.538 15.171 1.00 . A A . 29 CYS C 1 1 19 10790 1 1 29 CYS CA C 2.774 17.789 14.095 1.00 . A A . 29 CYS CA 1 1 19 10791 1 1 29 CYS CB C 1.744 16.659 14.032 1.00 . A A . 29 CYS CB 1 1 19 10792 1 1 29 CYS H H 3.090 17.418 12.070 1.00 . A A . 29 CYS H 1 1 19 10793 1 1 29 CYS HA H 2.231 18.712 14.294 1.00 . A A . 29 CYS HA 1 1 19 10794 1 1 29 CYS HB2 H 1.319 16.519 15.027 1.00 . A A . 29 CYS HB2 1 1 19 10795 1 1 29 CYS HB3 H 0.928 16.965 13.378 1.00 . A A . 29 CYS HB3 1 1 19 10796 1 1 29 CYS N N 3.452 17.969 12.822 1.00 . A A . 29 CYS N 1 1 19 10797 1 1 29 CYS O O 3.817 18.177 16.223 1.00 . A A . 29 CYS O 1 1 19 10798 1 1 29 CYS SG S 2.398 15.055 13.442 1.00 . A A . 29 CYS SG 1 1 19 10799 1 1 30 GLY C C 5.538 14.894 16.440 1.00 . A A . 30 GLY C 1 1 19 10800 1 1 30 GLY CA C 5.788 16.262 15.801 1.00 . A A . 30 GLY CA 1 1 19 10801 1 1 30 GLY H H 4.730 16.090 14.016 1.00 . A A . 30 GLY H 1 1 19 10802 1 1 30 GLY HA2 H 6.744 16.254 15.278 1.00 . A A . 30 GLY HA2 1 1 19 10803 1 1 30 GLY HA3 H 5.857 17.023 16.579 1.00 . A A . 30 GLY HA3 1 1 19 10804 1 1 30 GLY N N 4.725 16.606 14.872 1.00 . A A . 30 GLY N 1 1 19 10805 1 1 30 GLY O O 6.413 14.351 17.112 1.00 . A A . 30 GLY O 1 1 19 10806 1 1 31 ALA C C 4.979 12.032 16.300 1.00 . A A . 31 ALA C 1 1 19 10807 1 1 31 ALA CA C 3.964 13.084 16.750 1.00 . A A . 31 ALA CA 1 1 19 10808 1 1 31 ALA CB C 2.538 12.742 16.315 1.00 . A A . 31 ALA CB 1 1 19 10809 1 1 31 ALA H H 3.635 14.828 15.658 1.00 . A A . 31 ALA H 1 1 19 10810 1 1 31 ALA HA H 3.990 13.161 17.837 1.00 . A A . 31 ALA HA 1 1 19 10811 1 1 31 ALA HB1 H 1.835 13.405 16.819 1.00 . A A . 31 ALA HB1 1 1 19 10812 1 1 31 ALA HB2 H 2.447 12.870 15.236 1.00 . A A . 31 ALA HB2 1 1 19 10813 1 1 31 ALA HB3 H 2.316 11.709 16.577 1.00 . A A . 31 ALA HB3 1 1 19 10814 1 1 31 ALA N N 4.340 14.379 16.207 1.00 . A A . 31 ALA N 1 1 19 10815 1 1 31 ALA O O 5.749 12.265 15.370 1.00 . A A . 31 ALA O 1 1 19 10816 1 1 32 SER C C 5.361 9.059 15.425 1.00 . A A . 32 SER C 1 1 19 10817 1 1 32 SER CA C 5.856 9.808 16.664 1.00 . A A . 32 SER CA 1 1 19 10818 1 1 32 SER CB C 5.998 8.846 17.845 1.00 . A A . 32 SER CB 1 1 19 10819 1 1 32 SER H H 4.318 10.715 17.738 1.00 . A A . 32 SER H 1 1 19 10820 1 1 32 SER HA H 6.817 10.282 16.464 1.00 . A A . 32 SER HA 1 1 19 10821 1 1 32 SER HB2 H 6.702 8.055 17.586 1.00 . A A . 32 SER HB2 1 1 19 10822 1 1 32 SER HB3 H 6.416 9.379 18.699 1.00 . A A . 32 SER HB3 1 1 19 10823 1 1 32 SER HG H 4.855 7.734 19.055 1.00 . A A . 32 SER HG 1 1 19 10824 1 1 32 SER N N 4.948 10.896 16.982 1.00 . A A . 32 SER N 1 1 19 10825 1 1 32 SER O O 4.263 9.320 14.934 1.00 . A A . 32 SER O 1 1 19 10826 1 1 32 SER OG O 4.749 8.266 18.214 1.00 . A A . 32 SER OG 1 1 19 10827 1 1 33 LYS C C 4.950 6.188 14.202 1.00 . A A . 33 LYS C 1 1 19 10828 1 1 33 LYS CA C 5.854 7.352 13.784 1.00 . A A . 33 LYS CA 1 1 19 10829 1 1 33 LYS CB C 7.121 6.912 13.049 1.00 . A A . 33 LYS CB 1 1 19 10830 1 1 33 LYS CD C 9.237 6.091 14.149 1.00 . A A . 33 LYS CD 1 1 19 10831 1 1 33 LYS CE C 9.670 5.340 15.409 1.00 . A A . 33 LYS CE 1 1 19 10832 1 1 33 LYS CG C 7.796 5.743 13.770 1.00 . A A . 33 LYS CG 1 1 19 10833 1 1 33 LYS H H 7.083 7.933 15.361 1.00 . A A . 33 LYS H 1 1 19 10834 1 1 33 LYS HA H 5.295 7.997 13.106 1.00 . A A . 33 LYS HA 1 1 19 10835 1 1 33 LYS HB2 H 6.871 6.618 12.029 1.00 . A A . 33 LYS HB2 1 1 19 10836 1 1 33 LYS HB3 H 7.815 7.749 12.978 1.00 . A A . 33 LYS HB3 1 1 19 10837 1 1 33 LYS HD2 H 9.905 5.840 13.324 1.00 . A A . 33 LYS HD2 1 1 19 10838 1 1 33 LYS HD3 H 9.324 7.166 14.313 1.00 . A A . 33 LYS HD3 1 1 19 10839 1 1 33 LYS HE2 H 9.709 4.269 15.206 1.00 . A A . 33 LYS HE2 1 1 19 10840 1 1 33 LYS HE3 H 10.676 5.648 15.696 1.00 . A A . 33 LYS HE3 1 1 19 10841 1 1 33 LYS HG2 H 7.231 5.490 14.667 1.00 . A A . 33 LYS HG2 1 1 19 10842 1 1 33 LYS HG3 H 7.787 4.861 13.129 1.00 . A A . 33 LYS HG3 1 1 19 10843 1 1 33 LYS HZ1 H 8.135 6.406 16.331 1.00 . A A . 33 LYS HZ1 1 1 19 10844 1 1 33 LYS HZ2 H 8.114 4.818 16.693 1.00 . A A . 33 LYS HZ2 1 1 19 10845 1 1 33 LYS N N 6.193 8.141 14.956 1.00 . A A . 33 LYS N 1 1 19 10846 1 1 33 LYS NZ N 8.728 5.606 16.519 1.00 . A A . 33 LYS NZ 1 1 19 10847 1 1 33 LYS O O 5.230 5.035 13.882 1.00 . A A . 33 LYS O 1 1 19 10848 1 1 34 ASP C C 1.584 5.769 14.705 1.00 . A A . 34 ASP C 1 1 19 10849 1 1 34 ASP CA C 2.939 5.534 15.375 1.00 . A A . 34 ASP CA 1 1 19 10850 1 1 34 ASP CB C 2.740 5.625 16.889 1.00 . A A . 34 ASP CB 1 1 19 10851 1 1 34 ASP CG C 1.820 4.559 17.486 1.00 . A A . 34 ASP CG 1 1 19 10852 1 1 34 ASP H H 3.665 7.475 15.165 1.00 . A A . 34 ASP H 1 1 19 10853 1 1 34 ASP HA H 3.379 4.575 15.100 1.00 . A A . 34 ASP HA 1 1 19 10854 1 1 34 ASP HB2 H 3.715 5.554 17.373 1.00 . A A . 34 ASP HB2 1 1 19 10855 1 1 34 ASP HB3 H 2.336 6.608 17.129 1.00 . A A . 34 ASP HB3 1 1 19 10856 1 1 34 ASP HD2 H 0.039 4.306 18.046 1.00 . A A . 34 ASP HD2 1 1 19 10857 1 1 34 ASP N N 3.886 6.534 14.910 1.00 . A A . 34 ASP N 1 1 19 10858 1 1 34 ASP O O 0.899 4.819 14.330 1.00 . A A . 34 ASP O 1 1 19 10859 1 1 34 ASP OD1 O 2.113 3.355 17.425 1.00 . A A . 34 ASP OD1 1 1 19 10860 1 1 34 ASP OD2 O 0.746 5.014 18.038 1.00 . A A . 34 ASP OD2 1 1 19 10861 1 1 35 ALA C C 0.077 7.220 12.444 1.00 . A A . 35 ALA C 1 1 19 10862 1 1 35 ALA CA C -0.023 7.415 13.958 1.00 . A A . 35 ALA CA 1 1 19 10863 1 1 35 ALA CB C -0.372 8.856 14.337 1.00 . A A . 35 ALA CB 1 1 19 10864 1 1 35 ALA H H 1.800 7.809 14.884 1.00 . A A . 35 ALA H 1 1 19 10865 1 1 35 ALA HA H -0.794 6.753 14.351 1.00 . A A . 35 ALA HA 1 1 19 10866 1 1 35 ALA HB1 H 0.173 9.544 13.690 1.00 . A A . 35 ALA HB1 1 1 19 10867 1 1 35 ALA HB2 H -1.443 9.015 14.215 1.00 . A A . 35 ALA HB2 1 1 19 10868 1 1 35 ALA HB3 H -0.093 9.036 15.376 1.00 . A A . 35 ALA HB3 1 1 19 10869 1 1 35 ALA N N 1.237 7.042 14.576 1.00 . A A . 35 ALA N 1 1 19 10870 1 1 35 ALA O O -0.939 7.141 11.755 1.00 . A A . 35 ALA O 1 1 19 10871 1 1 36 PHE C C 1.040 5.603 10.075 1.00 . A A . 36 PHE C 1 1 19 10872 1 1 36 PHE CA C 1.559 6.962 10.550 1.00 . A A . 36 PHE CA 1 1 19 10873 1 1 36 PHE CB C 3.076 7.012 10.349 1.00 . A A . 36 PHE CB 1 1 19 10874 1 1 36 PHE CD1 C 3.823 9.173 11.371 1.00 . A A . 36 PHE CD1 1 1 19 10875 1 1 36 PHE CD2 C 3.965 8.947 9.031 1.00 . A A . 36 PHE CD2 1 1 19 10876 1 1 36 PHE CE1 C 4.349 10.489 11.277 1.00 . A A . 36 PHE CE1 1 1 19 10877 1 1 36 PHE CE2 C 4.491 10.263 8.936 1.00 . A A . 36 PHE CE2 1 1 19 10878 1 1 36 PHE CG C 3.642 8.430 10.247 1.00 . A A . 36 PHE CG 1 1 19 10879 1 1 36 PHE CZ C 4.672 11.006 10.061 1.00 . A A . 36 PHE CZ 1 1 19 10880 1 1 36 PHE H H 2.134 7.212 12.537 1.00 . A A . 