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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype |
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372493 |
1dbd ![]() ![]() |
4087 | cing | 4-filtered-FRED | STAR | entry | full |
data_FRED_restraints_with_modified_coordinates_PDB_code_1dbd # This FRED archive file contains, for PDB entry <1dbd>: # # - 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_1dbd _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1dbd _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all free" _Assembly.Molecular_mass 20916.97 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 $REGULATORY_PROTEIN_E2 A . 1 1 2 . 1 $REGULATORY_PROTEIN_E2 B . 1 1 stop_ save_ save_REGULATORY_PROTEIN_E2 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "REGULATORY PROTEIN E2" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code RRTTNDGFHLLKAGGSCFALISGTANQVKCYRFRVKKNHRHRYENCTTTWFTVADNGAERQGQAQILITFGSPSQRQDFLKHVPLPPGMNISGFTASLDF _Entity.Number_of_monomers 100 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 ARG . 1 1 2 ARG . 1 1 3 THR . 1 1 4 THR . 1 1 5 ASN . 1 1 6 ASP . 1 1 7 GLY . 1 1 8 PHE . 1 1 9 HIS . 1 1 10 LEU . 1 1 11 LEU . 1 1 12 LYS . 1 1 13 ALA . 1 1 14 GLY . 1 1 15 GLY . 1 1 16 SER . 1 1 17 CYS . 1 1 18 PHE . 1 1 19 ALA . 1 1 20 LEU . 1 1 21 ILE . 1 1 22 SER . 1 1 23 GLY . 1 1 24 THR . 1 1 25 ALA . 1 1 26 ASN . 1 1 27 GLN . 1 1 28 VAL . 1 1 29 LYS . 1 1 30 CYS . 1 1 31 TYR . 1 1 32 ARG . 1 1 33 PHE . 1 1 34 ARG . 1 1 35 VAL . 1 1 36 LYS . 1 1 37 LYS . 1 1 38 ASN . 1 1 39 HIS . 1 1 40 ARG . 1 1 41 HIS . 1 1 42 ARG . 1 1 43 TYR . 1 1 44 GLU . 1 1 45 ASN . 1 1 46 CYS . 1 1 47 THR . 1 1 48 THR . 1 1 49 THR . 1 1 50 TRP . 1 1 51 PHE . 1 1 52 THR . 1 1 53 VAL . 1 1 54 ALA . 1 1 55 ASP . 1 1 56 ASN . 1 1 57 GLY . 1 1 58 ALA . 1 1 59 GLU . 1 1 60 ARG . 1 1 61 GLN . 1 1 62 GLY . 1 1 63 GLN . 1 1 64 ALA . 1 1 65 GLN . 1 1 66 ILE . 1 1 67 LEU . 1 1 68 ILE . 1 1 69 THR . 1 1 70 PHE . 1 1 71 GLY . 1 1 72 SER . 1 1 73 PRO . 1 1 74 SER . 1 1 75 GLN . 1 1 76 ARG . 1 1 77 GLN . 1 1 78 ASP . 1 1 79 PHE . 1 1 80 LEU . 1 1 81 LYS . 1 1 82 HIS . 1 1 83 VAL . 1 1 84 PRO . 1 1 85 LEU . 1 1 86 PRO . 1 1 87 PRO . 1 1 88 GLY . 1 1 89 MET . 1 1 90 ASN . 1 1 91 ILE . 1 1 92 SER . 1 1 93 GLY . 1 1 94 PHE . 1 1 95 THR . 1 1 96 ALA . 1 1 97 SER . 1 1 98 LEU . 1 1 99 ASP . 1 1 100 PHE . 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 ARG 1 1 1 1 ARG 2 2 1 1 THR 3 3 1 1 THR 4 4 1 1 ASN 5 5 1 1 ASP 6 6 1 1 GLY 7 7 1 1 PHE 8 8 1 1 HIS 9 9 1 1 LEU 10 10 1 1 LEU 11 11 1 1 LYS 12 12 1 1 ALA 13 13 1 1 GLY 14 14 1 1 GLY 15 15 1 1 SER 16 16 1 1 CYS 17 17 1 1 PHE 18 18 1 1 ALA 19 19 1 1 LEU 20 20 1 1 ILE 21 21 1 1 SER 22 22 1 1 GLY 23 23 1 1 THR 24 24 1 1 ALA 25 25 1 1 ASN 26 26 1 1 GLN 27 27 1 1 VAL 28 28 1 1 LYS 29 29 1 1 CYS 30 30 1 1 TYR 31 31 1 1 ARG 32 32 1 1 PHE 33 33 1 1 ARG 34 34 1 1 VAL 35 35 1 1 LYS 36 36 1 1 LYS 37 37 1 1 ASN 38 38 1 1 HIS 39 39 1 1 ARG 40 40 1 1 HIS 41 41 1 1 ARG 42 42 1 1 TYR 43 43 1 1 GLU 44 44 1 1 ASN 45 45 1 1 CYS 46 46 1 1 THR 47 47 1 1 THR 48 48 1 1 THR 49 49 1 1 TRP 50 50 1 1 PHE 51 51 1 1 THR 52 52 1 1 VAL 53 53 1 1 ALA 54 54 1 1 ASP 55 55 1 1 ASN 56 56 1 1 GLY 57 57 1 1 ALA 58 58 1 1 GLU 59 59 1 1 ARG 60 60 1 1 GLN 61 61 1 1 GLY 62 62 1 1 GLN 63 63 1 1 ALA 64 64 1 1 GLN 65 65 1 1 ILE 66 66 1 1 LEU 67 67 1 1 ILE 68 68 1 1 THR 69 69 1 1 PHE 70 70 1 1 GLY 71 71 1 1 SER 72 72 1 1 PRO 73 73 1 1 SER 74 74 1 1 GLN 75 75 1 1 ARG 76 76 1 1 GLN 77 77 1 1 ASP 78 78 1 1 PHE 79 79 1 1 LEU 80 80 1 1 LYS 81 81 1 1 HIS 82 82 1 1 VAL 83 83 1 1 PRO 84 84 1 1 LEU 85 85 1 1 PRO 86 86 1 1 PRO 87 87 1 1 GLY 88 88 1 1 MET 89 89 1 1 ASN 90 90 1 1 ILE 91 91 1 1 SER 92 92 1 1 GLY 93 93 1 1 PHE 94 94 1 1 THR 95 95 1 1 ALA 96 96 1 1 SER 97 97 1 1 LEU 98 98 1 1 ASP 99 99 1 1 PHE 100 100 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 ARG C C 15.482 5.074 -41.532 1.00 . A A . 1 ARG C 1 1 1 2 1 1 1 ARG CA C 14.142 4.512 -41.949 1.00 . A A . 1 ARG CA 1 1 1 3 1 1 1 ARG CB C 13.722 5.070 -43.337 1.00 . A A . 1 ARG CB 1 1 1 4 1 1 1 ARG CD C 12.575 3.731 -45.250 1.00 . A A . 1 ARG CD 1 1 1 5 1 1 1 ARG CG C 12.413 4.482 -43.915 1.00 . A A . 1 ARG CG 1 1 1 6 1 1 1 ARG CZ C 13.207 1.313 -44.804 1.00 . A A . 1 ARG CZ 1 1 1 7 1 1 1 ARG N N 14.202 3.021 -42.007 1.00 . A A . 1 ARG N 1 1 1 8 1 1 1 ARG NE N 13.551 2.590 -45.075 1.00 . A A . 1 ARG NE 1 1 1 9 1 1 1 ARG NH1 N 11.955 0.972 -44.476 1.00 . A A . 1 ARG NH1 1 1 1 10 1 1 1 ARG NH2 N 14.148 0.357 -44.838 1.00 . A A . 1 ARG NH2 1 1 1 11 1 1 1 ARG O O 16.346 5.337 -42.363 1.00 . A A . 1 ARG O 1 1 1 12 1 1 2 ARG C C 17.724 4.240 -39.220 1.00 . A A . 2 ARG C 1 1 1 13 1 1 2 ARG CA C 16.995 5.511 -39.639 1.00 . A A . 2 ARG CA 1 1 1 14 1 1 2 ARG CB C 17.032 6.664 -38.616 1.00 . A A . 2 ARG CB 1 1 1 15 1 1 2 ARG CD C 16.627 8.463 -40.511 1.00 . A A . 2 ARG CD 1 1 1 16 1 1 2 ARG CG C 16.340 7.973 -39.077 1.00 . A A . 2 ARG CG 1 1 1 17 1 1 2 ARG CZ C 18.827 8.081 -41.720 1.00 . A A . 2 ARG CZ 1 1 1 18 1 1 2 ARG N N 15.697 5.276 -40.220 1.00 . A A . 2 ARG N 1 1 1 19 1 1 2 ARG NE N 18.109 8.601 -40.700 1.00 . A A . 2 ARG NE 1 1 1 20 1 1 2 ARG NH1 N 18.352 7.174 -42.585 1.00 . A A . 2 ARG NH1 1 1 1 21 1 1 2 ARG NH2 N 20.100 8.486 -41.871 1.00 . A A . 2 ARG NH2 1 1 1 22 1 1 2 ARG O O 18.690 3.889 -39.883 1.00 . A A . 2 ARG O 1 1 1 23 1 1 3 THR C C 16.359 3.951 -35.926 1.00 . A A . 3 THR C 1 1 1 24 1 1 3 THR CA C 16.262 3.257 -37.259 1.00 . A A . 3 THR CA 1 1 1 25 1 1 3 THR CB C 14.807 3.114 -37.749 1.00 . A A . 3 THR CB 1 1 1 26 1 1 3 THR CG2 C 14.740 2.038 -38.847 1.00 . A A . 3 THR CG2 1 1 1 27 1 1 3 THR N N 17.411 3.461 -38.156 1.00 . A A . 3 THR N 1 1 1 28 1 1 3 THR O O 17.031 3.481 -35.014 1.00 . A A . 3 THR O 1 1 1 29 1 1 3 THR OG1 O 14.192 4.311 -38.222 1.00 . A A . 3 THR OG1 1 1 1 30 1 1 4 THR C C 13.958 5.432 -34.173 1.00 . A A . 4 THR C 1 1 1 31 1 1 4 THR CA C 15.401 5.736 -34.502 1.00 . A A . 4 THR CA 1 1 1 32 1 1 4 THR CB C 15.644 7.245 -34.560 1.00 . A A . 4 THR CB 1 1 1 33 1 1 4 THR CG2 C 17.145 7.510 -34.772 1.00 . A A . 4 THR CG2 1 1 1 34 1 1 4 THR N N 15.637 5.070 -35.766 1.00 . A A . 4 THR N 1 1 1 35 1 1 4 THR O O 13.102 6.315 -34.186 1.00 . A A . 4 THR O 1 1 1 36 1 1 4 THR OG1 O 14.933 7.854 -35.636 1.00 . A A . 4 THR OG1 1 1 1 37 1 1 5 ASN C C 12.019 3.423 -32.279 1.00 . A A . 5 ASN C 1 1 1 38 1 1 5 ASN CA C 12.316 3.617 -33.755 1.00 . A A . 5 ASN CA 1 1 1 39 1 1 5 ASN CB C 12.054 2.341 -34.618 1.00 . A A . 5 ASN CB 1 1 1 40 1 1 5 ASN CG C 13.089 1.221 -34.436 1.00 . A A . 5 ASN CG 1 1 1 41 1 1 5 ASN N N 13.659 4.130 -33.941 1.00 . A A . 5 ASN N 1 1 1 42 1 1 5 ASN ND2 N 13.005 0.437 -33.338 1.00 . A A . 5 ASN ND2 1 1 1 43 1 1 5 ASN O O 12.538 4.136 -31.421 1.00 . A A . 5 ASN O 1 1 1 44 1 1 5 ASN OD1 O 13.961 1.049 -35.294 1.00 . A A . 5 ASN OD1 1 1 1 45 1 1 6 ASP C C 11.070 1.620 -29.624 1.00 . A A . 6 ASP C 1 1 1 46 1 1 6 ASP CA C 10.441 2.487 -30.689 1.00 . A A . 6 ASP CA 1 1 1 47 1 1 6 ASP CB C 9.015 1.892 -30.886 1.00 . A A . 6 ASP CB 1 1 1 48 1 1 6 ASP CG C 8.248 2.595 -31.988 1.00 . A A . 6 ASP CG 1 1 1 49 1 1 6 ASP N N 11.150 2.457 -31.934 1.00 . A A . 6 ASP N 1 1 1 50 1 1 6 ASP O O 11.502 0.487 -29.832 1.00 . A A . 