36 PHE H 1 1 19 10881 1 1 36 PHE HA H 1.030 7.755 10.023 1.00 . A A . 36 PHE HA 1 1 19 10882 1 1 36 PHE HB2 H 3.560 6.499 11.179 1.00 . A A . 36 PHE HB2 1 1 19 10883 1 1 36 PHE HB3 H 3.331 6.465 9.443 1.00 . A A . 36 PHE HB3 1 1 19 10884 1 1 36 PHE HD1 H 3.564 8.759 12.345 1.00 . A A . 36 PHE HD1 1 1 19 10885 1 1 36 PHE HD2 H 3.821 8.352 8.130 1.00 . A A . 36 PHE HD2 1 1 19 10886 1 1 36 PHE HE1 H 4.493 11.084 12.178 1.00 . A A . 36 PHE HE1 1 1 19 10887 1 1 36 PHE HE2 H 4.750 10.678 7.962 1.00 . A A . 36 PHE HE2 1 1 19 10888 1 1 36 PHE HZ H 5.075 12.016 9.988 1.00 . A A . 36 PHE HZ 1 1 19 10889 1 1 36 PHE N N 1.313 7.146 11.969 1.00 . A A . 36 PHE N 1 1 19 10890 1 1 36 PHE O O 1.277 4.584 10.721 1.00 . A A . 36 PHE O 1 1 19 10891 1 1 37 GLU C C -0.114 4.450 6.856 1.00 . A A . 37 GLU C 1 1 19 10892 1 1 37 GLU CA C -0.215 4.417 8.383 1.00 . A A . 37 GLU CA 1 1 19 10893 1 1 37 GLU CB C -1.663 4.213 8.831 1.00 . A A . 37 GLU CB 1 1 19 10894 1 1 37 GLU CD C -2.070 1.927 7.846 1.00 . A A . 37 GLU CD 1 1 19 10895 1 1 37 GLU CG C -1.941 2.739 9.136 1.00 . A A . 37 GLU CG 1 1 19 10896 1 1 37 GLU H H 0.152 6.466 8.431 1.00 . A A . 37 GLU H 1 1 19 10897 1 1 37 GLU HA H 0.398 3.607 8.776 1.00 . A A . 37 GLU HA 1 1 19 10898 1 1 37 GLU HB2 H -1.861 4.815 9.719 1.00 . A A . 37 GLU HB2 1 1 19 10899 1 1 37 GLU HB3 H -2.342 4.561 8.053 1.00 . A A . 37 GLU HB3 1 1 19 10900 1 1 37 GLU HE2 H -2.936 2.028 6.177 1.00 . A A . 37 GLU HE2 1 1 19 10901 1 1 37 GLU HG2 H -1.135 2.333 9.746 1.00 . A A . 37 GLU HG2 1 1 19 10902 1 1 37 GLU HG3 H -2.859 2.651 9.719 1.00 . A A . 37 GLU HG3 1 1 19 10903 1 1 37 GLU N N 0.340 5.633 8.951 1.00 . A A . 37 GLU N 1 1 19 10904 1 1 37 GLU O O -0.359 5.483 6.237 1.00 . A A . 37 GLU O 1 1 19 10905 1 1 37 GLU OE1 O -1.195 1.104 7.542 1.00 . A A . 37 GLU OE1 1 1 19 10906 1 1 37 GLU OE2 O -3.126 2.176 7.148 1.00 . A A . 37 GLU OE2 1 1 19 10907 1 1 38 LYS C C -0.981 3.402 4.196 1.00 . A A . 38 LYS C 1 1 19 10908 1 1 38 LYS CA C 0.385 3.191 4.852 1.00 . A A . 38 LYS CA 1 1 19 10909 1 1 38 LYS CB C 1.046 1.862 4.481 1.00 . A A . 38 LYS CB 1 1 19 10910 1 1 38 LYS CD C 1.107 0.171 2.611 1.00 . A A . 38 LYS CD 1 1 19 10911 1 1 38 LYS CE C 1.679 -0.040 1.209 1.00 . A A . 38 LYS CE 1 1 19 10912 1 1 38 LYS CG C 1.054 1.658 2.964 1.00 . A A . 38 LYS CG 1 1 19 10913 1 1 38 LYS H H 0.446 2.470 6.805 1.00 . A A . 38 LYS H 1 1 19 10914 1 1 38 LYS HA H 1.053 3.986 4.523 1.00 . A A . 38 LYS HA 1 1 19 10915 1 1 38 LYS HB2 H 2.068 1.841 4.860 1.00 . A A . 38 LYS HB2 1 1 19 10916 1 1 38 LYS HB3 H 0.513 1.041 4.959 1.00 . A A . 38 LYS HB3 1 1 19 10917 1 1 38 LYS HD2 H 1.719 -0.359 3.342 1.00 . A A . 38 LYS HD2 1 1 19 10918 1 1 38 LYS HD3 H 0.105 -0.256 2.667 1.00 . A A . 38 LYS HD3 1 1 19 10919 1 1 38 LYS HE2 H 1.003 0.382 0.466 1.00 . A A . 38 LYS HE2 1 1 19 10920 1 1 38 LYS HE3 H 2.628 0.489 1.114 1.00 . A A . 38 LYS HE3 1 1 19 10921 1 1 38 LYS HG2 H 0.162 2.107 2.529 1.00 . A A . 38 LYS HG2 1 1 19 10922 1 1 38 LYS HG3 H 1.913 2.169 2.530 1.00 . A A . 38 LYS HG3 1 1 19 10923 1 1 38 LYS HZ1 H 1.205 -2.056 1.432 1.00 . A A . 38 LYS HZ1 1 1 19 10924 1 1 38 LYS HZ2 H 1.793 -1.702 -0.044 1.00 . A A . 38 LYS HZ2 1 1 19 10925 1 1 38 LYS N N 0.248 3.306 6.295 1.00 . A A . 38 LYS N 1 1 19 10926 1 1 38 LYS NZ N 1.881 -1.482 0.941 1.00 . A A . 38 LYS NZ 1 1 19 10927 1 1 38 LYS O O -1.960 2.757 4.570 1.00 . A A . 38 LYS O 1 1 19 10928 1 1 39 GLN C C -1.928 4.993 1.068 1.00 . A A . 39 GLN C 1 1 19 10929 1 1 39 GLN CA C -2.233 4.613 2.519 1.00 . A A . 39 GLN CA 1 1 19 10930 1 1 39 GLN CB C -3.014 5.724 3.224 1.00 . A A . 39 GLN CB 1 1 19 10931 1 1 39 GLN CD C -5.463 5.158 3.437 1.00 . A A . 39 GLN CD 1 1 19 10932 1 1 39 GLN CG C -4.100 5.140 4.131 1.00 . A A . 39 GLN CG 1 1 19 10933 1 1 39 GLN H H -0.204 4.829 2.932 1.00 . A A . 39 GLN H 1 1 19 10934 1 1 39 GLN HA H -2.818 3.694 2.543 1.00 . A A . 39 GLN HA 1 1 19 10935 1 1 39 GLN HB2 H -2.332 6.335 3.814 1.00 . A A . 39 GLN HB2 1 1 19 10936 1 1 39 GLN HB3 H -3.470 6.381 2.482 1.00 . A A . 39 GLN HB3 1 1 19 10937 1 1 39 GLN HE21 H -4.846 3.611 2.287 1.00 . A A . 39 GLN HE21 1 1 19 10938 1 1 39 GLN HE22 H -6.456 4.167 1.977 1.00 . A A . 39 GLN HE22 1 1 19 10939 1 1 39 GLN HG2 H -3.839 4.117 4.403 1.00 . A A . 39 GLN HG2 1 1 19 10940 1 1 39 GLN HG3 H -4.152 5.713 5.057 1.00 . A A . 39 GLN HG3 1 1 19 10941 1 1 39 GLN N N -1.004 4.309 3.230 1.00 . A A . 39 GLN N 1 1 19 10942 1 1 39 GLN NE2 N -5.599 4.236 2.489 1.00 . A A . 39 GLN NE2 1 1 19 10943 1 1 39 GLN O O -1.827 6.176 0.741 1.00 . A A . 39 GLN O 1 1 19 10944 1 1 39 GLN OE1 O -6.333 5.957 3.742 1.00 . A A . 39 GLN OE1 1 1 20 10945 1 1 1 MET C C 5.737 1.707 -0.488 1.00 . A A . 1 MET C 1 1 20 10946 1 1 1 MET CA C 6.812 1.213 -1.458 1.00 . A A . 1 MET CA 1 1 20 10947 1 1 1 MET CB C 6.925 -0.311 -1.361 1.00 . A A . 1 MET CB 1 1 20 10948 1 1 1 MET CE C 6.348 -3.527 -1.524 1.00 . A A . 1 MET CE 1 1 20 10949 1 1 1 MET CG C 6.203 -0.988 -2.528 1.00 . A A . 1 MET CG 1 1 20 10950 1 1 1 MET H1 H 8.305 1.910 -0.184 1.00 . A A . 1 MET H1 1 1 20 10951 1 1 1 MET HA H 6.570 1.530 -2.472 1.00 . A A . 1 MET HA 1 1 20 10952 1 1 1 MET HB2 H 7.975 -0.602 -1.361 1.00 . A A . 1 MET HB2 1 1 20 10953 1 1 1 MET HB3 H 6.498 -0.651 -0.419 1.00 . A A . 1 MET HB3 1 1 20 10954 1 1 1 MET HE1 H 6.574 -4.580 -1.691 1.00 . A A . 1 MET HE1 1 1 20 10955 1 1 1 MET HE2 H 6.821 -3.196 -0.599 1.00 . A A . 1 MET HE2 1 1 20 10956 1 1 1 MET HE3 H 5.269 -3.396 -1.446 1.00 . A A . 1 MET HE3 1 1 20 10957 1 1 1 MET HG2 H 5.151 -1.135 -2.280 1.00 . A A . 1 MET HG2 1 1 20 10958 1 1 1 MET HG3 H 6.237 -0.347 -3.409 1.00 . A A . 1 MET HG3 1 1 20 10959 1 1 1 MET N N 8.100 1.814 -1.158 1.00 . A A . 1 MET N 1 1 20 10960 1 1 1 MET O O 6.024 1.981 0.677 1.00 . A A . 1 MET O 1 1 20 10961 1 1 1 MET SD S 6.968 -2.560 -2.889 1.00 . A A . 1 MET SD 1 1 20 10962 1 1 2 ASP C C 3.602 3.739 0.159 1.00 . A A . 2 ASP C 1 1 20 10963 1 1 2 ASP CA C 3.401 2.264 -0.198 1.00 . A A . 2 ASP CA 1 1 20 10964 1 1 2 ASP CB C 3.302 1.472 1.106 1.00 . A A . 2 ASP CB 1 1 20 10965 1 1 2 ASP CG C 1.901 0.959 1.447 1.00 . A A . 2 ASP CG 1 1 20 10966 1 1 2 ASP H H 4.295 1.584 -1.952 1.00 . A A . 2 ASP H 1 1 20 10967 1 1 2 ASP HA H 2.518 2.101 -0.816 1.00 . A A . 2 ASP HA 1 1 20 10968 1 1 2 ASP HB2 H 3.980 0.621 1.050 1.00 . A A . 2 ASP HB2 1 1 20 10969 1 1 2 ASP HB3 H 3.650 2.102 1.925 1.00 . A A . 2 ASP HB3 1 1 20 10970 1 1 2 ASP HD2 H 1.548 -0.526 0.344 1.00 . A A . 2 ASP HD2 1 1 20 10971 1 1 2 ASP N N 4.520 1.808 -1.004 1.00 . A A . 2 ASP N 1 1 20 10972 1 1 2 ASP O O 4.441 4.415 -0.435 1.00 . A A . 2 ASP O 1 1 20 10973 1 1 2 ASP OD1 O 1.013 1.734 1.831 1.00 . A A . 2 ASP OD1 1 1 20 10974 1 1 2 ASP OD2 O 1.736 -0.312 1.302 1.00 . A A . 2 ASP OD2 1 1 20 10975 1 1 3 ILE C C 2.590 5.646 3.064 1.00 . A A . 3 ILE C 1 1 20 10976 1 1 3 ILE CA C 2.901 5.575 1.568 1.00 . A A . 3 ILE CA 1 1 20 10977 1 1 3 ILE CB C 2.003 6.467 0.709 1.00 . A A . 3 ILE CB 1 1 20 10978 1 1 3 ILE CD1 C 1.966 6.209 -1.799 1.00 . A A . 3 ILE CD1 1 1 20 10979 1 1 3 ILE CG1 C 2.692 6.834 -0.606 1.00 . A A . 3 ILE CG1 1 1 20 10980 1 1 3 ILE CG2 C 1.555 7.705 1.488 1.00 . A A . 3 ILE CG2 1 1 20 10981 1 1 3 ILE H H 2.140 3.636 1.603 1.00 . A A . 3 ILE H 1 1 20 10982 1 1 3 ILE HA H 3.929 5.907 1.413 1.00 . A A . 3 ILE HA 1 1 20 10983 1 1 3 ILE HB H 1.105 5.904 0.456 1.00 . A A . 3 ILE HB 1 1 20 10984 1 1 3 ILE HD11 H 2.298 6.689 -2.719 1.00 . A A . 3 ILE HD11 1 1 20 10985 1 1 3 ILE HD12 H 2.193 5.143 -1.843 1.00 . A A . 3 ILE HD12 1 1 20 10986 1 1 3 ILE HD13 H 0.891 6.347 -1.684 1.00 . A A . 3 ILE HD13 1 1 20 10987 1 1 3 ILE HG12 H 2.714 7.919 -0.718 1.00 . A A . 3 ILE HG12 1 1 20 10988 1 1 3 ILE HG13 H 3.728 6.495 -0.587 1.00 . A A . 3 ILE HG13 1 1 20 10989 1 1 3 ILE HG21 H 0.929 8.329 0.850 1.00 . A A . 3 ILE HG21 1 1 20 10990 1 1 3 ILE HG22 H 0.985 7.397 2.365 1.00 . A A . 3 ILE HG22 1 1 20 10991 1 1 3 ILE HG23 H 2.431 8.272 1.804 1.00 . A A . 3 ILE HG23 1 1 20 10992 1 1 3 ILE N N 2.820 4.194 1.126 1.00 . A A . 3 ILE N 1 1 20 10993 1 1 3 ILE O O 1.787 4.886 3.601 1.00 . A A . 3 ILE O 1 1 20 10994 1 1 4 TYR C C 2.560 8.195 5.425 1.00 . A A . 4 TYR C 1 1 20 10995 1 1 4 TYR CA C 3.071 6.787 5.158 1.00 . A A . 4 TYR CA 1 1 20 10996 1 1 4 TYR CB C 4.396 6.549 5.876 1.00 . A A . 4 TYR CB 1 1 20 10997 1 1 4 TYR CD1 C 4.342 4.307 7.029 1.00 . A A . 4 TYR CD1 1 1 20 10998 1 1 4 TYR CD2 C 5.588 4.525 4.961 1.00 . A A . 4 TYR CD2 1 1 20 10999 1 1 4 TYR CE1 C 4.701 2.956 7.103 1.00 . A A . 4 TYR CE1 1 1 20 11000 1 1 4 TYR CE2 C 5.948 3.173 5.035 1.00 . A A . 4 TYR CE2 1 1 20 11001 1 1 4 TYR CG C 4.785 5.091 5.957 1.00 . A A . 4 TYR CG 1 1 20 11002 1 1 4 TYR CZ C 5.503 2.390 6.107 1.00 . A A . 4 TYR CZ 1 1 20 11003 1 1 4 TYR H H 3.903 7.191 3.246 1.00 . A A . 4 TYR H 1 1 20 11004 1 1 4 TYR HA H 2.338 6.069 5.524 1.00 . A A . 4 TYR HA 1 1 20 11005 1 1 4 TYR HB2 H 5.182 7.089 5.348 1.00 . A A . 4 TYR HB2 1 1 20 11006 1 1 4 TYR HB3 H 4.321 6.945 6.889 1.00 . A A . 4 TYR HB3 1 1 20 11007 1 1 4 TYR HD1 H 3.722 4.745 7.798 1.00 . A A . 4 TYR HD1 1 1 20 11008 1 1 4 TYR HD2 H 5.931 5.130 4.134 1.00 . A A . 4 TYR HD2 1 1 20 11009 1 1 4 TYR HE1 H 4.359 2.352 7.931 1.00 . A A . 4 TYR HE1 1 1 20 11010 1 1 4 TYR HE2 H 6.567 2.736 4.266 1.00 . A A . 4 TYR HE2 1 1 20 11011 1 1 4 TYR HH H 6.713 0.891 5.791 1.00 . A A . 4 TYR HH 1 1 20 11012 1 1 4 TYR N N 3.253 6.591 3.734 1.00 . A A . 4 TYR N 1 1 20 11013 1 1 4 TYR O O 3.343 9.042 5.852 1.00 . A A . 4 TYR O 1 1 20 11014 1 1 4 TYR OH O 5.853 1.073 6.180 1.00 . A A . 4 TYR OH 1 1 20 11015 1 1 5 VAL C C 0.288 9.861 6.865 1.00 . A A . 5 VAL C 1 1 20 11016 1 1 5 VAL CA C 0.688 9.727 5.394 1.00 . A A . 5 VAL CA 1 1 20 11017 1 1 5 VAL CB C -0.483 9.942 4.434 1.00 . A A . 5 VAL CB 1 1 20 11018 1 1 5 VAL CG1 C -1.227 11.239 4.758 1.00 . A A . 5 VAL CG1 1 1 20 11019 1 1 5 VAL CG2 C -0.010 9.931 2.980 1.00 . A A . 5 VAL CG2 1 1 20 11020 1 1 5 VAL H H 0.647 7.724 4.826 1.00 . A A . 5 VAL H 1 1 20 11021 1 1 5 VAL HA H 1.450 10.473 5.169 1.00 . A A . 5 VAL HA 1 1 20 11022 1 1 5 VAL HB H -1.181 9.114 4.565 1.00 . A A . 5 VAL HB 1 1 20 11023 1 1 5 VAL HG11 H -1.566 11.214 5.794 1.00 . A A . 5 VAL HG11 1 1 20 11024 1 1 5 VAL HG12 H -0.558 12.088 4.615 1.00 . A A . 5 VAL HG12 1 1 20 11025 1 1 5 VAL HG13 H -2.088 11.339 4.097 1.00 . A A . 5 VAL HG13 1 1 20 11026 1 1 5 VAL HG21 H 1.071 10.068 2.949 1.00 . A A . 5 VAL HG21 1 1 20 11027 1 1 5 VAL HG22 H -0.268 8.976 2.520 1.00 . A A . 5 VAL HG22 1 1 20 11028 1 1 5 VAL HG23 H -0.495 10.740 2.433 1.00 . A A . 5 VAL HG23 1 1 20 11029 1 1 5 VAL N N 1.277 8.418 5.174 1.00 . A A . 5 VAL N 1 1 20 11030 1 1 5 VAL O O -0.585 9.138 7.343 1.00 . A A . 5 VAL O 1 1 20 11031 1 1 6 CYS C C -0.845 11.149 9.127 1.00 . A A . 6 CYS C 1 1 20 11032 1 1 6 CYS CA C 0.670 11.028 8.949 1.00 . A A . 6 CYS CA 1 1 20 11033 1 1 6 CYS CB C 1.407 12.264 9.468 1.00 . A A . 6 CYS CB 1 1 20 11034 1 1 6 CYS H H 1.655 11.374 7.145 1.00 . A A . 6 CYS H 1 1 20 11035 1 1 6 CYS HA H 1.056 10.166 9.493 1.00 . A A . 6 CYS HA 1 1 20 11036 1 1 6 CYS HB2 H 2.454 12.195 9.177 1.00 . A A . 6 CYS HB2 1 1 20 11037 1 1 6 CYS HB3 H 0.997 13.147 8.979 1.00 . A A . 6 CYS HB3 1 1 20 11038 1 1 6 CYS N N 0.946 10.790 7.542 1.00 . A A . 6 CYS N 1 1 20 11039 1 1 6 CYS O O -1.549 11.580 8.215 1.00 . A A . 6 CYS O 1 1 20 11040 1 1 6 CYS SG S 1.318 12.505 11.281 1.00 . A A . 6 CYS SG 1 1 20 11041 1 1 7 THR C C -3.000 11.935 11.628 1.00 . A A . 7 THR C 1 1 20 11042 1 1 7 THR CA C -2.721 10.821 10.618 1.00 . A A . 7 THR CA 1 1 20 11043 1 1 7 THR CB C -3.157 9.437 11.103 1.00 . A A . 7 THR CB 1 1 20 11044 1 1 7 THR CG2 C -2.986 8.359 10.031 1.00 . A A . 7 THR CG2 1 1 20 11045 1 1 7 THR H H -0.723 10.411 11.044 1.00 . A A . 7 THR H 1 1 20 11046 1 1 7 THR HA H -3.261 11.073 9.705 1.00 . A A . 7 THR HA 1 1 20 11047 1 1 7 THR HB H -4.183 9.460 11.473 1.00 . A A . 7 THR HB 1 1 20 11048 1 1 7 THR HG1 H -2.270 9.717 12.876 1.00 . A A . 7 THR HG1 1 1 20 11049 1 1 7 THR HG21 H -3.382 8.724 9.083 1.00 . A A . 7 THR HG21 1 1 20 11050 1 1 7 THR HG22 H -1.928 8.124 9.918 1.00 . A A . 7 THR HG22 1 1 20 11051 1 1 7 THR HG23 H -3.527 7.461 10.330 1.00 . A A . 7 THR HG23 1 1 20 11052 1 1 7 THR N N -1.302 10.761 10.308 1.00 . A A . 7 THR N 1 1 20 11053 1 1 7 THR O O -4.041 11.938 12.283 1.00 . A A . 7 THR O 1 1 20 11054 1 1 7 THR OG1 O -2.192 9.097 12.095 1.00 . A A . 7 THR OG1 1 1 20 11055 1 1 8 VAL C C -2.263 15.277 11.844 1.00 . A A . 8 VAL C 1 1 20 11056 1 1 8 VAL CA C -2.182 13.974 12.641 1.00 . A A . 8 VAL CA 1 1 20 11057 1 1 8 VAL CB C -1.030 13.960 13.648 1.00 . A A . 8 VAL CB 1 1 20 11058 1 1 8 VAL CG1 C -0.859 15.332 14.304 1.00 . A A . 8 VAL CG1 1 1 20 11059 1 1 8 VAL CG2 C -1.235 12.870 14.701 1.00 . A A . 8 VAL CG2 1 1 20 11060 1 1 8 VAL H H -1.207 12.846 11.185 1.00 . A A . 8 VAL H 1 1 20 11061 1 1 8 VAL HA H -3.113 13.839 13.191 1.00 . A A . 8 VAL HA 1 1 20 11062 1 1 8 VAL HB H -0.113 13.733 13.105 1.00 . A A . 8 VAL HB 1 1 20 11063 1 1 8 VAL HG11 H -0.475 15.205 15.316 1.00 . A A . 8 VAL HG11 1 1 20 11064 1 1 8 VAL HG12 H -0.158 15.929 13.721 1.00 . A A . 8 VAL HG12 1 1 20 11065 1 1 8 VAL HG13 H -1.823 15.839 14.342 1.00 . A A . 8 VAL HG13 1 1 20 11066 1 1 8 VAL HG21 H -0.688 13.133 15.608 1.00 . A A . 