6 ASP O 1 1 1 51 1 1 6 ASP OD1 O 8.645 2.410 -33.168 1.00 . A A . 6 ASP OD1 1 1 1 52 1 1 6 ASP OD2 O 7.262 3.309 -31.677 1.00 . A A . 6 ASP OD2 1 1 1 53 1 1 7 GLY C C 9.329 1.066 -27.201 1.00 . A A . 7 GLY C 1 1 1 54 1 1 7 GLY CA C 10.796 1.357 -27.199 1.00 . A A . 7 GLY CA 1 1 1 55 1 1 7 GLY N N 11.059 2.160 -28.382 1.00 . A A . 7 GLY N 1 1 1 56 1 1 7 GLY O O 8.547 1.966 -27.502 1.00 . A A . 7 GLY O 1 1 1 57 1 1 8 PHE C C 6.548 -0.079 -26.141 1.00 . A A . 8 PHE C 1 1 1 58 1 1 8 PHE CA C 7.519 -0.553 -27.210 1.00 . A A . 8 PHE CA 1 1 1 59 1 1 8 PHE CB C 7.370 -2.080 -27.422 1.00 . A A . 8 PHE CB 1 1 1 60 1 1 8 PHE CD1 C 9.674 -2.949 -27.948 1.00 . A A . 8 PHE CD1 1 1 1 61 1 1 8 PHE CD2 C 8.126 -2.605 -29.780 1.00 . A A . 8 PHE CD2 1 1 1 62 1 1 8 PHE CE1 C 10.676 -3.307 -28.857 1.00 . A A . 8 PHE CE1 1 1 1 63 1 1 8 PHE CE2 C 9.116 -3.000 -30.690 1.00 . A A . 8 PHE CE2 1 1 1 64 1 1 8 PHE CG C 8.399 -2.569 -28.402 1.00 . A A . 8 PHE CG 1 1 1 65 1 1 8 PHE CZ C 10.393 -3.338 -30.228 1.00 . A A . 8 PHE CZ 1 1 1 66 1 1 8 PHE N N 8.891 -0.170 -26.909 1.00 . A A . 8 PHE N 1 1 1 67 1 1 8 PHE O O 5.980 -0.873 -25.393 1.00 . A A . 8 PHE O 1 1 1 68 1 1 9 HIS C C 4.472 2.688 -25.962 1.00 . A A . 9 HIS C 1 1 1 69 1 1 9 HIS CA C 5.507 1.956 -25.126 1.00 . A A . 9 HIS CA 1 1 1 70 1 1 9 HIS CB C 6.301 3.017 -24.302 1.00 . A A . 9 HIS CB 1 1 1 71 1 1 9 HIS CD2 C 8.352 1.748 -23.228 1.00 . A A . 9 HIS CD2 1 1 1 72 1 1 9 HIS CE1 C 9.939 2.984 -23.974 1.00 . A A . 9 HIS CE1 1 1 1 73 1 1 9 HIS CG C 7.755 2.687 -24.020 1.00 . A A . 9 HIS CG 1 1 1 74 1 1 9 HIS N N 6.371 1.252 -26.045 1.00 . A A . 9 HIS N 1 1 1 75 1 1 9 HIS ND1 N 8.787 3.469 -24.499 1.00 . A A . 9 HIS ND1 1 1 1 76 1 1 9 HIS NE2 N 9.728 1.938 -23.206 1.00 . A A . 9 HIS NE2 1 1 1 77 1 1 9 HIS O O 4.840 3.439 -26.862 1.00 . A A . 9 HIS O 1 1 1 78 1 1 10 LEU C C 1.443 4.311 -26.070 1.00 . A A . 10 LEU C 1 1 1 79 1 1 10 LEU CA C 2.089 3.012 -26.551 1.00 . A A . 10 LEU CA 1 1 1 80 1 1 10 LEU CB C 0.966 1.947 -26.690 1.00 . A A . 10 LEU CB 1 1 1 81 1 1 10 LEU CD1 C 0.388 -0.417 -27.424 1.00 . A A . 10 LEU CD1 1 1 1 82 1 1 10 LEU CD2 C 1.233 1.225 -29.123 1.00 . A A . 10 LEU CD2 1 1 1 83 1 1 10 LEU CG C 1.313 0.786 -27.651 1.00 . A A . 10 LEU CG 1 1 1 84 1 1 10 LEU N N 3.159 2.498 -25.692 1.00 . A A . 10 LEU N 1 1 1 85 1 1 10 LEU O O 0.598 4.885 -26.757 1.00 . A A . 10 LEU O 1 1 1 86 1 1 11 LEU C C 1.802 7.301 -24.635 1.00 . A A . 11 LEU C 1 1 1 87 1 1 11 LEU CA C 1.173 5.972 -24.256 1.00 . A A . 11 LEU CA 1 1 1 88 1 1 11 LEU CB C 1.234 5.840 -22.717 1.00 . A A . 11 LEU CB 1 1 1 89 1 1 11 LEU CD1 C 1.083 4.332 -20.718 1.00 . A A . 11 LEU CD1 1 1 1 90 1 1 11 LEU CD2 C -0.883 4.489 -22.318 1.00 . A A . 11 LEU CD2 1 1 1 91 1 1 11 LEU CG C 0.646 4.525 -22.176 1.00 . A A . 11 LEU CG 1 1 1 92 1 1 11 LEU N N 1.837 4.836 -24.890 1.00 . A A . 11 LEU N 1 1 1 93 1 1 11 LEU O O 1.565 8.329 -24.009 1.00 . A A . 11 LEU O 1 1 1 94 1 1 12 LYS C C 2.719 9.630 -26.582 1.00 . A A . 12 LYS C 1 1 1 95 1 1 12 LYS CA C 3.473 8.389 -26.134 1.00 . A A . 12 LYS CA 1 1 1 96 1 1 12 LYS CB C 4.386 7.902 -27.290 1.00 . A A . 12 LYS CB 1 1 1 97 1 1 12 LYS CD C 6.464 8.346 -28.707 1.00 . A A . 12 LYS CD 1 1 1 98 1 1 12 LYS CE C 7.607 9.302 -29.074 1.00 . A A . 12 LYS CE 1 1 1 99 1 1 12 LYS CG C 5.377 8.960 -27.808 1.00 . A A . 12 LYS CG 1 1 1 100 1 1 12 LYS N N 2.649 7.286 -25.682 1.00 . A A . 12 LYS N 1 1 1 101 1 1 12 LYS NZ N 7.080 10.455 -29.838 1.00 . A A . 12 LYS NZ 1 1 1 102 1 1 12 LYS O O 3.091 10.752 -26.236 1.00 . A A . 12 LYS O 1 1 1 103 1 1 13 ALA C C 0.085 11.302 -27.015 1.00 . A A . 13 ALA C 1 1 1 104 1 1 13 ALA CA C 0.933 10.540 -28.021 1.00 . A A . 13 ALA CA 1 1 1 105 1 1 13 ALA CB C 0.065 10.007 -29.177 1.00 . A A . 13 ALA CB 1 1 1 106 1 1 13 ALA N N 1.652 9.455 -27.391 1.00 . A A . 13 ALA N 1 1 1 107 1 1 13 ALA O O -0.623 10.708 -26.201 1.00 . A A . 13 ALA O 1 1 1 108 1 1 14 GLY C C -1.737 13.758 -25.876 1.00 . A A . 14 GLY C 1 1 1 109 1 1 14 GLY CA C -0.256 13.572 -25.989 1.00 . A A . 14 GLY CA 1 1 1 110 1 1 14 GLY N N 0.188 12.656 -27.040 1.00 . A A . 14 GLY N 1 1 1 111 1 1 14 GLY O O -2.260 14.863 -25.971 1.00 . A A . 14 GLY O 1 1 1 112 1 1 15 GLY C C -4.139 11.148 -25.182 1.00 . A A . 15 GLY C 1 1 1 113 1 1 15 GLY CA C -3.831 12.593 -25.313 1.00 . A A . 15 GLY CA 1 1 1 114 1 1 15 GLY N N -2.431 12.649 -25.640 1.00 . A A . 15 GLY N 1 1 1 115 1 1 15 GLY O O -5.140 10.667 -25.690 1.00 . A A . 15 GLY O 1 1 1 116 1 1 16 SER C C -3.789 8.722 -22.937 1.00 . A A . 16 SER C 1 1 1 117 1 1 16 SER CA C -3.382 8.960 -24.359 1.00 . A A . 16 SER CA 1 1 1 118 1 1 16 SER CB C -2.072 8.176 -24.635 1.00 . A A . 16 SER CB 1 1 1 119 1 1 16 SER N N -3.249 10.396 -24.508 1.00 . A A . 16 SER N 1 1 1 120 1 1 16 SER O O -2.954 8.435 -22.080 1.00 . A A . 16 SER O 1 1 1 121 1 1 16 SER OG O -1.690 8.276 -26.007 1.00 . A A . 16 SER OG 1 1 1 122 1 1 17 CYS C C -5.824 7.254 -21.031 1.00 . A A . 17 CYS C 1 1 1 123 1 1 17 CYS CA C -5.599 8.725 -21.296 1.00 . A A . 17 CYS CA 1 1 1 124 1 1 17 CYS CB C -6.902 9.548 -21.087 1.00 . A A . 17 CYS CB 1 1 1 125 1 1 17 CYS N N -5.098 8.871 -22.642 1.00 . A A . 17 CYS N 1 1 1 126 1 1 17 CYS O O -6.317 6.521 -21.890 1.00 . A A . 17 CYS O 1 1 1 127 1 1 17 CYS SG S -7.545 9.572 -19.369 1.00 . A A . 17 CYS SG 1 1 1 128 1 1 18 PHE C C -6.717 5.325 -18.339 1.00 . A A . 18 PHE C 1 1 1 129 1 1 18 PHE CA C -5.700 5.411 -19.455 1.00 . A A . 18 PHE CA 1 1 1 130 1 1 18 PHE CB C -4.437 4.548 -19.205 1.00 . A A . 18 PHE CB 1 1 1 131 1 1 18 PHE CD1 C -2.564 6.019 -18.352 1.00 . A A . 18 PHE CD1 1 1 1 132 1 1 18 PHE CD2 C -3.553 4.383 -16.864 1.00 . A A . 18 PHE CD2 1 1 1 133 1 1 18 PHE CE1 C -1.656 6.381 -17.351 1.00 . A A . 18 PHE CE1 1 1 1 134 1 1 18 PHE CE2 C -2.628 4.723 -15.874 1.00 . A A . 18 PHE CE2 1 1 1 135 1 1 18 PHE CG C -3.523 5.020 -18.115 1.00 . A A . 18 PHE CG 1 1 1 136 1 1 18 PHE CZ C -1.676 5.721 -16.116 1.00 . A A . 18 PHE CZ 1 1 1 137 1 1 18 PHE N N -5.457 6.784 -19.824 1.00 . A A . 18 PHE N 1 1 1 138 1 1 18 PHE O O -6.518 5.825 -17.234 1.00 . A A . 18 PHE O 1 1 1 139 1 1 19 ALA C C -8.196 2.953 -17.006 1.00 . A A . 19 ALA C 1 1 1 140 1 1 19 ALA CA C -8.778 4.208 -17.614 1.00 . A A . 19 ALA CA 1 1 1 141 1 1 19 ALA CB C -10.181 3.912 -18.172 1.00 . A A . 19 ALA CB 1 1 1 142 1 1 19 ALA N N -7.876 4.702 -18.624 1.00 . A A . 19 ALA N 1 1 1 143 1 1 19 ALA O O -8.021 1.955 -17.703 1.00 . A A . 19 ALA O 1 1 1 144 1 1 20 LEU C C -8.588 1.327 -14.187 1.00 . A A . 20 LEU C 1 1 1 145 1 1 20 LEU CA C -7.408 1.818 -14.985 1.00 . A A . 20 LEU CA 1 1 1 146 1 1 20 LEU CB C -6.232 2.198 -14.060 1.00 . A A . 20 LEU CB 1 1 1 147 1 1 20 LEU CD1 C -4.656 0.291 -14.652 1.00 . A A . 20 LEU CD1 1 1 1 148 1 1 20 LEU CD2 C -4.418 1.486 -12.457 1.00 . A A . 20 LEU CD2 1 1 1 149 1 1 20 LEU CG C -5.414 1.008 -13.523 1.00 . A A . 20 LEU CG 1 1 1 150 1 1 20 LEU N N -7.866 2.973 -15.707 1.00 . A A . 20 LEU N 1 1 1 151 1 1 20 LEU O O -9.104 2.073 -13.350 1.00 . A A . 20 LEU O 1 1 1 152 1 1 21 ILE C C -9.965 -1.546 -13.009 1.00 . A A . 21 ILE C 1 1 1 153 1 1 21 ILE CA C -10.313 -0.366 -13.875 1.00 . A A . 21 ILE CA 1 1 1 154 1 1 21 ILE CB C -11.419 -0.736 -14.860 1.00 . A A . 21 ILE CB 1 1 1 155 1 1 21 ILE CD1 C -10.864 0.205 -17.222 1.00 . A A . 21 ILE CD1 1 1 1 156 1 1 21 ILE CG1 C -11.660 0.369 -15.922 1.00 . A A . 21 ILE CG1 1 1 1 157 1 1 21 ILE CG2 C -12.718 -1.020 -14.070 1.00 . A A . 21 ILE CG2 1 1 1 158 1 1 21 ILE N N -9.084 0.105 -14.484 1.00 . A A . 21 ILE N 1 1 1 159 1 1 21 ILE O O -9.691 -2.644 -13.499 1.00 . A A . 21 ILE O 1 1 1 160 1 1 22 SER C C -10.779 -3.120 -10.229 1.00 . A A . 22 SER C 1 1 1 161 1 1 22 SER CA C -9.584 -2.385 -10.740 1.00 . A A . 22 SER CA 1 1 1 162 1 1 22 SER CB C -8.781 -1.868 -9.542 1.00 . A A . 22 SER CB 1 1 1 163 1 1 22 SER N N -9.975 -1.336 -11.678 1.00 . A A . 22 SER N 1 1 1 164 1 1 22 SER O O -11.081 -3.159 -9.039 1.00 . A A . 22 SER O 1 1 1 165 1 1 22 SER OG O -7.474 -1.548 -9.992 1.00 . A A . 22 SER OG 1 1 1 166 1 1 23 GLY C C -12.343 -5.912 -10.325 1.00 . A A . 23 GLY C 1 1 1 167 1 1 23 GLY CA C -12.667 -4.547 -10.868 1.00 . A A . 23 GLY CA 1 1 1 168 1 1 23 GLY N N -11.520 -3.719 -11.167 1.00 . A A . 23 GLY N 1 1 1 169 1 1 23 GLY O O -11.307 -6.514 -10.579 1.00 . A A . 23 GLY O 1 1 1 170 1 1 24 THR C C -13.196 -8.876 -10.212 1.00 . A A . 24 THR C 1 1 1 171 1 1 24 THR CA C -13.233 -7.853 -9.083 1.00 . A A . 24 THR CA 1 1 1 172 1 1 24 THR CB C -14.403 -8.094 -8.145 1.00 . A A . 24 THR CB 1 1 1 173 1 1 24 THR CG2 C -14.229 -9.392 -7.338 1.00 . A A . 24 THR CG2 1 1 1 174 1 1 24 THR N N -13.295 -6.493 -9.593 1.00 . A A . 24 THR N 1 1 1 175 1 1 24 THR O O -13.935 -8.766 -11.187 1.00 . A A . 24 THR O 1 1 1 176 1 1 24 THR OG1 O -14.467 -7.009 -7.224 1.00 . A A . 24 THR OG1 1 1 1 177 1 1 25 ALA C C -12.991 -11.329 -12.101 1.00 . A A . 25 ALA C 1 1 1 178 1 1 25 ALA CA C -11.884 -10.779 -11.209 1.00 . A A . 25 ALA CA 1 1 1 179 1 1 25 ALA CB C -11.076 -11.949 -10.612 1.00 . A A . 25 ALA CB 1 1 1 180 1 1 25 ALA N N -12.298 -9.887 -10.131 1.00 . A A . 25 ALA N 1 1 1 181 1 1 25 ALA O O -13.011 -11.099 -13.311 1.00 . A A . 25 ALA O 1 1 1 182 1 1 26 ASN C C -15.944 -11.574 -12.847 1.00 . A A . 26 ASN C 1 1 1 183 1 1 26 ASN CA C -15.145 -12.619 -12.088 1.00 . A A . 26 ASN CA 1 1 1 184 1 1 26 ASN CB C -16.087 -13.266 -11.022 1.00 . A A . 26 ASN CB 1 1 1 185 1 1 26 ASN CG C -15.390 -14.356 -10.198 1.00 . A A . 26 ASN CG 1 1 1 186 1 1 26 ASN N N -13.964 -12.036 -11.481 1.00 . A A . 26 ASN N 1 1 1 187 1 1 26 ASN ND2 N -16.126 -14.927 -9.209 1.00 . A A . 26 ASN ND2 1 1 1 188 1 1 26 ASN O O -16.340 -11.780 -13.993 1.00 . A A . 26 ASN O 1 1 1 189 1 1 26 ASN OD1 O -14.224 -14.690 -10.406 1.00 . A A . 26 ASN OD1 1 1 1 190 1 1 27 GLN C C -16.108 -8.672 -13.962 1.00 . A A . 27 GLN C 1 1 1 191 1 1 27 GLN CA C -16.858 -9.273 -12.789 1.00 . A A . 27 GLN CA 1 1 1 192 1 1 27 GLN CB C -17.132 -8.198 -11.711 1.00 . A A . 27 GLN CB 1 1 1 193 1 1 27 GLN CD C -18.265 -6.057 -11.044 1.00 . A A . 27 GLN CD 1 1 1 194 1 1 27 GLN CG C -17.958 -6.995 -12.212 1.00 . A A . 27 GLN CG 1 1 1 195 1 1 27 GLN N N -16.146 -10.395 -12.224 1.00 . A A . 27 GLN N 1 1 1 196 1 1 27 GLN NE2 N -19.432 -5.373 -11.100 1.00 . A A . 27 GLN NE2 1 1 1 197 1 1 27 GLN O O -16.711 -8.408 -14.996 1.00 . A A . 27 GLN O 1 1 1 198 1 1 27 GLN OE1 O -17.473 -5.933 -10.107 1.00 . A A . 27 GLN OE1 1 1 1 199 1 1 28 VAL C C -13.940 -9.015 -16.159 1.00 . A A . 28 VAL C 1 1 1 200 1 1 28 VAL CA C -13.957 -8.035 -14.995 1.00 . A A . 28 VAL CA 1 1 1 201 1 1 28 VAL CB C -12.562 -7.683 -14.545 1.00 . A A . 28 VAL CB 1 1 1 202 1 1 28 VAL CG1 C -11.592 -7.446 -15.715 1.00 . A A . 28 VAL CG1 1 1 1 203 1 1 28 VAL CG2 C -12.680 -6.399 -13.715 1.00 . A A . 28 VAL CG2 1 1 1 204 1 1 28 VAL N N -14.777 -8.484 -13.872 1.00 . A A . 28 VAL N 1 1 1 205 1 1 28 VAL O O -14.075 -8.632 -17.326 1.00 . A A . 28 VAL O 1 1 1 206 1 1 29 LYS C C -15.280 -11.387 -17.569 1.00 . A A . 29 LYS C 1 1 1 207 1 1 29 LYS CA C -13.951 -11.408 -16.820 1.00 . A A . 29 LYS CA 1 1 1 208 1 1 29 LYS CB C -13.724 -12.753 -16.086 1.00 . A A . 29 LYS CB 1 1 1 209 1 1 29 LYS CD C -13.058 -15.199 -16.118 1.00 . A A . 29 LYS CD 1 1 1 210 1 1 29 LYS CE C -12.578 -16.442 -16.883 1.00 . A A . 29 LYS CE 1 1 1 211 1 1 29 LYS CG C -13.403 -13.966 -16.978 1.00 . A A . 29 LYS CG 1 1 1 212 1 1 29 LYS N N -13.855 -10.327 -15.858 1.00 . A A . 29 LYS N 1 1 1 213 1 1 29 LYS NZ N -13.647 -16.952 -17.767 1.00 . A A . 29 LYS NZ 1 1 1 214 1 1 29 LYS O O -15.304 -11.420 -18.799 1.00 . A A . 29 LYS O 1 1 1 215 1 1 30 CYS C C -17.796 -9.741 -18.211 1.00 . A A . 30 CYS C 1 1 1 216 1 1 30 CYS CA C -17.724 -11.035 -17.417 1.00 . A A . 30 CYS CA 1 1 1 217 1 1 30 CYS CB C -18.836 -11.033 -16.339 1.00 . A A . 30 CYS CB 1 1 1 218 1 1 30 CYS N N -16.412 -11.252 -16.838 1.00 . A A . 30 CYS N 1 1 1 219 1 1 30 CYS O O -18.211 -9.759 -19.368 1.00 . A A . 30 CYS O 1 1 1 220 1 1 30 CYS SG S -19.039 -12.673 -15.571 1.00 . A A . 30 CYS SG 1 1 1 221 1 1 31 TYR C C -16.657 -7.295 -19.613 1.00 . A A . 31 TYR C 1 1 1 222 1 1 31 TYR CA C -17.293 -7.277 -18.235 1.00 . A A . 31 TYR CA 1 1 1 223 1 1 31 TYR CB C -16.537 -6.274 -17.307 1.00 . A A . 31 TYR CB 1 1 1 224 1 1 31 TYR CD1 C -17.712 -4.055 -17.590 1.00 . A A . 31 TYR CD1 1 1 1 225 1 1 31 TYR CD2 C -15.481 -4.316 -18.503 1.00 . A A . 31 TYR CD2 1 1 1 226 1 1 31 TYR CE1 C -17.758 -2.742 -18.077 1.00 . A A . 31 TYR CE1 1 1 1 227 1 1 31 TYR CE2 C -15.528 -3.005 -18.999 1.00 . A A . 31 TYR CE2 1 1 1 228 1 1 31 TYR CG C -16.577 -4.854 -17.804 1.00 . A A . 31 TYR CG 1 1 1 229 1 1 31 TYR CZ C -16.664 -2.222 -18.782 1.00 . A A . 31 TYR CZ 1 1 1 230 1 1 31 TYR N N -17.360 -8.598 -17.624 1.00 . A A . 31 TYR N 1 1 1 231 1 1 31 TYR O O -17.303 -6.916 -20.588 1.00 . A A . 31 TYR O 1 1 1 232 1 1 31 TYR OH O -16.716 -0.919 -19.305 1.00 . A A . 31 TYR OH 1 1 1 233 1 1 32 ARG C C -15.353 -8.649 -22.037 1.00 . A A . 32 ARG C 1 1 1 234 1 1 32 ARG CA C -14.672 -7.788 -20.992 1.00 . A A . 32 ARG CA 1 1 1 235 1 1 32 ARG CB C -13.219 -8.294 -20.840 1.00 . A A . 32 ARG CB 1 1 1 236 1 1 32 ARG CD C -11.046 -8.786 -22.111 1.00 . A A . 32 ARG CD 1 1 1 237 1 1 32 ARG CG C -12.341 -7.975 -22.068 1.00 . A A . 32 ARG CG 1 1 1 238 1 1 32 ARG CZ C -9.103 -7.768 -23.353 1.00 . A A . 32 ARG CZ 1 1 1 239 1 1 32 ARG N N -15.395 -7.782 -19.733 1.00 . A A . 32 ARG N 1 1 1 240 1 1 32 ARG NE N -10.302 -8.380 -23.356 1.00 . A A . 32 ARG NE 1 1 1 241 1 1 32 ARG NH1 N -8.588 -7.220 -22.246 1.00 . A A . 32 ARG NH1 1 1 1 242 1 1 32 ARG NH2 N -8.402 -7.697 -24.490 1.00 . A A . 32 ARG NH2 1 1 1 243 1 1 32 ARG O O -15.460 -8.269 -23.203 1.00 . A A . 32 ARG O 1 1 1 244 1 1 33 PHE C C -17.856 -10.130 -23.020 1.00 . A A . 33 PHE C 1 1 1 245 1 1 33 PHE CA C -16.587 -10.755 -22.463 1.00 . A A . 33 PHE CA 1 1 1 246 1 1 33 PHE CB C -16.931 -12.037 -21.658 1.00 . A A . 33 PHE CB 1 1 1 247 1 1 33 PHE CD1 C -16.321 -14.006 -23.095 1.00 . A A . 33 PHE CD1 1 1 1 248 1 1 33 PHE CD2 C -18.668 -13.460 -22.843 1.00 . A A . 33 PHE CD2 1 1 1 249 1 1 33 PHE CE1 C -16.659 -15.095 -23.908 1.00 . A A . 33 PHE CE1 1 1 1 250 1 1 33 PHE CE2 C -19.009 -14.544 -23.663 1.00 . A A . 33 PHE CE2 1 1 1 251 1 1 33 PHE CG C -17.320 -13.184 -22.550 1.00 . A A . 33 PHE CG 1 1 1 252 1 1 33 PHE CZ C -18.004 -15.362 -24.192 1.00 . A A . 33 PHE CZ 1 1 1 253 1 1 33 PHE N N -15.862 -9.833 -21.611 1.00 . A A . 