8 VAL HG21 1 1 20 11067 1 1 8 VAL HG22 H -2.297 12.782 14.931 1.00 . A A . 8 VAL HG22 1 1 20 11068 1 1 8 VAL HG23 H -0.867 11.919 14.317 1.00 . A A . 8 VAL HG23 1 1 20 11069 1 1 8 VAL N N -2.051 12.856 11.721 1.00 . A A . 8 VAL N 1 1 20 11070 1 1 8 VAL O O -3.193 16.062 12.025 1.00 . A A . 8 VAL O 1 1 20 11071 1 1 9 CYS C C -1.546 16.262 8.710 1.00 . A A . 9 CYS C 1 1 20 11072 1 1 9 CYS CA C -1.229 16.662 10.152 1.00 . A A . 9 CYS CA 1 1 20 11073 1 1 9 CYS CB C 0.122 17.370 10.265 1.00 . A A . 9 CYS CB 1 1 20 11074 1 1 9 CYS H H -0.528 14.823 10.836 1.00 . A A . 9 CYS H 1 1 20 11075 1 1 9 CYS HA H -1.986 17.342 10.540 1.00 . A A . 9 CYS HA 1 1 20 11076 1 1 9 CYS HB2 H 0.212 18.084 9.446 1.00 . A A . 9 CYS HB2 1 1 20 11077 1 1 9 CYS HB3 H 0.140 17.943 11.191 1.00 . A A . 9 CYS HB3 1 1 20 11078 1 1 9 CYS N N -1.280 15.467 10.978 1.00 . A A . 9 CYS N 1 1 20 11079 1 1 9 CYS O O -1.958 17.098 7.907 1.00 . A A . 9 CYS O 1 1 20 11080 1 1 9 CYS SG S 1.576 16.259 10.236 1.00 . A A . 9 CYS SG 1 1 20 11081 1 1 10 GLY C C -0.325 14.462 6.248 1.00 . A A . 10 GLY C 1 1 20 11082 1 1 10 GLY CA C -1.601 14.464 7.092 1.00 . A A . 10 GLY CA 1 1 20 11083 1 1 10 GLY H H -1.007 14.311 9.083 1.00 . A A . 10 GLY H 1 1 20 11084 1 1 10 GLY HA2 H -1.995 13.451 7.164 1.00 . A A . 10 GLY HA2 1 1 20 11085 1 1 10 GLY HA3 H -2.364 15.070 6.604 1.00 . A A . 10 GLY HA3 1 1 20 11086 1 1 10 GLY N N -1.342 14.984 8.424 1.00 . A A . 10 GLY N 1 1 20 11087 1 1 10 GLY O O -0.343 14.241 5.038 1.00 . A A . 10 GLY O 1 1 20 11088 1 1 11 TYR C C 2.180 13.633 5.239 1.00 . A A . 11 TYR C 1 1 20 11089 1 1 11 TYR CA C 2.090 14.754 6.265 1.00 . A A . 11 TYR CA 1 1 20 11090 1 1 11 TYR CB C 3.194 14.621 7.310 1.00 . A A . 11 TYR CB 1 1 20 11091 1 1 11 TYR CD1 C 4.836 15.888 5.876 1.00 . A A . 11 TYR CD1 1 1 20 11092 1 1 11 TYR CD2 C 5.614 13.947 7.105 1.00 . A A . 11 TYR CD2 1 1 20 11093 1 1 11 TYR CE1 C 6.123 16.075 5.357 1.00 . A A . 11 TYR CE1 1 1 20 11094 1 1 11 TYR CE2 C 6.900 14.135 6.586 1.00 . A A . 11 TYR CE2 1 1 20 11095 1 1 11 TYR CG C 4.582 14.824 6.750 1.00 . A A . 11 TYR CG 1 1 20 11096 1 1 11 TYR CZ C 7.155 15.198 5.712 1.00 . A A . 11 TYR CZ 1 1 20 11097 1 1 11 TYR H H 0.760 14.894 7.915 1.00 . A A . 11 TYR H 1 1 20 11098 1 1 11 TYR HA H 2.201 15.710 5.753 1.00 . A A . 11 TYR HA 1 1 20 11099 1 1 11 TYR HB2 H 3.024 15.361 8.093 1.00 . A A . 11 TYR HB2 1 1 20 11100 1 1 11 TYR HB3 H 3.138 13.626 7.751 1.00 . A A . 11 TYR HB3 1 1 20 11101 1 1 11 TYR HD1 H 4.039 16.564 5.603 1.00 . A A . 11 TYR HD1 1 1 20 11102 1 1 11 TYR HD2 H 5.418 13.127 7.780 1.00 . A A . 11 TYR HD2 1 1 20 11103 1 1 11 TYR HE1 H 6.318 16.896 4.683 1.00 . A A . 11 TYR HE1 1 1 20 11104 1 1 11 TYR HE2 H 7.697 13.458 6.860 1.00 . A A . 11 TYR HE2 1 1 20 11105 1 1 11 TYR HH H 8.729 16.279 5.313 1.00 . A A . 11 TYR HH 1 1 20 11106 1 1 11 TYR N N 0.799 14.718 6.921 1.00 . A A . 11 TYR N 1 1 20 11107 1 1 11 TYR O O 1.433 12.662 5.353 1.00 . A A . 11 TYR O 1 1 20 11108 1 1 11 TYR OH O 8.409 15.380 5.206 1.00 . A A . 11 TYR OH 1 1 20 11109 1 1 12 GLU C C 4.706 12.333 3.163 1.00 . A A . 12 GLU C 1 1 20 11110 1 1 12 GLU CA C 3.242 12.771 3.245 1.00 . A A . 12 GLU CA 1 1 20 11111 1 1 12 GLU CB C 2.745 13.278 1.890 1.00 . A A . 12 GLU CB 1 1 20 11112 1 1 12 GLU CD C 1.154 12.405 0.140 1.00 . A A . 12 GLU CD 1 1 20 11113 1 1 12 GLU CG C 1.321 12.792 1.610 1.00 . A A . 12 GLU CG 1 1 20 11114 1 1 12 GLU H H 3.679 14.575 4.189 1.00 . A A . 12 GLU H 1 1 20 11115 1 1 12 GLU HA H 2.622 11.931 3.562 1.00 . A A . 12 GLU HA 1 1 20 11116 1 1 12 GLU HB2 H 2.770 14.368 1.875 1.00 . A A . 12 GLU HB2 1 1 20 11117 1 1 12 GLU HB3 H 3.413 12.933 1.101 1.00 . A A . 12 GLU HB3 1 1 20 11118 1 1 12 GLU HE2 H -0.015 13.324 -1.016 1.00 . A A . 12 GLU HE2 1 1 20 11119 1 1 12 GLU HG2 H 1.095 11.934 2.245 1.00 . A A . 12 GLU HG2 1 1 20 11120 1 1 12 GLU HG3 H 0.608 13.575 1.868 1.00 . A A . 12 GLU HG3 1 1 20 11121 1 1 12 GLU N N 3.076 13.782 4.275 1.00 . A A . 12 GLU N 1 1 20 11122 1 1 12 GLU O O 5.620 13.138 3.002 1.00 . A A . 12 GLU O 1 1 20 11123 1 1 12 GLU OE1 O 1.246 11.217 -0.202 1.00 . A A . 12 GLU OE1 1 1 20 11124 1 1 12 GLU OE2 O 0.917 13.390 -0.659 1.00 . A A . 12 GLU OE2 1 1 20 11125 1 1 13 TYR C C 6.477 9.825 1.855 1.00 . A A . 13 TYR C 1 1 20 11126 1 1 13 TYR CA C 6.239 10.444 3.224 1.00 . A A . 13 TYR CA 1 1 20 11127 1 1 13 TYR CB C 6.384 9.397 4.325 1.00 . A A . 13 TYR CB 1 1 20 11128 1 1 13 TYR CD1 C 8.880 9.529 4.650 1.00 . A A . 13 TYR CD1 1 1 20 11129 1 1 13 TYR CD2 C 7.884 7.382 4.122 1.00 . A A . 13 TYR CD2 1 1 20 11130 1 1 13 TYR CE1 C 10.147 8.932 4.689 1.00 . A A . 13 TYR CE1 1 1 20 11131 1 1 13 TYR CE2 C 9.150 6.784 4.162 1.00 . A A . 13 TYR CE2 1 1 20 11132 1 1 13 TYR CG C 7.749 8.753 4.367 1.00 . A A . 13 TYR CG 1 1 20 11133 1 1 13 TYR CZ C 10.282 7.560 4.445 1.00 . A A . 13 TYR CZ 1 1 20 11134 1 1 13 TYR H H 4.123 10.398 3.411 1.00 . A A . 13 TYR H 1 1 20 11135 1 1 13 TYR HA H 6.972 11.234 3.388 1.00 . A A . 13 TYR HA 1 1 20 11136 1 1 13 TYR HB2 H 6.194 9.874 5.286 1.00 . A A . 13 TYR HB2 1 1 20 11137 1 1 13 TYR HB3 H 5.638 8.618 4.167 1.00 . A A . 13 TYR HB3 1 1 20 11138 1 1 13 TYR HD1 H 8.776 10.586 4.838 1.00 . A A . 13 TYR HD1 1 1 20 11139 1 1 13 TYR HD2 H 7.011 6.783 3.904 1.00 . A A . 13 TYR HD2 1 1 20 11140 1 1 13 TYR HE1 H 11.019 9.530 4.908 1.00 . A A . 13 TYR HE1 1 1 20 11141 1 1 13 TYR HE2 H 9.255 5.726 3.973 1.00 . A A . 13 TYR HE2 1 1 20 11142 1 1 13 TYR HH H 11.762 6.682 5.360 1.00 . A A . 13 TYR HH 1 1 20 11143 1 1 13 TYR N N 4.909 11.019 3.279 1.00 . A A . 13 TYR N 1 1 20 11144 1 1 13 TYR O O 5.508 9.550 1.150 1.00 . A A . 13 TYR O 1 1 20 11145 1 1 13 TYR OH O 11.515 6.978 4.482 1.00 . A A . 13 TYR OH 1 1 20 11146 1 1 14 ASP C C 9.133 7.944 0.425 1.00 . A A . 14 ASP C 1 1 20 11147 1 1 14 ASP CA C 8.077 9.032 0.223 1.00 . A A . 14 ASP CA 1 1 20 11148 1 1 14 ASP CB C 8.655 10.083 -0.728 1.00 . A A . 14 ASP CB 1 1 20 11149 1 1 14 ASP CG C 8.488 9.770 -2.216 1.00 . A A . 14 ASP CG 1 1 20 11150 1 1 14 ASP H H 8.522 9.845 2.088 1.00 . A A . 14 ASP H 1 1 20 11151 1 1 14 ASP HA H 7.139 8.635 -0.165 1.00 . A A . 14 ASP HA 1 1 20 11152 1 1 14 ASP HB2 H 8.181 11.041 -0.517 1.00 . A A . 14 ASP HB2 1 1 20 11153 1 1 14 ASP HB3 H 9.717 10.199 -0.513 1.00 . A A . 14 ASP HB3 1 1 20 11154 1 1 14 ASP HD2 H 9.399 9.894 -3.858 1.00 . A A . 14 ASP HD2 1 1 20 11155 1 1 14 ASP N N 7.739 9.618 1.509 1.00 . A A . 14 ASP N 1 1 20 11156 1 1 14 ASP O O 10.336 8.177 0.331 1.00 . A A . 14 ASP O 1 1 20 11157 1 1 14 ASP OD1 O 7.365 9.577 -2.705 1.00 . A A . 14 ASP OD1 1 1 20 11158 1 1 14 ASP OD2 O 9.587 9.728 -2.891 1.00 . A A . 14 ASP OD2 1 1 20 11159 1 1 15 PRO C C 10.705 5.623 0.055 1.00 . A A . 15 PRO C 1 1 20 11160 1 1 15 PRO CA C 9.466 5.560 0.937 1.00 . A A . 15 PRO CA 1 1 20 11161 1 1 15 PRO CB C 8.576 4.382 0.549 1.00 . A A . 15 PRO CB 1 1 20 11162 1 1 15 PRO CD C 7.241 6.424 0.829 1.00 . A A . 15 PRO CD 1 1 20 11163 1 1 15 PRO CG C 7.187 4.917 1.073 1.00 . A A . 15 PRO CG 1 1 20 11164 1 1 15 PRO HA H 9.761 5.486 1.984 1.00 . A A . 15 PRO HA 1 1 20 11165 1 1 15 PRO HB2 H 8.605 4.176 -0.521 1.00 . A A . 15 PRO HB2 1 1 20 11166 1 1 15 PRO HB3 H 8.878 3.503 1.120 1.00 . A A . 15 PRO HB3 1 1 20 11167 1 1 15 PRO HD2 H 6.694 6.690 -0.076 1.00 . A A . 15 PRO HD2 1 1 20 11168 1 1 15 PRO HD3 H 6.831 6.953 1.689 1.00 . A A . 15 PRO HD3 1 1 20 11169 1 1 15 PRO HG2 H 6.501 4.462 0.358 1.00 . A A . 15 PRO HG2 1 1 20 11170 1 1 15 PRO HG3 H 6.898 4.673 2.095 1.00 . A A . 15 PRO HG3 1 1 20 11171 1 1 15 PRO N N 8.649 6.733 0.709 1.00 . A A . 15 PRO N 1 1 20 11172 1 1 15 PRO O O 10.640 5.181 -1.091 1.00 . A A . 15 PRO O 1 1 20 11173 1 1 16 ALA C C 14.082 6.974 0.687 1.00 . A A . 16 ALA C 1 1 20 11174 1 1 16 ALA CA C 13.025 6.268 -0.165 1.00 . A A . 16 ALA CA 1 1 20 11175 1 1 16 ALA CB C 12.755 6.999 -1.482 1.00 . A A . 16 ALA CB 1 1 20 11176 1 1 16 ALA H H 11.835 6.516 1.525 1.00 . A A . 16 ALA H 1 1 20 11177 1 1 16 ALA HA H 13.367 5.257 -0.389 1.00 . A A . 16 ALA HA 1 1 20 11178 1 1 16 ALA HB1 H 12.178 6.354 -2.144 1.00 . A A . 16 ALA HB1 1 1 20 11179 1 1 16 ALA HB2 H 12.190 7.910 -1.281 1.00 . A A . 16 ALA HB2 1 1 20 11180 1 1 16 ALA HB3 H 13.702 7.256 -1.956 1.00 . A A . 16 ALA HB3 1 1 20 11181 1 1 16 ALA N N 11.790 6.160 0.593 1.00 . A A . 16 ALA N 1 1 20 11182 1 1 16 ALA O O 14.413 8.133 0.438 1.00 . A A . 16 ALA O 1 1 20 11183 1 1 17 PHE C C 16.755 5.807 2.738 1.00 . A A . 17 PHE C 1 1 20 11184 1 1 17 PHE CA C 15.594 6.788 2.566 1.00 . A A . 17 PHE CA 1 1 20 11185 1 1 17 PHE CB C 14.923 7.010 3.922 1.00 . A A . 17 PHE CB 1 1 20 11186 1 1 17 PHE CD1 C 15.960 9.284 4.069 1.00 . A A . 17 PHE CD1 1 1 20 11187 1 1 17 PHE CD2 C 13.875 8.948 5.112 1.00 . A A . 17 PHE CD2 1 1 20 11188 1 1 17 PHE CE1 C 15.957 10.638 4.497 1.00 . A A . 17 PHE CE1 1 1 20 11189 1 1 17 PHE CE2 C 13.871 10.302 5.540 1.00 . A A . 17 PHE CE2 1 1 20 11190 1 1 17 PHE CG C 14.919 8.468 4.385 1.00 . A A . 17 PHE CG 1 1 20 11191 1 1 17 PHE CZ C 14.912 11.118 5.223 1.00 . A A . 17 PHE CZ 1 1 20 11192 1 1 17 PHE H H 14.307 5.304 1.871 1.00 . A A . 17 PHE H 1 1 20 11193 1 1 17 PHE HA H 15.963 7.708 2.115 1.00 . A A . 17 PHE HA 1 1 20 11194 1 1 17 PHE HB2 H 13.894 6.653 3.871 1.00 . A A . 17 PHE HB2 1 1 20 11195 1 1 17 PHE HB3 H 15.433 6.404 4.672 1.00 . A A . 17 PHE HB3 1 1 20 11196 1 1 17 PHE HD1 H 16.797 8.899 3.486 1.00 . A A . 17 PHE HD1 1 1 20 11197 1 1 17 PHE HD2 H 13.040 8.295 5.365 1.00 . A A . 17 PHE HD2 1 1 20 11198 1 1 17 PHE HE1 H 16.791 11.292 4.244 1.00 . A A . 17 PHE HE1 1 1 20 11199 1 1 17 PHE HE2 H 13.034 10.687 6.122 1.00 . A A . 17 PHE HE2 1 1 20 11200 1 1 17 PHE HZ H 14.910 12.158 5.553 1.00 . A A . 17 PHE HZ 1 1 20 11201 1 1 17 PHE N N 14.582 6.246 1.675 1.00 . A A . 17 PHE N 1 1 20 11202 1 1 17 PHE O O 16.795 4.766 2.083 1.00 . A A . 17 PHE O 1 1 20 11203 1 1 18 GLU C C 19.242 5.456 5.359 1.00 . A A . 18 GLU C 1 1 20 11204 1 1 18 GLU CA C 18.829 5.337 3.890 1.00 . A A . 18 GLU CA 1 1 20 11205 1 1 18 GLU CB C 19.991 5.699 2.962 1.00 . A A . 18 GLU CB 1 1 20 11206 1 1 18 GLU CD C 19.730 3.791 1.334 1.00 . A A . 18 GLU CD 1 1 20 11207 1 1 18 GLU CG C 20.639 4.442 2.379 1.00 . A A . 18 GLU CG 1 1 20 11208 1 1 18 GLU H H 17.630 7.020 4.152 1.00 . A A . 18 GLU H 1 1 20 11209 1 1 18 GLU HA H 18.507 4.318 3.678 1.00 . A A . 18 GLU HA 1 1 20 11210 1 1 18 GLU HB2 H 19.631 6.337 2.154 1.00 . A A . 18 GLU HB2 1 1 20 11211 1 1 18 GLU HB3 H 20.735 6.274 3.514 1.00 . A A . 18 GLU HB3 1 1 20 11212 1 1 18 GLU HE2 H 20.325 3.787 -0.452 1.00 . A A . 18 GLU HE2 1 1 20 11213 1 1 18 GLU HG2 H 21.595 4.700 1.923 1.00 . A A . 18 GLU HG2 1 1 20 11214 1 1 18 GLU HG3 H 20.847 3.732 3.179 1.00 . A A . 18 GLU HG3 1 1 20 11215 1 1 18 GLU N N 17.671 6.173 3.624 1.00 . A A . 18 GLU N 1 1 20 11216 1 1 18 GLU O O 20.381 5.809 5.661 1.00 . A A . 18 GLU O 1 1 20 11217 1 1 18 GLU OE1 O 19.031 2.814 1.644 1.00 . A A . 18 GLU OE1 1 1 20 11218 1 1 18 GLU OE2 O 19.763 4.337 0.166 1.00 . A A . 18 GLU OE2 1 1 20 11219 1 1 19 ASP C C 17.262 4.866 8.418 1.00 . A A . 19 ASP C 1 1 20 11220 1 1 19 ASP CA C 18.545 5.222 7.662 1.00 . A A . 19 ASP CA 1 1 20 11221 1 1 19 ASP CB C 18.964 6.632 8.082 1.00 . A A . 19 ASP CB 1 1 20 11222 1 1 19 ASP CG C 19.382 6.774 9.546 1.00 . A A . 19 ASP CG 1 1 20 11223 1 1 19 ASP H H 17.370 4.867 5.979 1.00 . A A . 19 ASP H 1 1 20 11224 1 1 19 ASP HA H 19.349 4.510 7.846 1.00 . A A . 19 ASP HA 1 1 20 11225 1 1 19 ASP HB2 H 19.794 6.950 7.450 1.00 . A A . 19 ASP HB2 1 1 20 11226 1 1 19 ASP HB3 H 18.137 7.314 7.888 1.00 . A A . 19 ASP HB3 1 1 20 11227 1 1 19 ASP HD2 H 20.651 8.133 9.250 1.00 . A A . 19 ASP HD2 1 1 20 11228 1 1 19 ASP N N 18.293 5.154 6.233 1.00 . A A . 19 ASP N 1 1 20 11229 1 1 19 ASP O O 17.196 3.833 9.082 1.00 . A A . 19 ASP O 1 1 20 11230 1 1 19 ASP OD1 O 18.619 6.436 10.464 1.00 . A A . 19 ASP OD1 1 1 20 11231 1 1 19 ASP OD2 O 20.562 7.262 9.732 1.00 . A A . 19 ASP OD2 1 1 20 11232 1 1 20 LEU C C 15.243 4.928 10.339 1.00 . A A . 20 LEU C 1 1 20 11233 1 1 20 LEU CA C 15.001 5.533 8.954 1.00 . A A . 20 LEU CA 1 1 20 11234 1 1 20 LEU CB C 14.068 4.699 8.073 1.00 . A A . 20 LEU CB 1 1 20 11235 1 1 20 LEU CD1 C 11.605 4.201 8.284 1.00 . A A . 20 LEU CD1 1 1 20 11236 1 1 20 LEU CD2 C 13.318 2.383 8.730 1.00 . A A . 20 LEU CD2 1 1 20 11237 1 1 20 LEU CG C 13.007 3.879 8.808 1.00 . A A . 20 LEU CG 1 1 20 11238 1 1 20 LEU H H 16.339 6.580 7.750 1.00 . A A . 20 LEU H 1 1 20 11239 1 1 20 LEU HA H 14.535 6.511 9.082 1.00 . A A . 20 LEU HA 1 1 20 11240 1 1 20 LEU HB2 H 13.565 5.369 7.376 1.00 . A A . 20 LEU HB2 1 1 20 11241 1 1 20 LEU HB3 H 14.678 4.018 7.478 1.00 . A A . 20 LEU HB3 1 1 20 11242 1 1 20 LEU HD11 H 11.582 5.227 7.916 1.00 . A A . 20 LEU HD11 1 1 20 11243 1 1 20 LEU HD12 H 11.355 3.519 7.472 1.00 . A A . 20 LEU HD12 1 1 20 11244 1 1 20 LEU HD13 H 10.881 4.088 9.090 1.00 . A A . 20 LEU HD13 1 1 20 11245 1 1 20 LEU HD21 H 13.016 1.900 9.660 1.00 . A A . 20 LEU HD21 1 1 20 11246 1 1 20 LEU HD22 H 12.771 1.941 7.897 1.00 . A A . 20 LEU HD22 1 1 20 11247 1 1 20 LEU HD23 H 14.388 2.242 8.579 1.00 . A A . 20 LEU HD23 1 1 20 11248 1 1 20 LEU HG H 13.027 4.158 9.862 1.00 . A A . 