33 PHE N 1 1 1 254 1 1 33 PHE O O -18.191 -10.299 -24.191 1.00 . A A . 33 PHE O 1 1 1 255 1 1 34 ARG C C -19.597 -7.481 -23.373 1.00 . A A . 34 ARG C 1 1 1 256 1 1 34 ARG CA C -19.827 -8.704 -22.498 1.00 . A A . 34 ARG CA 1 1 1 257 1 1 34 ARG CB C -20.529 -8.320 -21.172 1.00 . A A . 34 ARG CB 1 1 1 258 1 1 34 ARG CD C -22.643 -7.875 -19.855 1.00 . A A . 34 ARG CD 1 1 1 259 1 1 34 ARG CG C -22.039 -8.032 -21.259 1.00 . A A . 34 ARG CG 1 1 1 260 1 1 34 ARG CZ C -24.836 -6.853 -19.155 1.00 . A A . 34 ARG CZ 1 1 1 261 1 1 34 ARG N N -18.589 -9.380 -22.173 1.00 . A A . 34 ARG N 1 1 1 262 1 1 34 ARG NE N -24.124 -7.649 -19.980 1.00 . A A . 34 ARG NE 1 1 1 263 1 1 34 ARG NH1 N -24.261 -6.191 -18.141 1.00 . A A . 34 ARG NH1 1 1 1 264 1 1 34 ARG NH2 N -26.165 -6.743 -19.309 1.00 . A A . 34 ARG NH2 1 1 1 265 1 1 34 ARG O O -20.253 -7.292 -24.397 1.00 . A A . 34 ARG O 1 1 1 266 1 1 35 VAL C C -17.743 -5.610 -25.102 1.00 . A A . 35 VAL C 1 1 1 267 1 1 35 VAL CA C -18.232 -5.405 -23.687 1.00 . A A . 35 VAL CA 1 1 1 268 1 1 35 VAL CB C -17.228 -4.588 -22.866 1.00 . A A . 35 VAL CB 1 1 1 269 1 1 35 VAL CG1 C -16.133 -3.850 -23.677 1.00 . A A . 35 VAL CG1 1 1 1 270 1 1 35 VAL CG2 C -18.028 -3.597 -21.999 1.00 . A A . 35 VAL CG2 1 1 1 271 1 1 35 VAL N N -18.618 -6.626 -22.994 1.00 . A A . 35 VAL N 1 1 1 272 1 1 35 VAL O O -18.153 -4.862 -25.991 1.00 . A A . 35 VAL O 1 1 1 273 1 1 36 LYS C C -17.033 -6.752 -27.897 1.00 . A A . 36 LYS C 1 1 1 274 1 1 36 LYS CA C -16.167 -6.752 -26.637 1.00 . A A . 36 LYS CA 1 1 1 275 1 1 36 LYS CB C -15.257 -8.006 -26.661 1.00 . A A . 36 LYS CB 1 1 1 276 1 1 36 LYS CD C -13.242 -9.111 -27.869 1.00 . A A . 36 LYS CD 1 1 1 277 1 1 36 LYS CE C -13.920 -10.255 -28.629 1.00 . A A . 36 LYS CE 1 1 1 278 1 1 36 LYS CG C -14.132 -7.870 -27.706 1.00 . A A . 36 LYS CG 1 1 1 279 1 1 36 LYS N N -16.871 -6.617 -25.364 1.00 . A A . 36 LYS N 1 1 1 280 1 1 36 LYS NZ N -12.938 -11.331 -28.897 1.00 . A A . 36 LYS NZ 1 1 1 281 1 1 36 LYS O O -16.622 -6.236 -28.934 1.00 . A A . 36 LYS O 1 1 1 282 1 1 37 LYS C C -19.636 -5.982 -29.402 1.00 . A A . 37 LYS C 1 1 1 283 1 1 37 LYS CA C -19.270 -7.354 -28.854 1.00 . A A . 37 LYS CA 1 1 1 284 1 1 37 LYS CB C -20.586 -8.005 -28.338 1.00 . A A . 37 LYS CB 1 1 1 285 1 1 37 LYS CD C -21.985 -10.087 -27.974 1.00 . A A . 37 LYS CD 1 1 1 286 1 1 37 LYS CE C -22.089 -11.610 -28.101 1.00 . A A . 37 LYS CE 1 1 1 287 1 1 37 LYS CG C -20.564 -9.536 -28.205 1.00 . A A . 37 LYS CG 1 1 1 288 1 1 37 LYS N N -18.261 -7.308 -27.806 1.00 . A A . 37 LYS N 1 1 1 289 1 1 37 LYS NZ N -23.495 -12.036 -27.910 1.00 . A A . 37 LYS NZ 1 1 1 290 1 1 37 LYS O O -19.312 -5.643 -30.536 1.00 . A A . 37 LYS O 1 1 1 291 1 1 38 ASN C C -20.074 -2.747 -28.700 1.00 . A A . 38 ASN C 1 1 1 292 1 1 38 ASN CA C -20.931 -3.922 -29.088 1.00 . A A . 38 ASN CA 1 1 1 293 1 1 38 ASN CB C -22.335 -3.712 -28.475 1.00 . A A . 38 ASN CB 1 1 1 294 1 1 38 ASN CG C -23.285 -4.654 -29.204 1.00 . A A . 38 ASN CG 1 1 1 295 1 1 38 ASN N N -20.353 -5.166 -28.609 1.00 . A A . 38 ASN N 1 1 1 296 1 1 38 ASN ND2 N -24.048 -4.085 -30.172 1.00 . A A . 38 ASN ND2 1 1 1 297 1 1 38 ASN O O -20.030 -1.722 -29.382 1.00 . A A . 38 ASN O 1 1 1 298 1 1 38 ASN OD1 O -23.333 -5.858 -28.945 1.00 . A A . 38 ASN OD1 1 1 1 299 1 1 39 HIS C C -17.165 -1.838 -27.262 1.00 . A A . 39 HIS C 1 1 1 300 1 1 39 HIS CA C -18.640 -1.769 -26.966 1.00 . A A . 39 HIS CA 1 1 1 301 1 1 39 HIS CB C -18.903 -1.698 -25.458 1.00 . A A . 39 HIS CB 1 1 1 302 1 1 39 HIS CD2 C -21.149 -2.759 -24.891 1.00 . A A . 39 HIS CD2 1 1 1 303 1 1 39 HIS CE1 C -22.494 -1.156 -25.337 1.00 . A A . 39 HIS CE1 1 1 1 304 1 1 39 HIS CG C -20.373 -1.700 -25.218 1.00 . A A . 39 HIS CG 1 1 1 305 1 1 39 HIS N N -19.343 -2.872 -27.578 1.00 . A A . 39 HIS N 1 1 1 306 1 1 39 HIS ND1 N -21.238 -0.670 -25.512 1.00 . A A . 39 HIS ND1 1 1 1 307 1 1 39 HIS NE2 N -22.485 -2.422 -24.970 1.00 . A A . 39 HIS NE2 1 1 1 308 1 1 39 HIS O O -16.322 -1.465 -26.451 1.00 . A A . 39 HIS O 1 1 1 309 1 1 40 ARG C C -15.058 -0.727 -29.258 1.00 . A A . 40 ARG C 1 1 1 310 1 1 40 ARG CA C -15.449 -2.176 -29.004 1.00 . A A . 40 ARG CA 1 1 1 311 1 1 40 ARG CB C -15.288 -3.004 -30.298 1.00 . A A . 40 ARG CB 1 1 1 312 1 1 40 ARG CD C -12.737 -2.498 -30.734 1.00 . A A . 40 ARG CD 1 1 1 313 1 1 40 ARG CG C -13.861 -3.533 -30.569 1.00 . A A . 40 ARG CG 1 1 1 314 1 1 40 ARG CZ C -10.368 -2.703 -31.554 1.00 . A A . 40 ARG CZ 1 1 1 315 1 1 40 ARG N N -16.811 -2.261 -28.495 1.00 . A A . 40 ARG N 1 1 1 316 1 1 40 ARG NE N -11.558 -3.250 -31.260 1.00 . A A . 40 ARG NE 1 1 1 317 1 1 40 ARG NH1 N -10.019 -1.457 -31.226 1.00 . A A . 40 ARG NH1 1 1 1 318 1 1 40 ARG NH2 N -9.454 -3.409 -32.231 1.00 . A A . 40 ARG NH2 1 1 1 319 1 1 40 ARG O O -13.961 -0.287 -28.925 1.00 . A A . 40 ARG O 1 1 1 320 1 1 41 HIS C C -15.687 2.363 -28.780 1.00 . A A . 41 HIS C 1 1 1 321 1 1 41 HIS CA C -15.844 1.503 -30.033 1.00 . A A . 41 HIS CA 1 1 1 322 1 1 41 HIS CB C -17.023 2.074 -30.856 1.00 . A A . 41 HIS CB 1 1 1 323 1 1 41 HIS CD2 C -18.699 3.147 -29.231 1.00 . A A . 41 HIS CD2 1 1 1 324 1 1 41 HIS CE1 C -19.829 1.420 -28.674 1.00 . A A . 41 HIS CE1 1 1 1 325 1 1 41 HIS CG C -18.269 2.136 -30.029 1.00 . A A . 41 HIS CG 1 1 1 326 1 1 41 HIS N N -15.999 0.078 -29.800 1.00 . A A . 41 HIS N 1 1 1 327 1 1 41 HIS ND1 N -19.004 1.036 -29.669 1.00 . A A . 41 HIS ND1 1 1 1 328 1 1 41 HIS NE2 N -19.686 2.693 -28.365 1.00 . A A . 41 HIS NE2 1 1 1 329 1 1 41 HIS O O -15.606 3.588 -28.883 1.00 . A A . 41 HIS O 1 1 1 330 1 1 42 ARG C C -13.831 2.459 -26.058 1.00 . A A . 42 ARG C 1 1 1 331 1 1 42 ARG CA C -15.316 2.410 -26.332 1.00 . A A . 42 ARG CA 1 1 1 332 1 1 42 ARG CB C -15.905 1.649 -25.119 1.00 . A A . 42 ARG CB 1 1 1 333 1 1 42 ARG CD C -17.967 3.126 -24.684 1.00 . A A . 42 ARG CD 1 1 1 334 1 1 42 ARG CG C -17.430 1.722 -24.966 1.00 . A A . 42 ARG CG 1 1 1 335 1 1 42 ARG CZ C -18.934 4.946 -26.094 1.00 . A A . 42 ARG CZ 1 1 1 336 1 1 42 ARG N N -15.611 1.740 -27.581 1.00 . A A . 42 ARG N 1 1 1 337 1 1 42 ARG NE N -18.518 3.673 -25.963 1.00 . A A . 42 ARG NE 1 1 1 338 1 1 42 ARG NH1 N -18.580 5.907 -25.243 1.00 . A A . 42 ARG NH1 1 1 1 339 1 1 42 ARG NH2 N -19.769 5.238 -27.105 1.00 . A A . 42 ARG NH2 1 1 1 340 1 1 42 ARG O O -13.423 3.094 -25.088 1.00 . A A . 42 ARG O 1 1 1 341 1 1 43 TYR C C -10.898 1.708 -28.021 1.00 . A A . 43 TYR C 1 1 1 342 1 1 43 TYR CA C -11.573 1.832 -26.670 1.00 . A A . 43 TYR CA 1 1 1 343 1 1 43 TYR CB C -11.072 0.771 -25.636 1.00 . A A . 43 TYR CB 1 1 1 344 1 1 43 TYR CD1 C -12.598 -1.264 -25.749 1.00 . A A . 43 TYR CD1 1 1 1 345 1 1 43 TYR CD2 C -10.435 -1.350 -26.828 1.00 . A A . 43 TYR CD2 1 1 1 346 1 1 43 TYR CE1 C -12.881 -2.557 -26.214 1.00 . A A . 43 TYR CE1 1 1 1 347 1 1 43 TYR CE2 C -10.719 -2.628 -27.314 1.00 . A A . 43 TYR CE2 1 1 1 348 1 1 43 TYR CG C -11.377 -0.643 -26.065 1.00 . A A . 43 TYR CG 1 1 1 349 1 1 43 TYR CZ C -11.943 -3.232 -27.005 1.00 . A A . 43 TYR CZ 1 1 1 350 1 1 43 TYR N N -12.998 1.783 -26.871 1.00 . A A . 43 TYR N 1 1 1 351 1 1 43 TYR O O -11.539 1.417 -29.033 1.00 . A A . 43 TYR O 1 1 1 352 1 1 43 TYR OH O -12.201 -4.520 -27.508 1.00 . A A . 43 TYR OH 1 1 1 353 1 1 44 GLU C C -7.867 0.557 -28.813 1.00 . A A . 