20 LEU HG 1 1 20 11249 1 1 20 LEU N N 16.276 5.743 8.293 1.00 . A A . 20 LEU N 1 1 20 11250 1 1 20 LEU O O 15.132 3.723 10.552 1.00 . A A . 20 LEU O 1 1 20 11251 1 1 21 PRO C C 14.614 4.824 13.285 1.00 . A A . 21 PRO C 1 1 20 11252 1 1 21 PRO CA C 15.853 5.452 12.665 1.00 . A A . 21 PRO CA 1 1 20 11253 1 1 21 PRO CB C 16.196 6.776 13.346 1.00 . A A . 21 PRO CB 1 1 20 11254 1 1 21 PRO CD C 15.720 7.229 11.071 1.00 . A A . 21 PRO CD 1 1 20 11255 1 1 21 PRO CG C 16.563 7.725 12.243 1.00 . A A . 21 PRO CG 1 1 20 11256 1 1 21 PRO HA H 16.693 4.762 12.733 1.00 . A A . 21 PRO HA 1 1 20 11257 1 1 21 PRO HB2 H 15.361 7.173 13.922 1.00 . A A . 21 PRO HB2 1 1 20 11258 1 1 21 PRO HB3 H 17.072 6.635 13.981 1.00 . A A . 21 PRO HB3 1 1 20 11259 1 1 21 PRO HD2 H 14.750 7.727 11.051 1.00 . A A . 21 PRO HD2 1 1 20 11260 1 1 21 PRO HD3 H 16.252 7.397 10.135 1.00 . A A . 21 PRO HD3 1 1 20 11261 1 1 21 PRO HG2 H 16.315 8.766 12.449 1.00 . A A . 21 PRO HG2 1 1 20 11262 1 1 21 PRO HG3 H 17.632 7.613 12.061 1.00 . A A . 21 PRO HG3 1 1 20 11263 1 1 21 PRO N N 15.580 5.805 11.287 1.00 . A A . 21 PRO N 1 1 20 11264 1 1 21 PRO O O 13.584 4.757 12.616 1.00 . A A . 21 PRO O 1 1 20 11265 1 1 22 ASP C C 12.951 4.792 16.134 1.00 . A A . 22 ASP C 1 1 20 11266 1 1 22 ASP CA C 13.609 3.764 15.213 1.00 . A A . 22 ASP CA 1 1 20 11267 1 1 22 ASP CB C 14.070 2.584 16.072 1.00 . A A . 22 ASP CB 1 1 20 11268 1 1 22 ASP CG C 15.398 2.795 16.801 1.00 . A A . 22 ASP CG 1 1 20 11269 1 1 22 ASP H H 15.574 4.440 15.065 1.00 . A A . 22 ASP H 1 1 20 11270 1 1 22 ASP HA H 12.942 3.426 14.421 1.00 . A A . 22 ASP HA 1 1 20 11271 1 1 22 ASP HB2 H 13.297 2.369 16.811 1.00 . A A . 22 ASP HB2 1 1 20 11272 1 1 22 ASP HB3 H 14.157 1.703 15.437 1.00 . A A . 22 ASP HB3 1 1 20 11273 1 1 22 ASP HD2 H 15.735 1.048 17.418 1.00 . A A . 22 ASP HD2 1 1 20 11274 1 1 22 ASP N N 14.732 4.382 14.529 1.00 . A A . 22 ASP N 1 1 20 11275 1 1 22 ASP O O 12.554 4.465 17.252 1.00 . A A . 22 ASP O 1 1 20 11276 1 1 22 ASP OD1 O 15.690 3.896 17.292 1.00 . A A . 22 ASP OD1 1 1 20 11277 1 1 22 ASP OD2 O 16.161 1.756 16.855 1.00 . A A . 22 ASP OD2 1 1 20 11278 1 1 23 ASP C C 12.090 8.320 15.498 1.00 . A A . 23 ASP C 1 1 20 11279 1 1 23 ASP CA C 12.252 7.093 16.397 1.00 . A A . 23 ASP CA 1 1 20 11280 1 1 23 ASP CB C 13.134 7.488 17.583 1.00 . A A . 23 ASP CB 1 1 20 11281 1 1 23 ASP CG C 12.424 8.286 18.680 1.00 . A A . 23 ASP CG 1 1 20 11282 1 1 23 ASP H H 13.181 6.273 14.723 1.00 . A A . 23 ASP H 1 1 20 11283 1 1 23 ASP HA H 11.295 6.699 16.742 1.00 . A A . 23 ASP HA 1 1 20 11284 1 1 23 ASP HB2 H 13.550 6.582 18.025 1.00 . A A . 23 ASP HB2 1 1 20 11285 1 1 23 ASP HB3 H 13.974 8.075 17.212 1.00 . A A . 23 ASP HB3 1 1 20 11286 1 1 23 ASP HD2 H 12.560 8.752 20.499 1.00 . A A . 23 ASP HD2 1 1 20 11287 1 1 23 ASP N N 12.856 6.015 15.633 1.00 . A A . 23 ASP N 1 1 20 11288 1 1 23 ASP O O 12.511 9.419 15.860 1.00 . A A . 23 ASP O 1 1 20 11289 1 1 23 ASP OD1 O 11.241 8.633 18.552 1.00 . A A . 23 ASP OD1 1 1 20 11290 1 1 23 ASP OD2 O 13.147 8.552 19.713 1.00 . A A . 23 ASP OD2 1 1 20 11291 1 1 24 TRP C C 10.033 9.963 13.854 1.00 . A A . 24 TRP C 1 1 20 11292 1 1 24 TRP CA C 11.255 9.168 13.392 1.00 . A A . 24 TRP CA 1 1 20 11293 1 1 24 TRP CB C 11.110 8.619 11.971 1.00 . A A . 24 TRP CB 1 1 20 11294 1 1 24 TRP CD1 C 12.229 10.559 10.689 1.00 . A A . 24 TRP CD1 1 1 20 11295 1 1 24 TRP CD2 C 10.283 9.945 9.825 1.00 . A A . 24 TRP CD2 1 1 20 11296 1 1 24 TRP CE2 C 10.769 10.980 9.053 1.00 . A A . 24 TRP CE2 1 1 20 11297 1 1 24 TRP CE3 C 9.053 9.330 9.534 1.00 . A A . 24 TRP CE3 1 1 20 11298 1 1 24 TRP CG C 11.233 9.682 10.878 1.00 . A A . 24 TRP CG 1 1 20 11299 1 1 24 TRP CH2 C 8.863 10.894 7.631 1.00 . A A . 24 TRP CH2 1 1 20 11300 1 1 24 TRP CZ2 C 10.091 11.491 7.940 1.00 . A A . 24 TRP CZ2 1 1 20 11301 1 1 24 TRP CZ3 C 8.387 9.852 8.418 1.00 . A A . 24 TRP CZ3 1 1 20 11302 1 1 24 TRP H H 11.139 7.197 14.059 1.00 . A A . 24 TRP H 1 1 20 11303 1 1 24 TRP HA H 12.139 9.806 13.398 1.00 . A A . 24 TRP HA 1 1 20 11304 1 1 24 TRP HB2 H 11.870 7.855 11.809 1.00 . A A . 24 TRP HB2 1 1 20 11305 1 1 24 TRP HB3 H 10.141 8.129 11.880 1.00 . A A . 24 TRP HB3 1 1 20 11306 1 1 24 TRP HD1 H 13.115 10.627 11.319 1.00 . A A . 24 TRP HD1 1 1 20 11307 1 1 24 TRP HE1 H 12.640 12.159 9.224 1.00 . A A . 24 TRP HE1 1 1 20 11308 1 1 24 TRP HE3 H 8.647 8.512 10.128 1.00 . A A . 24 TRP HE3 1 1 20 11309 1 1 24 TRP HH2 H 8.284 11.243 6.776 1.00 . A A . 24 TRP HH2 1 1 20 11310 1 1 24 TRP HZ2 H 10.497 12.310 7.345 1.00 . A A . 24 TRP HZ2 1 1 20 11311 1 1 24 TRP HZ3 H 7.428 9.411 8.148 1.00 . A A . 24 TRP HZ3 1 1 20 11312 1 1 24 TRP N N 11.478 8.093 14.345 1.00 . A A . 24 TRP N 1 1 20 11313 1 1 24 TRP NE1 N 11.991 11.365 9.595 1.00 . A A . 24 TRP NE1 1 1 20 11314 1 1 24 TRP O O 9.072 9.390 14.364 1.00 . A A . 24 TRP O 1 1 20 11315 1 1 25 ALA C C 8.638 13.039 12.864 1.00 . A A . 25 ALA C 1 1 20 11316 1 1 25 ALA CA C 9.021 12.152 14.049 1.00 . A A . 25 ALA CA 1 1 20 11317 1 1 25 ALA CB C 9.437 12.965 15.277 1.00 . A A . 25 ALA CB 1 1 20 11318 1 1 25 ALA H H 10.895 11.729 13.244 1.00 . A A . 25 ALA H 1 1 20 11319 1 1 25 ALA HA H 8.169 11.526 14.316 1.00 . A A . 25 ALA HA 1 1 20 11320 1 1 25 ALA HB1 H 9.248 12.385 16.179 1.00 . A A . 25 ALA HB1 1 1 20 11321 1 1 25 ALA HB2 H 10.500 13.201 15.213 1.00 . A A . 25 ALA HB2 1 1 20 11322 1 1 25 ALA HB3 H 8.861 13.890 15.312 1.00 . A A . 25 ALA HB3 1 1 20 11323 1 1 25 ALA N N 10.110 11.272 13.659 1.00 . A A . 25 ALA N 1 1 20 11324 1 1 25 ALA O O 9.509 13.542 12.153 1.00 . A A . 25 ALA O 1 1 20 11325 1 1 26 CYS C C 7.504 15.393 11.671 1.00 . A A . 26 CYS C 1 1 20 11326 1 1 26 CYS CA C 6.828 14.022 11.597 1.00 . A A . 26 CYS CA 1 1 20 11327 1 1 26 CYS CB C 5.303 14.136 11.640 1.00 . A A . 26 CYS CB 1 1 20 11328 1 1 26 CYS H H 6.635 12.793 13.267 1.00 . A A . 26 CYS H 1 1 20 11329 1 1 26 CYS HA H 7.091 13.512 10.672 1.00 . A A . 26 CYS HA 1 1 20 11330 1 1 26 CYS HB2 H 4.897 13.230 12.092 1.00 . A A . 26 CYS HB2 1 1 20 11331 1 1 26 CYS HB3 H 5.031 14.966 12.292 1.00 . A A . 26 CYS HB3 1 1 20 11332 1 1 26 CYS N N 7.336 13.205 12.686 1.00 . A A . 26 CYS N 1 1 20 11333 1 1 26 CYS O O 7.597 16.019 12.725 1.00 . A A . 26 CYS O 1 1 20 11334 1 1 26 CYS SG S 4.507 14.386 10.011 1.00 . A A . 26 CYS SG 1 1 20 11335 1 1 27 PRO C C 7.650 18.255 10.510 1.00 . A A . 27 PRO C 1 1 20 11336 1 1 27 PRO CA C 8.653 17.121 10.349 1.00 . A A . 27 PRO CA 1 1 20 11337 1 1 27 PRO CB C 9.218 17.088 8.930 1.00 . A A . 27 PRO CB 1 1 20 11338 1 1 27 PRO CD C 7.888 15.141 9.253 1.00 . A A . 27 PRO CD 1 1 20 11339 1 1 27 PRO CG C 8.207 16.185 8.186 1.00 . A A . 27 PRO CG 1 1 20 11340 1 1 27 PRO HA H 9.459 17.233 11.076 1.00 . A A . 27 PRO HA 1 1 20 11341 1 1 27 PRO HB2 H 9.248 18.076 8.473 1.00 . A A . 27 PRO HB2 1 1 20 11342 1 1 27 PRO HB3 H 10.213 16.643 8.951 1.00 . A A . 27 PRO HB3 1 1 20 11343 1 1 27 PRO HD2 H 6.893 14.722 9.101 1.00 . A A . 27 PRO HD2 1 1 20 11344 1 1 27 PRO HD3 H 8.639 14.351 9.234 1.00 . A A . 27 PRO HD3 1 1 20 11345 1 1 27 PRO HG2 H 7.276 16.583 7.783 1.00 . A A . 27 PRO HG2 1 1 20 11346 1 1 27 PRO HG3 H 8.833 15.784 7.389 1.00 . A A . 27 PRO HG3 1 1 20 11347 1 1 27 PRO N N 7.979 15.850 10.511 1.00 . A A . 27 PRO N 1 1 20 11348 1 1 27 PRO O O 8.053 19.416 10.459 1.00 . A A . 27 PRO O 1 1 20 11349 1 1 28 VAL C C 4.866 18.908 12.311 1.00 . A A . 28 VAL C 1 1 20 11350 1 1 28 VAL CA C 5.349 18.911 10.859 1.00 . A A . 28 VAL CA 1 1 20 11351 1 1 28 VAL CB C 4.222 18.668 9.853 1.00 . A A . 28 VAL CB 1 1 20 11352 1 1 28 VAL CG1 C 3.130 19.732 9.986 1.00 . A A . 28 VAL CG1 1 1 20 11353 1 1 28 VAL CG2 C 4.765 18.616 8.424 1.00 . A A . 28 VAL CG2 1 1 20 11354 1 1 28 VAL H H 6.067 16.959 10.736 1.00 . A A . 28 VAL H 1 1 20 11355 1 1 28 VAL HA H 5.794 19.881 10.640 1.00 . A A . 28 VAL HA 1 1 20 11356 1 1 28 VAL HB H 3.775 17.700 10.078 1.00 . A A . 28 VAL HB 1 1 20 11357 1 1 28 VAL HG11 H 2.326 19.351 10.615 1.00 . A A . 28 VAL HG11 1 1 20 11358 1 1 28 VAL HG12 H 3.551 20.631 10.438 1.00 . A A . 28 VAL HG12 1 1 20 11359 1 1 28 VAL HG13 H 2.735 19.973 8.999 1.00 . A A . 28 VAL HG13 1 1 20 11360 1 1 28 VAL HG21 H 5.629 19.275 8.339 1.00 . A A . 28 VAL HG21 1 1 20 11361 1 1 28 VAL HG22 H 5.063 17.594 8.186 1.00 . A A . 28 VAL HG22 1 1 20 11362 1 1 28 VAL HG23 H 3.990 18.940 7.729 1.00 . A A . 28 VAL HG23 1 1 20 11363 1 1 28 VAL N N 6.386 17.906 10.696 1.00 . A A . 28 VAL N 1 1 20 11364 1 1 28 VAL O O 5.434 19.592 13.160 1.00 . A A . 28 VAL O 1 1 20 11365 1 1 29 CYS C C 4.394 17.781 14.874 1.00 . A A . 29 CYS C 1 1 20 11366 1 1 29 CYS CA C 3.253 18.029 13.885 1.00 . A A . 29 CYS CA 1 1 20 11367 1 1 29 CYS CB C 2.182 16.939 13.964 1.00 . A A . 29 CYS CB 1 1 20 11368 1 1 29 CYS H H 3.363 17.577 11.855 1.00 . A A . 29 CYS H 1 1 20 11369 1 1 29 CYS HA H 2.764 18.981 14.091 1.00 . A A . 29 CYS HA 1 1 20 11370 1 1 29 CYS HB2 H 1.843 16.857 14.996 1.00 . A A . 29 CYS HB2 1 1 20 11371 1 1 29 CYS HB3 H 1.324 17.250 13.369 1.00 . A A . 29 CYS HB3 1 1 20 11372 1 1 29 CYS N N 3.820 18.130 12.551 1.00 . A A . 29 CYS N 1 1 20 11373 1 1 29 CYS O O 4.520 18.489 15.872 1.00 . A A . 29 CYS O 1 1 20 11374 1 1 29 CYS SG S 2.725 15.287 13.392 1.00 . A A . 29 CYS SG 1 1 20 11375 1 1 30 GLY C C 6.075 15.094 16.128 1.00 . A A . 30 GLY C 1 1 20 11376 1 1 30 GLY CA C 6.322 16.422 15.411 1.00 . A A . 30 GLY CA 1 1 20 11377 1 1 30 GLY H H 5.086 16.202 13.748 1.00 . A A . 30 GLY H 1 1 20 11378 1 1 30 GLY HA2 H 7.228 16.353 14.809 1.00 . A A . 30 GLY HA2 1 1 20 11379 1 1 30 GLY HA3 H 6.489 17.210 16.145 1.00 . A A . 30 GLY HA3 1 1 20 11380 1 1 30 GLY N N 5.196 16.773 14.562 1.00 . A A . 30 GLY N 1 1 20 11381 1 1 30 GLY O O 6.992 14.522 16.716 1.00 . A A . 30 GLY O 1 1 20 11382 1 1 31 ALA C C 5.397 12.278 16.220 1.00 . A A . 31 ALA C 1 1 20 11383 1 1 31 ALA CA C 4.455 13.389 16.688 1.00 . A A . 31 ALA CA 1 1 20 11384 1 1 31 ALA CB C 2.989 13.080 16.375 1.00 . A A . 31 ALA CB 1 1 20 11385 1 1 31 ALA H H 4.094 15.110 15.573 1.00 . A A . 31 ALA H 1 1 20 11386 1 1 31 ALA HA H 4.564 13.516 17.765 1.00 . A A . 31 ALA HA 1 1 20 11387 1 1 31 ALA HB1 H 2.937 12.319 15.596 1.00 . A A . 31 ALA HB1 1 1 20 11388 1 1 31 ALA HB2 H 2.494 12.714 17.275 1.00 . A A . 31 ALA HB2 1 1 20 11389 1 1 31 ALA HB3 H 2.492 13.988 16.031 1.00 . A A . 31 ALA HB3 1 1 20 11390 1 1 31 ALA N N 4.833 14.639 16.054 1.00 . A A . 31 ALA N 1 1 20 11391 1 1 31 ALA O O 6.072 12.421 15.201 1.00 . A A . 31 ALA O 1 1 20 11392 1 1 32 SER C C 5.676 9.294 15.474 1.00 . A A . 32 SER C 1 1 20 11393 1 1 32 SER CA C 6.260 10.062 16.660 1.00 . A A . 32 SER CA 1 1 20 11394 1 1 32 SER CB C 6.425 9.135 17.866 1.00 . A A . 32 SER CB 1 1 20 11395 1 1 32 SER H H 4.860 11.088 17.811 1.00 . A A . 32 SER H 1 1 20 11396 1 1 32 SER HA H 7.228 10.491 16.399 1.00 . A A . 32 SER HA 1 1 20 11397 1 1 32 SER HB2 H 6.953 8.231 17.559 1.00 . A A . 32 SER HB2 1 1 20 11398 1 1 32 SER HB3 H 7.041 9.625 18.619 1.00 . A A . 32 SER HB3 1 1 20 11399 1 1 32 SER HG H 4.742 8.050 17.901 1.00 . A A . 32 SER HG 1 1 20 11400 1 1 32 SER N N 5.412 11.196 16.984 1.00 . A A . 32 SER N 1 1 20 11401 1 1 32 SER O O 4.547 9.552 15.059 1.00 . A A . 32 SER O 1 1 20 11402 1 1 32 SER OG O 5.169 8.777 18.438 1.00 . A A . 32 SER OG 1 1 20 11403 1 1 33 LYS C C 5.150 6.422 14.330 1.00 . A A . 33 LYS C 1 1 20 11404 1 1 33 LYS CA C 6.046 7.557 13.831 1.00 . A A . 33 LYS CA 1 1 20 11405 1 1 33 LYS CB C 7.257 7.078 13.030 1.00 . A A . 33 LYS CB 1 1 20 11406 1 1 33 LYS CD C 8.919 5.207 13.339 1.00 . A A . 33 LYS CD 1 1 20 11407 1 1 33 LYS CE C 9.136 4.133 14.407 1.00 . A A . 33 LYS CE 1 1 20 11408 1 1 33 LYS CG C 8.320 6.475 13.950 1.00 . A A . 33 LYS CG 1 1 20 11409 1 1 33 LYS H H 7.387 8.163 15.305 1.00 . A A . 33 LYS H 1 1 20 11410 1 1 33 LYS HA H 5.457 8.199 13.174 1.00 . A A . 33 LYS HA 1 1 20 11411 1 1 33 LYS HB2 H 6.942 6.335 12.296 1.00 . A A . 33 LYS HB2 1 1 20 11412 1 1 33 LYS HB3 H 7.683 7.913 12.474 1.00 . A A . 33 LYS HB3 1 1 20 11413 1 1 33 LYS HD2 H 8.257 4.824 12.563 1.00 . A A . 33 LYS HD2 1 1 20 11414 1 1 33 LYS HD3 H 9.869 5.445 12.859 1.00 . A A . 33 LYS HD3 1 1 20 11415 1 1 33 LYS HE2 H 10.195 4.068 14.656 1.00 . A A . 33 LYS HE2 1 1 20 11416 1 1 33 LYS HE3 H 8.611 4.410 15.322 1.00 . A A . 33 LYS HE3 1 1 20 11417 1 1 33 LYS HG2 H 9.109 7.206 14.128 1.00 . A A . 33 LYS HG2 1 1 20 11418 1 1 33 LYS HG3 H 7.878 6.243 14.919 1.00 . A A . 33 LYS HG3 1 1 20 11419 1 1 33 LYS HZ1 H 9.406 2.243 13.573 1.00 . A A . 33 LYS HZ1 1 1 20 11420 1 1 33 LYS HZ2 H 8.198 2.290 14.664 1.00 . A A . 33 LYS HZ2 1 1 20 11421 1 1 33 LYS N N 6.471 8.365 14.961 1.00 . A A . 33 LYS N 1 1 20 11422 1 1 33 LYS NZ N 8.651 2.820 13.928 1.00 . A A . 33 LYS NZ 1 1 20 11423 1 1 33 LYS O O 5.400 5.254 14.035 1.00 . A A . 33 LYS O 1 1 20 11424 1 1 34 ASP C C 1.821 6.023 14.959 1.00 . A A . 34 ASP C 1 1 20 11425 1 1 34 ASP CA C 3.189 5.833 15.619 1.00 . A A . 34 ASP CA 1 1 20 11426 1 1 34 ASP CB C 3.017 6.017 17.127 1.00 . A A . 34 ASP CB 1 1 20 11427 1 1 34 ASP CG C 2.108 4.990 17.805 1.00 . A A . 34 ASP CG 1 1 20 11428 1 1 34 ASP H H 3.928 7.756 15.311 1.00 . A A . 34 ASP H 1 1 20 11429 1 1 34 ASP HA H 3.626 4.859 15.397 1.00 . A A . 34 ASP HA 1 1 20 11430 1 1 34 ASP HB2 H 3.999 5.977 17.598 1.00 . A A . 