44 GLU C 1 1 1 354 1 1 44 GLU CA C -8.703 1.758 -29.164 1.00 . A A . 44 GLU CA 1 1 1 355 1 1 44 GLU CB C -7.821 3.002 -29.397 1.00 . A A . 44 GLU CB 1 1 1 356 1 1 44 GLU CD C -7.775 5.469 -29.824 1.00 . A A . 44 GLU CD 1 1 1 357 1 1 44 GLU CG C -8.661 4.236 -29.788 1.00 . A A . 44 GLU CG 1 1 1 358 1 1 44 GLU N N -9.573 1.965 -28.036 1.00 . A A . 44 GLU N 1 1 1 359 1 1 44 GLU O O -8.041 -0.521 -29.369 1.00 . A A . 44 GLU O 1 1 1 360 1 1 44 GLU OE1 O -6.923 5.570 -30.744 1.00 . A A . 44 GLU OE1 1 1 1 361 1 1 44 GLU OE2 O -7.943 6.315 -28.907 1.00 . A A . 44 GLU OE2 1 1 1 362 1 1 45 ASN C C -6.433 -0.589 -25.823 1.00 . A A . 45 ASN C 1 1 1 363 1 1 45 ASN CA C -6.175 -0.394 -27.305 1.00 . A A . 45 ASN CA 1 1 1 364 1 1 45 ASN CB C -4.670 -0.150 -27.603 1.00 . A A . 45 ASN CB 1 1 1 365 1 1 45 ASN CG C -4.453 -0.369 -29.100 1.00 . A A . 45 ASN CG 1 1 1 366 1 1 45 ASN N N -6.988 0.695 -27.802 1.00 . A A . 45 ASN N 1 1 1 367 1 1 45 ASN ND2 N -3.423 0.265 -29.718 1.00 . A A . 45 ASN ND2 1 1 1 368 1 1 45 ASN O O -6.918 0.292 -25.112 1.00 . A A . 45 ASN O 1 1 1 369 1 1 45 ASN OD1 O -5.168 -1.157 -29.717 1.00 . A A . 45 ASN OD1 1 1 1 370 1 1 46 CYS C C -5.301 -3.247 -23.655 1.00 . A A . 46 CYS C 1 1 1 371 1 1 46 CYS CA C -6.289 -2.137 -23.935 1.00 . A A . 46 CYS CA 1 1 1 372 1 1 46 CYS CB C -7.732 -2.567 -23.543 1.00 . A A . 46 CYS CB 1 1 1 373 1 1 46 CYS N N -6.178 -1.814 -25.331 1.00 . A A . 46 CYS N 1 1 1 374 1 1 46 CYS O O -4.686 -3.793 -24.570 1.00 . A A . 46 CYS O 1 1 1 375 1 1 46 CYS SG S -8.320 -4.106 -24.336 1.00 . A A . 46 CYS SG 1 1 1 376 1 1 47 THR C C -5.051 -6.086 -21.978 1.00 . A A . 47 THR C 1 1 1 377 1 1 47 THR CA C -4.335 -4.736 -21.927 1.00 . A A . 47 THR CA 1 1 1 378 1 1 47 THR CB C -3.869 -4.480 -20.489 1.00 . A A . 47 THR CB 1 1 1 379 1 1 47 THR CG2 C -2.946 -3.257 -20.505 1.00 . A A . 47 THR CG2 1 1 1 380 1 1 47 THR N N -5.169 -3.631 -22.379 1.00 . A A . 47 THR N 1 1 1 381 1 1 47 THR O O -6.089 -6.281 -22.625 1.00 . A A . 47 THR O 1 1 1 382 1 1 47 THR OG1 O -4.974 -4.206 -19.622 1.00 . A A . 47 THR OG1 1 1 1 383 1 1 48 THR C C -5.833 -7.816 -19.409 1.00 . A A . 48 THR C 1 1 1 384 1 1 48 THR CA C -5.198 -8.239 -20.719 1.00 . A A . 48 THR CA 1 1 1 385 1 1 48 THR CB C -4.197 -9.375 -20.432 1.00 . A A . 48 THR CB 1 1 1 386 1 1 48 THR CG2 C -3.490 -9.744 -21.747 1.00 . A A . 48 THR CG2 1 1 1 387 1 1 48 THR N N -4.518 -7.055 -21.197 1.00 . A A . 48 THR N 1 1 1 388 1 1 48 THR O O -6.071 -6.627 -19.182 1.00 . A A . 48 THR O 1 1 1 389 1 1 48 THR OG1 O -3.181 -8.991 -19.496 1.00 . A A . 48 THR OG1 1 1 1 390 1 1 49 THR C C -4.864 -8.666 -16.481 1.00 . A A . 49 THR C 1 1 1 391 1 1 49 THR CA C -6.231 -8.472 -17.078 1.00 . A A . 49 THR CA 1 1 1 392 1 1 49 THR CB C -7.200 -9.435 -16.398 1.00 . A A . 49 THR CB 1 1 1 393 1 1 49 THR CG2 C -8.625 -9.036 -16.780 1.00 . A A . 49 THR CG2 1 1 1 394 1 1 49 THR N N -6.023 -8.766 -18.474 1.00 . A A . 49 THR N 1 1 1 395 1 1 49 THR O O -4.072 -9.473 -16.980 1.00 . A A . 49 THR O 1 1 1 396 1 1 49 THR OG1 O -7.029 -10.773 -16.850 1.00 . A A . 49 THR OG1 1 1 1 397 1 1 50 TRP C C -3.549 -7.666 -13.295 1.00 . A A . 50 TRP C 1 1 1 398 1 1 50 TRP CA C -3.287 -7.987 -14.745 1.00 . A A . 50 TRP CA 1 1 1 399 1 1 50 TRP CB C -2.080 -7.227 -15.363 1.00 . A A . 50 TRP CB 1 1 1 400 1 1 50 TRP CD1 C -3.046 -5.321 -16.828 1.00 . A A . 50 TRP CD1 1 1 1 401 1 1 50 TRP CD2 C -1.806 -4.632 -15.085 1.00 . A A . 50 TRP CD2 1 1 1 402 1 1 50 TRP CE2 C -2.260 -3.502 -15.800 1.00 . A A . 50 TRP CE2 1 1 1 403 1 1 50 TRP CE3 C -1.005 -4.495 -13.953 1.00 . A A . 50 TRP CE3 1 1 1 404 1 1 50 TRP CG C -2.330 -5.788 -15.762 1.00 . A A . 50 TRP CG 1 1 1 405 1 1 50 TRP CH2 C -1.127 -2.073 -14.253 1.00 . A A . 50 TRP CH2 1 1 1 406 1 1 50 TRP CZ2 C -1.928 -2.220 -15.391 1.00 . A A . 50 TRP CZ2 1 1 1 407 1 1 50 TRP CZ3 C -0.671 -3.195 -13.545 1.00 . A A . 50 TRP CZ3 1 1 1 408 1 1 50 TRP N N -4.519 -7.830 -15.483 1.00 . A A . 50 TRP N 1 1 1 409 1 1 50 TRP NE1 N -3.022 -3.949 -16.855 1.00 . A A . 50 TRP NE1 1 1 1 410 1 1 50 TRP O O -4.674 -7.340 -12.904 1.00 . A A . 50 TRP O 1 1 1 411 1 1 51 PHE C C -1.409 -6.885 -10.635 1.00 . A A . 51 PHE C 1 1 1 412 1 1 51 PHE CA C -2.613 -7.692 -11.027 1.00 . A A . 51 PHE CA 1 1 1 413 1 1 51 PHE CB C -2.536 -9.081 -10.329 1.00 . A A . 51 PHE CB 1 1 1 414 1 1 51 PHE CD1 C -4.951 -9.794 -10.498 1.00 . A A . 51 PHE CD1 1 1 1 415 1 1 51 PHE CD2 C -3.305 -10.994 -11.803 1.00 . A A . 51 PHE CD2 1 1 1 416 1 1 51 PHE CE1 C -5.971 -10.571 -11.060 1.00 . A A . 51 PHE CE1 1 1 1 417 1 1 51 PHE CE2 C -4.322 -11.781 -12.362 1.00 . A A . 51 PHE CE2 1 1 1 418 1 1 51 PHE CG C -3.612 -9.983 -10.875 1.00 . A A . 51 PHE CG 1 1 1 419 1 1 51 PHE CZ C -5.658 -11.564 -11.999 1.00 . A A . 51 PHE CZ 1 1 1 420 1 1 51 PHE N N -2.508 -7.786 -12.455 1.00 . A A . 51 PHE N 1 1 1 421 1 1 51 PHE O O -0.393 -6.898 -11.332 1.00 . A A . 51 PHE O 1 1 1 422 1 1 52 THR C C -0.069 -6.053 -7.646 1.00 . A A . 52 THR C 1 1 1 423 1 1 52 THR CA C -0.376 -5.415 -8.980 1.00 . A A . 52 THR CA 1 1 1 424 1 1 52 THR CB C -0.641 -3.911 -8.895 1.00 . A A . 52 THR CB 1 1 1 425 1 1 52 THR CG2 C 0.564 -3.166 -8.291 1.00 . A A . 52 THR CG2 1 1 1 426 1 1 52 THR N N -1.497 -6.171 -9.500 1.00 . A A . 52 THR N 1 1 1 427 1 1 52 THR O O -0.968 -6.554 -6.969 1.00 . A A . 52 THR O 1 1 1 428 1 1 52 THR OG1 O -0.802 -3.399 -10.216 1.00 . A A . 52 THR OG1 1 1 1 429 1 1 53 VAL C C 1.764 -5.434 -5.005 1.00 . A A . 53 VAL C 1 1 1 430 1 1 53 VAL CA C 1.703 -6.583 -6.000 1.00 . A A . 53 VAL CA 1 1 1 431 1 1 53 VAL CB C 3.053 -7.298 -6.076 1.00 . A A . 53 VAL CB 1 1 1 432 1 1 53 VAL CG1 C 2.950 -8.480 -7.062 1.00 . A A . 53 VAL CG1 1 1 1 433 1 1 53 VAL CG2 C 4.185 -6.341 -6.494 1.00 . A A . 53 VAL CG2 1 1 1 434 1 1 53 VAL N N 1.229 -6.117 -7.282 1.00 . A A . 53 VAL N 1 1 1 435 1 1 53 VAL O O 1.966 -4.274 -5.378 1.00 . A A . 53 VAL O 1 1 1 436 1 1 54 ALA C C 3.305 -4.970 -2.159 1.00 . A A . 54 ALA C 1 1 1 437 1 1 54 ALA CA C 1.853 -4.855 -2.603 1.00 . A A . 54 ALA CA 1 1 1 438 1 1 54 ALA CB C 0.921 -5.182 -1.416 1.00 . A A . 54 ALA CB 1 1 1 439 1 1 54 ALA N N 1.589 -5.760 -3.703 1.00 . A A . 54 ALA N 1 1 1 440 1 1 54 ALA O O 4.046 -5.825 -2.646 1.00 . A A . 54 ALA O 1 1 1 441 1 1 55 ASP C C 5.139 -5.196 0.487 1.00 . A A . 55 ASP C 1 1 1 442 1 1 55 ASP CA C 5.094 -4.216 -0.685 1.00 . A A . 55 ASP CA 1 1 1 443 1 1 55 ASP CB C 5.639 -2.796 -0.328 1.00 . A A . 55 ASP CB 1 1 1 444 1 1 55 ASP CG C 7.094 -2.853 0.124 1.00 . A A . 55 ASP CG 1 1 1 445 1 1 55 ASP N N 3.739 -4.135 -1.189 1.00 . A A . 55 ASP N 1 1 1 446 1 1 55 ASP O O 5.697 -6.286 0.390 1.00 . A A . 55 ASP O 1 1 1 447 1 1 55 ASP OD1 O 7.352 -3.417 1.221 1.00 . A A . 55 ASP OD1 1 1 1 448 1 1 55 ASP OD2 O 7.989 -2.420 -0.650 1.00 . A A . 55 ASP OD2 1 1 1 449 1 1 56 ASN C C 4.129 -6.641 3.287 1.00 . A A . 56 ASN C 1 1 1 450 1 1 56 ASN CA C 4.969 -5.424 2.917 1.00 . A A . 56 ASN CA 1 1 1 451 1 1 56 ASN CB C 4.921 -4.349 4.044 1.00 . A A . 56 ASN CB 1 1 1 452 1 1 56 ASN CG C 6.291 -4.119 4.689 1.00 . A A . 56 ASN CG 1 1 1 453 1 1 56 ASN N N 4.588 -4.810 1.656 1.00 . A A . 56 ASN N 1 1 1 454 1 1 56 ASN ND2 N 7.328 -3.786 3.879 1.00 . A A . 56 ASN ND2 1 1 1 455 1 1 56 ASN O O 4.657 -7.645 3.765 1.00 . A A . 