34 ASP HB2 1 1 20 11431 1 1 34 ASP HB3 H 2.615 7.013 17.313 1.00 . A A . 34 ASP HB3 1 1 20 11432 1 1 34 ASP HD2 H 3.287 4.773 19.257 1.00 . A A . 34 ASP HD2 1 1 20 11433 1 1 34 ASP N N 4.124 6.805 15.076 1.00 . A A . 34 ASP N 1 1 20 11434 1 1 34 ASP O O 1.230 5.067 14.462 1.00 . A A . 34 ASP O 1 1 20 11435 1 1 34 ASP OD1 O 0.902 4.920 17.524 1.00 . A A . 34 ASP OD1 1 1 20 11436 1 1 34 ASP OD2 O 2.692 4.228 18.666 1.00 . A A . 34 ASP OD2 1 1 20 11437 1 1 35 ALA C C 0.106 7.271 12.893 1.00 . A A . 35 ALA C 1 1 20 11438 1 1 35 ALA CA C 0.074 7.594 14.388 1.00 . A A . 35 ALA CA 1 1 20 11439 1 1 35 ALA CB C -0.252 9.064 14.659 1.00 . A A . 35 ALA CB 1 1 20 11440 1 1 35 ALA H H 1.848 8.037 15.384 1.00 . A A . 35 ALA H 1 1 20 11441 1 1 35 ALA HA H -0.681 6.972 14.869 1.00 . A A . 35 ALA HA 1 1 20 11442 1 1 35 ALA HB1 H -0.457 9.571 13.716 1.00 . A A . 35 ALA HB1 1 1 20 11443 1 1 35 ALA HB2 H -1.128 9.129 15.305 1.00 . A A . 35 ALA HB2 1 1 20 11444 1 1 35 ALA HB3 H 0.596 9.540 15.151 1.00 . A A . 35 ALA HB3 1 1 20 11445 1 1 35 ALA N N 1.360 7.265 14.977 1.00 . A A . 35 ALA N 1 1 20 11446 1 1 35 ALA O O -0.940 7.085 12.271 1.00 . A A . 35 ALA O 1 1 20 11447 1 1 36 PHE C C 0.942 5.532 10.603 1.00 . A A . 36 PHE C 1 1 20 11448 1 1 36 PHE CA C 1.498 6.915 10.947 1.00 . A A . 36 PHE CA 1 1 20 11449 1 1 36 PHE CB C 3.004 6.928 10.677 1.00 . A A . 36 PHE CB 1 1 20 11450 1 1 36 PHE CD1 C 3.852 9.121 11.539 1.00 . A A . 36 PHE CD1 1 1 20 11451 1 1 36 PHE CD2 C 3.837 8.778 9.209 1.00 . A A . 36 PHE CD2 1 1 20 11452 1 1 36 PHE CE1 C 4.392 10.421 11.345 1.00 . A A . 36 PHE CE1 1 1 20 11453 1 1 36 PHE CE2 C 4.377 10.077 9.014 1.00 . A A . 36 PHE CE2 1 1 20 11454 1 1 36 PHE CG C 3.586 8.328 10.467 1.00 . A A . 36 PHE CG 1 1 20 11455 1 1 36 PHE CZ C 4.643 10.870 10.086 1.00 . A A . 36 PHE CZ 1 1 20 11456 1 1 36 PHE H H 2.162 7.365 12.870 1.00 . A A . 36 PHE H 1 1 20 11457 1 1 36 PHE HA H 0.954 7.674 10.384 1.00 . A A . 36 PHE HA 1 1 20 11458 1 1 36 PHE HB2 H 3.517 6.455 11.514 1.00 . A A . 36 PHE HB2 1 1 20 11459 1 1 36 PHE HB3 H 3.210 6.325 9.794 1.00 . A A . 36 PHE HB3 1 1 20 11460 1 1 36 PHE HD1 H 3.650 8.761 12.548 1.00 . A A . 36 PHE HD1 1 1 20 11461 1 1 36 PHE HD2 H 3.624 8.142 8.349 1.00 . A A . 36 PHE HD2 1 1 20 11462 1 1 36 PHE HE1 H 4.605 11.056 12.204 1.00 . A A . 36 PHE HE1 1 1 20 11463 1 1 36 PHE HE2 H 4.579 10.437 8.005 1.00 . A A . 36 PHE HE2 1 1 20 11464 1 1 36 PHE HZ H 5.058 11.867 9.937 1.00 . A A . 36 PHE HZ 1 1 20 11465 1 1 36 PHE N N 1.316 7.213 12.357 1.00 . A A . 36 PHE N 1 1 20 11466 1 1 36 PHE O O 1.194 4.562 11.317 1.00 . A A . 36 PHE O 1 1 20 11467 1 1 37 GLU C C -0.007 3.954 7.608 1.00 . A A . 37 GLU C 1 1 20 11468 1 1 37 GLU CA C -0.397 4.236 9.060 1.00 . A A . 37 GLU CA 1 1 20 11469 1 1 37 GLU CB C -1.917 4.261 9.226 1.00 . A A . 37 GLU CB 1 1 20 11470 1 1 37 GLU CD C -2.843 3.325 11.378 1.00 . A A . 37 GLU CD 1 1 20 11471 1 1 37 GLU CG C -2.411 3.004 9.946 1.00 . A A . 37 GLU CG 1 1 20 11472 1 1 37 GLU H H -0.003 6.277 8.933 1.00 . A A . 37 GLU H 1 1 20 11473 1 1 37 GLU HA H 0.022 3.466 9.711 1.00 . A A . 37 GLU HA 1 1 20 11474 1 1 37 GLU HB2 H -2.211 5.145 9.790 1.00 . A A . 37 GLU HB2 1 1 20 11475 1 1 37 GLU HB3 H -2.392 4.334 8.247 1.00 . A A . 37 GLU HB3 1 1 20 11476 1 1 37 GLU HE2 H -2.245 3.561 13.148 1.00 . A A . 37 GLU HE2 1 1 20 11477 1 1 37 GLU HG2 H -3.249 2.572 9.398 1.00 . A A . 37 GLU HG2 1 1 20 11478 1 1 37 GLU HG3 H -1.620 2.254 9.961 1.00 . A A . 37 GLU HG3 1 1 20 11479 1 1 37 GLU N N 0.197 5.484 9.508 1.00 . A A . 37 GLU N 1 1 20 11480 1 1 37 GLU O O 0.139 4.879 6.810 1.00 . A A . 37 GLU O 1 1 20 11481 1 1 37 GLU OE1 O -4.022 3.623 11.618 1.00 . A A . 37 GLU OE1 1 1 20 11482 1 1 37 GLU OE2 O -1.903 3.257 12.259 1.00 . A A . 37 GLU OE2 1 1 20 11483 1 1 38 LYS C C -0.720 2.300 5.066 1.00 . A A . 38 LYS C 1 1 20 11484 1 1 38 LYS CA C 0.517 2.258 5.965 1.00 . A A . 38 LYS CA 1 1 20 11485 1 1 38 LYS CB C 1.208 0.893 5.996 1.00 . A A . 38 LYS CB 1 1 20 11486 1 1 38 LYS CD C 3.240 -0.234 5.016 1.00 . A A . 38 LYS CD 1 1 20 11487 1 1 38 LYS CE C 2.890 -1.704 4.773 1.00 . A A . 38 LYS CE 1 1 20 11488 1 1 38 LYS CG C 2.039 0.670 4.731 1.00 . A A . 38 LYS CG 1 1 20 11489 1 1 38 LYS H H 0.027 1.927 7.963 1.00 . A A . 38 LYS H 1 1 20 11490 1 1 38 LYS HA H 1.243 2.978 5.589 1.00 . A A . 38 LYS HA 1 1 20 11491 1 1 38 LYS HB2 H 1.850 0.827 6.875 1.00 . A A . 38 LYS HB2 1 1 20 11492 1 1 38 LYS HB3 H 0.461 0.106 6.088 1.00 . A A . 38 LYS HB3 1 1 20 11493 1 1 38 LYS HD2 H 4.076 0.054 4.380 1.00 . A A . 38 LYS HD2 1 1 20 11494 1 1 38 LYS HD3 H 3.564 -0.099 6.048 1.00 . A A . 38 LYS HD3 1 1 20 11495 1 1 38 LYS HE2 H 2.238 -2.064 5.569 1.00 . A A . 38 LYS HE2 1 1 20 11496 1 1 38 LYS HE3 H 2.338 -1.802 3.839 1.00 . A A . 38 LYS HE3 1 1 20 11497 1 1 38 LYS HG2 H 1.417 0.221 3.957 1.00 . A A . 38 LYS HG2 1 1 20 11498 1 1 38 LYS HG3 H 2.385 1.630 4.345 1.00 . A A . 38 LYS HG3 1 1 20 11499 1 1 38 LYS HZ1 H 4.955 -1.957 4.660 1.00 . A A . 38 LYS HZ1 1 1 20 11500 1 1 38 LYS HZ2 H 4.220 -3.112 5.541 1.00 . A A . 38 LYS HZ2 1 1 20 11501 1 1 38 LYS N N 0.148 2.673 7.308 1.00 . A A . 38 LYS N 1 1 20 11502 1 1 38 LYS NZ N 4.119 -2.526 4.720 1.00 . A A . 38 LYS NZ 1 1 20 11503 1 1 38 LYS O O -1.518 1.364 5.056 1.00 . A A . 38 LYS O 1 1 20 11504 1 1 39 GLN C C -1.577 4.488 2.265 1.00 . A A . 39 GLN C 1 1 20 11505 1 1 39 GLN CA C -1.966 3.572 3.427 1.00 . A A . 39 GLN CA 1 1 20 11506 1 1 39 GLN CB C -3.184 4.119 4.174 1.00 . A A . 39 GLN CB 1 1 20 11507 1 1 39 GLN CD C -5.036 2.550 4.857 1.00 . A A . 39 GLN CD 1 1 20 11508 1 1 39 GLN CG C -4.464 3.409 3.728 1.00 . A A . 39 GLN CG 1 1 20 11509 1 1 39 GLN H H -0.186 4.152 4.341 1.00 . A A . 39 GLN H 1 1 20 11510 1 1 39 GLN HA H -2.195 2.575 3.052 1.00 . A A . 39 GLN HA 1 1 20 11511 1 1 39 GLN HB2 H -3.047 3.989 5.247 1.00 . A A . 39 GLN HB2 1 1 20 11512 1 1 39 GLN HB3 H -3.276 5.190 3.992 1.00 . A A . 39 GLN HB3 1 1 20 11513 1 1 39 GLN HE21 H -3.882 1.016 4.212 1.00 . A A . 39 GLN HE21 1 1 20 11514 1 1 39 GLN HE22 H -4.870 0.670 5.592 1.00 . A A . 39 GLN HE22 1 1 20 11515 1 1 39 GLN HG2 H -5.203 4.146 3.417 1.00 . A A . 39 GLN HG2 1 1 20 11516 1 1 39 GLN HG3 H -4.254 2.783 2.860 1.00 . A A . 39 GLN HG3 1 1 20 11517 1 1 39 GLN N N -0.839 3.395 4.329 1.00 . A A . 39 GLN N 1 1 20 11518 1 1 39 GLN NE2 N -4.557 1.310 4.890 1.00 . A A . 39 GLN NE2 1 1 20 11519 1 1 39 GLN O O -2.112 4.363 1.165 1.00 . A A . 39 GLN O 1 1 20 11520 1 1 39 GLN OE1 O -5.858 2.984 5.646 1.00 . A A . 39 GLN OE1 1 1 stop_ save_
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