56 ASN O 1 1 1 456 1 1 56 ASN OD1 O 6.422 -4.198 5.912 1.00 . A A . 56 ASN OD1 1 1 1 457 1 1 57 GLY C C 2.122 -8.731 2.144 1.00 . A A . 57 GLY C 1 1 1 458 1 1 57 GLY CA C 1.940 -7.762 3.282 1.00 . A A . 57 GLY CA 1 1 1 459 1 1 57 GLY N N 2.791 -6.594 3.098 1.00 . A A . 57 GLY N 1 1 1 460 1 1 57 GLY O O 2.479 -8.313 1.046 1.00 . A A . 57 GLY O 1 1 1 461 1 1 58 ALA C C 0.969 -10.965 0.155 1.00 . A A . 58 ALA C 1 1 1 462 1 1 58 ALA CA C 1.991 -11.060 1.297 1.00 . A A . 58 ALA CA 1 1 1 463 1 1 58 ALA CB C 1.885 -12.456 1.947 1.00 . A A . 58 ALA CB 1 1 1 464 1 1 58 ALA N N 1.827 -10.042 2.334 1.00 . A A . 58 ALA N 1 1 1 465 1 1 58 ALA O O 0.511 -11.964 -0.410 1.00 . A A . 58 ALA O 1 1 1 466 1 1 59 GLU C C -0.296 -8.963 -2.377 1.00 . A A . 59 GLU C 1 1 1 467 1 1 59 GLU CA C -0.575 -9.435 -0.988 1.00 . A A . 59 GLU CA 1 1 1 468 1 1 59 GLU CB C -1.565 -8.460 -0.305 1.00 . A A . 59 GLU CB 1 1 1 469 1 1 59 GLU CD C -3.662 -9.955 -0.580 1.00 . A A . 59 GLU CD 1 1 1 470 1 1 59 GLU CG C -2.733 -9.196 0.384 1.00 . A A . 59 GLU CG 1 1 1 471 1 1 59 GLU N N 0.580 -9.729 -0.199 1.00 . A A . 59 GLU N 1 1 1 472 1 1 59 GLU O O 0.744 -8.414 -2.743 1.00 . A A . 59 GLU O 1 1 1 473 1 1 59 GLU OE1 O -3.368 -10.076 -1.801 1.00 . A A . 59 GLU OE1 1 1 1 474 1 1 59 GLU OE2 O -4.692 -10.447 -0.062 1.00 . A A . 59 GLU OE2 1 1 1 475 1 1 60 ARG C C -2.720 -7.808 -4.421 1.00 . A A . 60 ARG C 1 1 1 476 1 1 60 ARG CA C -1.490 -8.691 -4.510 1.00 . A A . 60 ARG CA 1 1 1 477 1 1 60 ARG CB C -1.712 -9.892 -5.485 1.00 . A A . 60 ARG CB 1 1 1 478 1 1 60 ARG CD C 0.636 -11.059 -5.064 1.00 . A A . 60 ARG CD 1 1 1 479 1 1 60 ARG CG C -0.448 -10.589 -6.051 1.00 . A A . 60 ARG CG 1 1 1 480 1 1 60 ARG CZ C 0.445 -13.191 -3.713 1.00 . A A . 60 ARG CZ 1 1 1 481 1 1 60 ARG N N -1.331 -9.180 -3.180 1.00 . A A . 60 ARG N 1 1 1 482 1 1 60 ARG NE N 0.037 -11.940 -4.004 1.00 . A A . 60 ARG NE 1 1 1 483 1 1 60 ARG NH1 N 0.990 -13.976 -4.652 1.00 . A A . 60 ARG NH1 1 1 1 484 1 1 60 ARG NH2 N 0.317 -13.654 -2.462 1.00 . A A . 60 ARG NH2 1 1 1 485 1 1 60 ARG O O -3.252 -7.517 -3.354 1.00 . A A . 60 ARG O 1 1 1 486 1 1 61 GLN C C -5.241 -8.331 -6.320 1.00 . A A . 61 GLN C 1 1 1 487 1 1 61 GLN CA C -4.626 -7.072 -5.764 1.00 . A A . 61 GLN CA 1 1 1 488 1 1 61 GLN CB C -4.806 -5.918 -6.789 1.00 . A A . 61 GLN CB 1 1 1 489 1 1 61 GLN CD C -3.780 -4.261 -5.156 1.00 . A A . 61 GLN CD 1 1 1 490 1 1 61 GLN CG C -4.918 -4.521 -6.142 1.00 . A A . 61 GLN CG 1 1 1 491 1 1 61 GLN N N -3.245 -7.429 -5.589 1.00 . A A . 61 GLN N 1 1 1 492 1 1 61 GLN NE2 N -4.121 -4.307 -3.847 1.00 . A A . 61 GLN NE2 1 1 1 493 1 1 61 GLN O O -4.731 -8.923 -7.269 1.00 . A A . 61 GLN O 1 1 1 494 1 1 61 GLN OE1 O -2.613 -4.077 -5.507 1.00 . A A . 61 GLN OE1 1 1 1 495 1 1 62 GLY C C -7.941 -9.567 -7.350 1.00 . A A . 62 GLY C 1 1 1 496 1 1 62 GLY CA C -7.113 -9.945 -6.155 1.00 . A A . 62 GLY CA 1 1 1 497 1 1 62 GLY N N -6.332 -8.809 -5.678 1.00 . A A . 62 GLY N 1 1 1 498 1 1 62 GLY O O -8.205 -10.367 -8.241 1.00 . A A . 62 GLY O 1 1 1 499 1 1 63 GLN C C -8.167 -7.493 -9.673 1.00 . A A . 63 GLN C 1 1 1 500 1 1 63 GLN CA C -9.008 -7.575 -8.414 1.00 . A A . 63 GLN CA 1 1 1 501 1 1 63 GLN CB C -9.369 -6.145 -7.940 1.00 . A A . 63 GLN CB 1 1 1 502 1 1 63 GLN CD C -9.937 -6.443 -5.412 1.00 . A A . 63 GLN CD 1 1 1 503 1 1 63 GLN CG C -10.443 -6.099 -6.822 1.00 . A A . 63 GLN CG 1 1 1 504 1 1 63 GLN N N -8.371 -8.292 -7.355 1.00 . A A . 63 GLN N 1 1 1 505 1 1 63 GLN NE2 N -10.881 -6.410 -4.439 1.00 . A A . 63 GLN NE2 1 1 1 506 1 1 63 GLN O O -6.952 -7.283 -9.660 1.00 . A A . 63 GLN O 1 1 1 507 1 1 63 GLN OE1 O -8.764 -6.748 -5.172 1.00 . A A . 63 GLN OE1 1 1 1 508 1 1 64 ALA C C -8.198 -6.277 -12.636 1.00 . A A . 64 ALA C 1 1 1 509 1 1 64 ALA CA C -8.276 -7.692 -12.123 1.00 . A A . 64 ALA CA 1 1 1 510 1 1 64 ALA CB C -9.125 -8.557 -13.067 1.00 . A A . 64 ALA CB 1 1 1 511 1 1 64 ALA N N -8.857 -7.669 -10.813 1.00 . A A . 64 ALA N 1 1 1 512 1 1 64 ALA O O -9.197 -5.623 -12.925 1.00 . A A . 64 ALA O 1 1 1 513 1 1 65 GLN C C -6.505 -4.230 -14.483 1.00 . A A . 65 GLN C 1 1 1 514 1 1 65 GLN CA C -6.665 -4.395 -12.993 1.00 . A A . 65 GLN CA 1 1 1 515 1 1 65 GLN CB C -5.366 -4.112 -12.204 1.00 . A A . 65 GLN CB 1 1 1 516 1 1 65 GLN CD C -4.182 -2.485 -10.702 1.00 . A A . 65 GLN CD 1 1 1 517 1 1 65 GLN CG C -5.010 -2.632 -11.982 1.00 . A A . 65 GLN CG 1 1 1 518 1 1 65 GLN N N -6.968 -5.767 -12.737 1.00 . A A . 65 GLN N 1 1 1 519 1 1 65 GLN NE2 N -4.816 -2.783 -9.541 1.00 . A A . 65 GLN NE2 1 1 1 520 1 1 65 GLN O O -5.442 -4.490 -15.035 1.00 . A A . 65 GLN O 1 1 1 521 1 1 65 GLN OE1 O -3.003 -2.117 -10.713 1.00 . A A . 65 GLN OE1 1 1 1 522 1 1 66 ILE C C -7.087 -2.231 -16.964 1.00 . A A . 66 ILE C 1 1 1 523 1 1 66 ILE CA C -7.475 -3.660 -16.654 1.00 . A A . 66 ILE CA 1 1 1 524 1 1 66 ILE CB C -8.695 -4.067 -17.479 1.00 . A A . 66 ILE CB 1 1 1 525 1 1 66 ILE CD1 C -11.191 -3.684 -17.960 1.00 . A A . 66 ILE CD1 1 1 1 526 1 1 66 ILE CG1 C -9.994 -3.349 -17.063 1.00 . A A . 66 ILE CG1 1 1 1 527 1 1 66 ILE CG2 C -8.847 -5.591 -17.379 1.00 . A A . 66 ILE CG2 1 1 1 528 1 1 66 ILE N N -7.584 -3.866 -15.212 1.00 . A A . 66 ILE N 1 1 1 529 1 1 66 ILE O O -7.442 -1.306 -16.236 1.00 . A A . 66 ILE O 1 1 1 530 1 1 67 LEU C C -6.493 -0.434 -19.847 1.00 . A A . 67 LEU C 1 1 1 531 1 1 67 LEU CA C -5.928 -0.681 -18.456 1.00 . A A . 67 LEU CA 1 1 1 532 1 1 67 LEU CB C -4.382 -0.615 -18.347 1.00 . A A . 67 LEU CB 1 1 1 533 1 1 67 LEU CD1 C -2.293 0.710 -17.834 1.00 . A A . 67 LEU CD1 1 1 1 534 1 1 67 LEU CD2 C -3.559 1.211 -19.943 1.00 . A A . 67 LEU CD2 1 1 1 535 1 1 67 LEU CG C -3.689 0.755 -18.485 1.00 . A A . 67 LEU CG 1 1 1 536 1 1 67 LEU N N -6.342 -2.010 -18.065 1.00 . A A . 67 LEU N 1 1 1 537 1 1 67 LEU O O -6.366 -1.281 -20.731 1.00 . A A . 67 LEU O 1 1 1 538 1 1 68 ILE C C -7.493 2.391 -21.753 1.00 . A A . 68 ILE C 1 1 1 539 1 1 68 ILE CA C -7.943 1.030 -21.261 1.00 . A A . 68 ILE CA 1 1 1 540 1 1 68 ILE CB C -9.462 0.975 -21.010 1.00 . A A . 68 ILE CB 1 1 1 541 1 1 68 ILE CD1 C -11.456 -0.680 -21.047 1.00 . A A . 68 ILE CD1 1 1 1 542 1 1 68 ILE CG1 C -9.967 -0.450 -21.330 1.00 . A A . 68 ILE CG1 1 1 1 543 1 1 68 ILE CG2 C -10.271 2.064 -21.764 1.00 . A A . 68 ILE CG2 1 1 1 544 1 1 68 ILE N N -7.204 0.706 -20.041 1.00 . A A . 68 ILE N 1 1 1 545 1 1 68 ILE O O -7.592 3.373 -21.021 1.00 . A A . 68 ILE O 1 1 1 546 1 1 69 THR C C -7.215 4.231 -24.730 1.00 . A A . 69 THR C 1 1 1 547 1 1 69 THR CA C -6.366 3.668 -23.600 1.00 . A A . 69 THR CA 1 1 1 548 1 1 69 THR CB C -4.958 3.453 -24.152 1.00 . A A . 69 THR CB 1 1 1 549 1 1 69 THR CG2 C -4.014 3.115 -22.986 1.00 . A A . 69 THR CG2 1 1 1 550 1 1 69 THR N N -6.940 2.472 -22.993 1.00 . A A . 69 THR N 1 1 1 551 1 1 69 THR O O -7.219 3.675 -25.831 1.00 . A A . 69 THR O 1 1 1 552 1 1 69 THR OG1 O -4.920 2.388 -25.094 1.00 . A A . 69 THR OG1 1 1 1 553 1 1 70 PHE C C -8.015 7.504 -25.654 1.00 . A A . 70 PHE C 1 1 1 554 1 1 70 PHE CA C -8.647 6.128 -25.474 1.00 . A A . 70 PHE CA 1 1 1 555 1 1 70 PHE CB C -10.164 6.276 -25.126 1.00 . A A . 70 PHE CB 1 1 1 556 1 1 70 PHE CD1 C -10.254 7.886 -23.152 1.00 . A A . 70 PHE CD1 1 1 1 557 1 1 70 PHE CD2 C -10.864 5.571 -22.807 1.00 . A A . 70 PHE CD2 1 1 1 558 1 1 70 PHE CE1 C -10.442 8.144 -21.787 1.00 . A A . 70 PHE CE1 1 1 1 559 1 1 70 PHE CE2 C -11.072 5.830 -21.446 1.00 . A A . 70 PHE CE2 1 1 1 560 1 1 70 PHE CG C -10.429 6.590 -23.671 1.00 . A A . 70 PHE CG 1 1 1 561 1 1 70 PHE CZ C -10.841 7.111 -20.930 1.00 . A A . 70 PHE CZ 1 1 1 562 1 1 70 PHE N N -7.916 5.361 -24.491 1.00 . A A . 70 PHE N 1 1 1 563 1 1 70 PHE O O -7.562 8.150 -24.706 1.00 . A A . 70 PHE O 1 1 1 564 1 1 71 GLY C C -9.063 10.182 -27.015 1.00 . A A . 71 GLY C 1 1 1 565 1 1 71 GLY CA C -7.828 9.371 -27.274 1.00 . A A . 71 GLY CA 1 1 1 566 1 1 71 GLY N N -7.987 7.976 -26.920 1.00 . A A . 71 GLY N 1 1 1 567 1 1 71 GLY O O -8.999 11.308 -26.531 1.00 . A A . 71 GLY O 1 1 1 568 1 1 72 SER C C -12.014 10.570 -25.894 1.00 . A A . 72 SER C 1 1 1 569 1 1 72 SER CA C -11.499 10.400 -27.311 1.00 . A A . 72 SER CA 1 1 1 570 1 1 72 SER CB C -12.677 9.807 -28.136 1.00 . A A . 72 SER CB 1 1 1 571 1 1 72 SER N N -10.250 9.649 -27.384 1.00 . A A . 72 SER N 1 1 1 572 1 1 72 SER O O -12.272 9.553 -25.245 1.00 . A A . 72 SER O 1 1 1 573 1 1 72 SER OG O -12.414 9.846 -29.536 1.00 . A A . 72 SER OG 1 1 1 574 1 1 73 PRO C C -14.501 11.597 -24.375 1.00 . A A . 73 PRO C 1 1 1 575 1 1 73 PRO CA C -13.046 11.942 -24.148 1.00 . A A . 73 PRO CA 1 1 1 576 1 1 73 PRO CB C -12.871 13.422 -23.774 1.00 . A A . 73 PRO CB 1 1 1 577 1 1 73 PRO CD C -11.847 13.071 -25.922 1.00 . A A . 73 PRO CD 1 1 1 578 1 1 73 PRO CG C -12.602 14.127 -25.109 1.00 . A A . 73 PRO CG 1 1 1 579 1 1 73 PRO N N -12.288 11.781 -25.379 1.00 . A A . 73 PRO N 1 1 1 580 1 1 73 PRO O O -15.218 11.348 -23.409 1.00 . A A . 73 PRO O 1 1 1 581 1 1 74 SER C C -16.503 9.620 -25.631 1.00 . A A . 74 SER C 1 1 1 582 1 1 74 SER CA C -16.284 11.058 -26.001 1.00 . A A . 74 SER CA 1 1 1 583 1 1 74 SER CB C -16.623 11.235 -27.501 1.00 . A A . 74 SER CB 1 1 1 584 1 1 74 SER N N -14.964 11.542 -25.643 1.00 . A A . 74 SER N 1 1 1 585 1 1 74 SER O O -17.578 9.201 -25.232 1.00 . A A . 74 SER O 1 1 1 586 1 1 74 SER OG O -16.171 12.508 -27.952 1.00 . A A . 74 SER OG 1 1 1 587 1 1 75 GLN C C -15.757 7.299 -23.753 1.00 . A A . 75 GLN C 1 1 1 588 1 1 75 GLN CA C -15.499 7.430 -25.253 1.00 . A A . 75 GLN CA 1 1 1 589 1 1 75 GLN CB C -14.282 6.655 -25.791 1.00 . A A . 75 GLN CB 1 1 1 590 1 1 75 GLN CD C -13.242 6.029 -28.072 1.00 . A A . 75 GLN CD 1 1 1 591 1 1 75 GLN CG C -14.519 6.350 -27.293 1.00 . A A . 75 GLN CG 1 1 1 592 1 1 75 GLN N N -15.449 8.811 -25.686 1.00 . A A . 75 GLN N 1 1 1 593 1 1 75 GLN NE2 N -13.394 5.292 -29.199 1.00 . A A . 75 GLN NE2 1 1 1 594 1 1 75 GLN O O -16.630 6.518 -23.365 1.00 . A A . 75 GLN O 1 1 1 595 1 1 75 GLN OE1 O -12.148 6.469 -27.727 1.00 . A A . 75 GLN OE1 1 1 1 596 1 1 76 ARG C C -16.534 8.892 -21.078 1.00 . A A . 76 ARG C 1 1 1 597 1 1 76 ARG CA C -15.203 8.304 -21.492 1.00 . A A . 76 ARG CA 1 1 1 598 1 1 76 ARG CB C -14.089 9.266 -20.958 1.00 . A A . 76 ARG CB 1 1 1 599 1 1 76 ARG CD C -12.849 10.336 -18.900 1.00 . A A . 76 ARG CD 1 1 1 600 1 1 76 ARG CG C -14.003 9.437 -19.418 1.00 . A A . 76 ARG CG 1 1 1 601 1 1 76 ARG CZ C -12.549 12.704 -18.067 1.00 . A A . 76 ARG CZ 1 1 1 602 1 1 76 ARG N N -15.065 8.136 -22.933 1.00 . A A . 76 ARG N 1 1 1 603 1 1 76 ARG NE N -13.331 11.739 -18.607 1.00 . A A . 76 ARG NE 1 1 1 604 1 1 76 ARG NH1 N -11.250 12.498 -17.819 1.00 . A A . 76 ARG NH1 1 1 1 605 1 1 76 ARG NH2 N -13.040 13.917 -17.759 1.00 . A A . 76 ARG NH2 1 1 1 606 1 1 76 ARG O O -17.099 8.523 -20.052 1.00 . A A . 76 ARG O 1 1 1 607 1 1 77 GLN C C -19.519 9.945 -22.039 1.00 . A A . 77 GLN C 1 1 1 608 1 1 77 GLN CA C -18.258 10.590 -21.503 1.00 . A A . 77 GLN CA 1 1 1 609 1 1 77 GLN CB C -18.125 12.067 -21.935 1.00 . A A . 77 GLN CB 1 1 1 610 1 1 77 GLN CD C -18.414 14.384 -20.985 1.00 . A A . 77 GLN CD 1 1 1 611 1 1 77 GLN CG C -19.071 13.017 -21.169 1.00 . A A . 77 GLN CG 1 1 1 612 1 1 77 GLN N N -17.063 9.852 -21.858 1.00 . A A . 77 GLN N 1 1 1 613 1 1 77 GLN NE2 N -18.782 15.383 -21.822 1.00 . A A . 77 GLN NE2 1 1 1 614 1 1 77 GLN O O -20.501 9.804 -21.314 1.00 . A A . 77 GLN O 1 1 1 615 1 1 77 GLN OE1 O -17.563 14.547 -20.106 1.00 . A A . 77 GLN OE1 1 1 1 616 1 1 78 ASP C C -20.666 7.290 -23.299 1.00 . A A . 78 ASP C 1 1 1 617 1 1 78 ASP CA C -20.624 8.705 -23.864 1.00 . A A . 78 ASP CA 1 1 1 618 1 1 78 ASP CB C -20.627 8.688 -25.419 1.00 . A A . 78 ASP CB 1 1 1 619 1 1 78 ASP CG C -20.892 10.090 -25.943 1.00 . A A . 78 ASP CG 1 1 1 620 1 1 78 ASP N N -19.521 9.469 -23.311 1.00 . A A . 78 ASP N 1 1 1 621 1 1 78 ASP O O -21.614 6.543 -23.547 1.00 . A A . 78 ASP O 1 1 1 622 1 1 78 ASP OD1 O -22.032 10.578 -25.711 1.00 . A A . 78 ASP OD1 1 1 1 623 1 1 78 ASP OD2 O -19.981 10.694 -26.563 1.00 . A A . 78 ASP OD2 1 1 1 624 1 1 79 PHE C C -20.868 5.333 -21.046 1.00 . A A . 79 PHE C 1 1 1 625 1 1 79 PHE CA C -19.557 5.692 -21.697 1.00 . A A . 79 PHE CA 1 1 1 626 1 1 79 PHE CB C -18.421 5.887 -20.648 1.00 . A A . 79 PHE CB 1 1 1 627 1 1 79 PHE CD1 C -18.342 3.403 -20.006 1.00 . A A . 79 PHE CD1 1 1 1 628 1 1 79 PHE CD2 C -16.688 4.929 -19.138 1.00 . A A . 79 PHE CD2 1 1 1 629 1 1 79 PHE CE1 C -17.764 2.361 -19.275 1.00 . A A . 79 PHE CE1 1 1 1 630 1 1 79 PHE CE2 C -16.082 3.882 -18.430 1.00 . A A . 79 PHE CE2 1 1 1 631 1 1 79 PHE CG C -17.831 4.703 -19.931 1.00 . A A . 79 PHE CG 1 1 1 632 1 1 79 PHE CZ C -16.632 2.595 -18.490 1.00 . A A . 79 PHE CZ 1 1 1 633 1 1 79 PHE N N -19.656 6.918 -22.470 1.00 . A A . 79 PHE N 1 1 1 634 1 1 79 PHE O O -21.425 4.292 -21.367 1.00 . A A . 79 PHE O 1 1 1 635 1 1 80 LEU C C -23.898 5.699 -20.167 1.00 . A A . 80 LEU C 1 1 1 636 1 1 80 LEU CA C -22.605 5.919 -19.403 1.00 . A A . 80 LEU CA 1 1 1 637 1 1 80 LEU CB C -22.781 7.025 -18.339 1.00 . A A . 80 LEU CB 1 1 1 638 1 1 80 LEU CD1 C -21.846 5.779 -16.327 1.00 . A A . 80 LEU CD1 1 1 1 639 1 1 80 LEU CD2 C -23.615 7.552 -16.001 1.00 . A A . 80 LEU CD2 1 1 1 640 1 1 80 LEU CG C -23.083 6.458 -16.941 1.00 . A A . 80 LEU CG 1 1 1 641 1 1 80 LEU N N -21.434 6.208 -20.194 1.00 . A A . 80 LEU N 1 1 1 642 1 1 80 LEU O O -24.827 5.057 -19.686 1.00 . A A . 80 LEU O 1 1 1 643 1 1 81 LYS C C -24.954 4.599 -22.925 1.00 . A A . 81 LYS C 1 1 1 644 1 1 81 LYS CA C -25.036 6.000 -22.347 1.00 . A A . 81 LYS CA 1 1 1 645 1 1 81 LYS CB C -24.962 7.003 -23.526 1.00 . A A . 81 LYS CB 1 1 1 646 1 1 81 LYS CD C -24.483 9.435 -24.008 1.00 . A A . 81 LYS CD 1 1 1 647 1 1 81 LYS CE C -25.034 10.859 -24.097 1.00 . A A . 81 LYS CE 1 1 1 648 1 1 81 LYS CG C -25.328 8.452 -23.179 1.00 . A A . 81 LYS CG 1 1 1 649 1 1 81 LYS N N -23.958 6.230 -21.400 1.00 . A A . 81 LYS N 1 1 1 650 1 1 81 LYS NZ N -24.046 11.758 -24.735 1.00 . A A . 81 LYS NZ 1 1 1 651 1 1 81 LYS O O -25.882 3.796 -22.833 1.00 . A A . 81 LYS O 1 1 1 652 1 1 82 HIS C C -23.273 1.915 -23.516 1.00 . A A . 82 HIS C 1 1 1 653 1 1 82 HIS CA C -23.605 3.114 -24.358 1.00 . A A . 82 HIS CA 1 1 1 654 1 1 82 HIS CB C -22.532 3.322 -25.445 1.00 . A A . 82 HIS CB 1 1 1 655 1 1 82 HIS CD2 C -23.002 5.670 -26.423 1.00 . A A . 82 HIS CD2 1 1 1 656 1 1 82 HIS CE1 C -24.009 5.154 -28.238 1.00 . A A . 82 HIS CE1 1 1 1 657 1 1 82 HIS CG C -23.004 4.311 -26.473 1.00 . A A . 82 HIS CG 1 1 1 658 1 1 82 HIS N N -23.800 4.305 -23.564 1.00 . A A . 82 HIS N 1 1 1 659 1 1 82 HIS ND1 N -23.666 3.983 -27.639 1.00 . A A . 82 HIS ND1 1 1 1 660 1 1 82 HIS NE2 N -23.624 6.197 -27.537 1.00 . A A . 82 HIS NE2 1 1 1 661 1 1 82 HIS O O -23.839 0.850 -23.747 1.00 . A A . 82 HIS O 1 1 1 662 1 1 83 VAL C C -22.071 1.541 -20.175 1.00 . A A . 83 VAL C 1 1 1 663 1 1 83 VAL CA C -22.170 0.960 -21.573 1.00 . A A . 83 VAL CA 1 1 1 664 1 1 83 VAL CB C -21.016 0.064 -21.978 1.00 . A A . 83 VAL CB 1 1 1 665 1 1 83 VAL CG1 C -19.663 0.779 -22.150 1.00 . A A . 83 VAL CG1 1 1 1 666 1 1 83 VAL CG2 C -20.929 -1.159 -21.044 1.00 . A A . 83 VAL CG2 1 1 1 667 1 1 83 VAL N N -22.361 2.021 -22.526 1.00 . A A . 83 VAL N 1 1 1 668 1 1 83 VAL O O -20.986 1.907 -19.727 1.00 . A A . 83 VAL O 1 1 1 669 1 1 84 PRO C C -22.322 1.248 -17.166 1.00 . A A . 84 PRO C 1 1 1 670 1 1 84 PRO CA C -23.092 2.191 -18.059 1.00 . A A . 84 PRO CA 1 1 1 671 1 1 84 PRO CB C -24.562 2.333 -17.629 1.00 . A A . 84 PRO CB 1 1 1 672 1 1 84 PRO CD C -24.534 1.326 -19.797 1.00 . A A . 84 PRO CD 1 1 1 673 1 1 84 PRO CG C -25.304 1.298 -18.476 1.00 . A A . 84 PRO CG 1 1 1 674 1 1 84 PRO N N -23.161 1.667 -19.413 1.00 . A A . 84 PRO N 1 1 1 675 1 1 84 PRO O O -22.405 0.030 -17.328 1.00 . A A . 84 PRO O 1 1 1 676 1 1 85 LEU C C -21.386 0.275 -14.340 1.00 . A A . 85 LEU C 1 1 1 677 1 1 85 LEU CA C -20.627 1.077 -15.396 1.00 . A A . 85 LEU CA 1 1 1 678 1 1 85 LEU CB C -19.680 2.082 -14.699 1.00 . A A . 85 LEU CB 1 1 1 679 1 1 85 LEU CD1 C -17.450 0.910 -15.034 1.00 . A A . 85 LEU CD1 1 1 1 680 1 1 85 LEU CD2 C -17.785 2.526 -13.119 1.00 . A A . 85 LEU CD2 1 1 1 681 1 1 85 LEU CG C -18.449 1.467 -14.011 1.00 . A A . 85 LEU CG 1 1 1 682 1 1 85 LEU N N -21.521 1.814 -16.246 1.00 . A A . 85 LEU N 1 1 1 683 1 1 85 LEU O O -22.283 0.833 -13.704 1.00 . A A . 85 LEU O 1 1 1 684 1 1 86 PRO C C -21.044 -1.259 -11.626 1.00 . A A . 86 PRO C 1 1 1 685 1 1 86 PRO CA C -21.646 -1.720 -12.954 1.00 . A A . 86 PRO CA 1 1 1 686 1 1 86 PRO CB C -21.241 -3.183 -13.225 1.00 . A A . 86 PRO CB 1 1 1 687 1 1 86 PRO CD C -20.471 -1.902 -15.067 1.00 . A A . 86 PRO CD 1 1 1 688 1 1 86 PRO CG C -21.076 -3.263 -14.743 1.00 . A A . 86 PRO CG 1 1 1 689 1 1 86 PRO N N -21.093 -1.001 -14.096 1.00 . A A . 86 PRO N 1 1 1 690 1 1 86 PRO O O -19.894 -0.816 -11.650 1.00 . A A . 86 PRO O 1 1 1 691 1 1 87 PRO C C -20.136 -2.252 -8.823 1.00 . A A . 87 PRO C 1 1 1 692 1 1 87 PRO CA C -21.089 -1.122 -9.180 1.00 . A A . 87 PRO CA 1 1 1 693 1 1 87 PRO CB C -22.288 -1.105 -8.217 1.00 . A A . 87 PRO CB 1 1 1 694 1 1 87 PRO CD C -23.112 -1.775 -10.353 1.00 . A A . 87 PRO CD 1 1 1 695 1 1 87 PRO CG C -23.290 -2.067 -8.863 1.00 . A A . 87 PRO CG 1 1 1 696 1 1 87 PRO N N -21.716 -1.346 -10.478 1.00 . A A . 87 PRO N 1 1 1 697 1 1 87 PRO O O -20.162 -3.309 -9.450 1.00 . A A . 87 PRO O 1 1 1 698 1 1 88 GLY C C -16.920 -2.819 -7.890 1.00 . A A . 88 GLY C 1 1 1 699 1 1 88 GLY CA C -18.310 -3.079 -7.388 1.00 . A A . 88 GLY CA 1 1 1 700 1 1 88 GLY N N -19.254 -2.048 -7.820 1.00 . A A . 88 GLY N 1 1 1 701 1 1 88 GLY O O -15.937 -3.123 -7.220 1.00 . A A . 88 GLY O 1 1 1 702 1 1 89 MET C C -15.578 -0.200 -9.454 1.00 . A A . 89 MET C 1 1 1 703 1 1 89 MET CA C -15.558 -1.707 -9.579 1.00 . A A . 89 MET CA 1 1 1 704 1 1 89 MET CB C -15.286 -2.139 -11.039 1.00 . A A . 89 MET CB 1 1 1 705 1 1 89 MET CE C -15.803 -3.636 -13.865 1.00 . A A . 89 MET CE 1 1 1 706 1 1 89 MET CG C -16.328 -1.664 -12.074 1.00 . A A . 89 MET CG 1 1 1 707 1 1 89 MET N N -16.804 -2.238 -9.097 1.00 . A A . 89 MET N 1 1 1 708 1 1 89 MET O O -16.613 0.427 -9.246 1.00 . A A . 89 MET O 1 1 1 709 1 1 89 MET SD S -17.219 -3.012 -12.913 1.00 . A A . 89 MET SD 1 1 1 710 1 1 90 ASN C C -13.302 1.980 -10.889 1.00 . A A . 90 ASN C 1 1 1 711 1 1 90 ASN CA C -14.226 1.838 -9.699 1.00 . A A . 90 ASN CA 1 1 1 712 1 1 90 ASN CB C -13.589 2.448 -8.426 1.00 . A A . 90 ASN CB 1 1 1 713 1 1 90 ASN CG C -14.645 2.646 -7.337 1.00 . A A . 90 ASN CG 1 1 1 714 1 1 90 ASN N N -14.396 0.415 -9.592 1.00 . A A . 90 ASN N 1 1 1 715 1 1 90 ASN ND2 N -14.808 1.677 -6.404 1.00 . A A . 90 ASN ND2 1 1 1 716 1 1 90 ASN O O -12.576 1.038 -11.224 1.00 . A A . 90 ASN O 1 1 1 717 1 1 90 ASN OD1 O -15.305 3.685 -7.307 1.00 . A A . 90 ASN OD1 1 1 1 718 1 1 91 ILE C C -11.731 4.561 -12.449 1.00 . A A . 91 ILE C 1 1 1 719 1 1 91 ILE CA C -12.608 3.397 -12.790 1.00 . A A . 91 ILE CA 1 1 1 720 1 1 91 ILE CB C -13.507 3.754 -13.984 1.00 . A A . 91 ILE CB 1 1 1 721 1 1 91 ILE CD1 C -15.201 5.458 -14.955 1.00 . A A . 91 ILE CD1 1 1 1 722 1 1 91 ILE CG1 C -14.469 4.943 -13.706 1.00 . A A . 91 ILE CG1 1 1 1 723 1 1 91 ILE CG2 C -14.288 2.478 -14.365 1.00 . A A . 91 ILE CG2 1 1 1 724 1 1 91 ILE N N -13.341 3.145 -11.573 1.00 . A A . 91 ILE N 1 1 1 725 1 1 91 ILE O O -12.107 5.438 -11.672 1.00 . A A . 91 ILE O 1 1 1 726 1 1 92 SER C C -8.959 6.212 -13.985 1.00 . A A . 92 SER C 1 1 1 727 1 1 92 SER CA C -9.754 5.876 -12.766 1.00 . A A . 92 SER CA 1 1 1 728 1 1 92 SER CB C -8.909 5.930 -11.479 1.00 . A A . 92 SER CB 1 1 1 729 1 1 92 SER N N -10.493 4.633 -12.944 1.00 . A A . 92 SER N 1 1 1 730 1 1 92 SER O O -8.132 5.429 -14.449 1.00 . A A . 92 SER O 1 1 1 731 1 1 92 SER OG O -9.788 6.016 -10.359 1.00 . A A . 92 SER OG 1 1 1 732 1 1 93 GLY C C -7.472 8.703 -15.447 1.00 . A A . 93 GLY C 1 1 1 733 1 1 93 GLY CA C -8.703 7.931 -15.762 1.00 . A A . 93 GLY CA 1 1 1 734 1 1 93 GLY N N -9.270 7.403 -14.543 1.00 . A A . 93 GLY N 1 1 1 735 1 1 93 GLY O O -7.547 9.765 -14.828 1.00 . A A . 93 GLY O 1 1 1 736 1 1 94 PHE C C -4.619 9.366 -17.006 1.00 . A A . 94 PHE C 1 1 1 737 1 1 94 PHE CA C -5.066 8.865 -15.668 1.00 . A A . 94 PHE CA 1 1 1 738 1 1 94 PHE CB C -3.990 7.934 -15.081 1.00 . A A . 94 PHE CB 1 1 1 739 1 1 94 PHE CD1 C -5.103 6.558 -13.274 1.00 . A A . 94 PHE CD1 1 1 1 740 1 1 94 PHE CD2 C -3.757 8.462 -12.628 1.00 . A A . 94 PHE CD2 1 1 1 741 1 1 94 PHE CE1 C -5.404 6.310 -11.929 1.00 . A A . 94 PHE CE1 1 1 1 742 1 1 94 PHE CE2 C -4.070 8.228 -11.284 1.00 . A A . 94 PHE CE2 1 1 1 743 1 1 94 PHE CG C -4.288 7.643 -13.637 1.00 . A A . 94 PHE CG 1 1 1 744 1 1 94 PHE CZ C -4.909 7.163 -10.935 1.00 . A A . 94 PHE CZ 1 1 1 745 1 1 94 PHE N N -6.315 8.192 -15.880 1.00 . A A . 94 PHE N 1 1 1 746 1 1 94 PHE O O -4.715 8.679 -18.022 1.00 . A A . 94 PHE O 1 1 1 747 1 1 95 THR C C -2.132 11.149 -18.070 1.00 . A A . 95 THR C 1 1 1 748 1 1 95 THR CA C -3.622 11.318 -18.169 1.00 . A A . 95 THR CA 1 1 1 749 1 1 95 THR CB C -4.008 12.794 -18.138 1.00 . A A . 95 THR CB 1 1 1 750 1 1 95 THR CG2 C -3.527 13.498 -19.419 1.00 . A A . 95 THR CG2 1 1 1 751 1 1 95 THR N N -4.116 10.603 -17.028 1.00 . A A . 95 THR N 1 1 1 752 1 1 95 THR O O -1.528 11.348 -17.014 1.00 . A A . 95 THR O 1 1 1 753 1 1 95 THR OG1 O -5.428 12.900 -18.080 1.00 . A A . 95 THR OG1 1 1 1 754 1 1 96 ALA C C 0.787 11.244 -19.707 1.00 . A A . 96 ALA C 1 1 1 755 1 1 96 ALA CA C -0.156 10.195 -19.161 1.00 . A A . 96 ALA CA 1 1 1 756 1 1 96 ALA CB C -0.058 8.922 -20.031 1.00 . A A . 96 ALA CB 1 1 1 757 1 1 96 ALA N N -1.516 10.676 -19.162 1.00 . A A . 96 ALA N 1 1 1 758 1 1 96 ALA O O 0.785 11.524 -20.906 1.00 . A A . 96 ALA O 1 1 1 759 1 1 97 SER C C 3.963 12.099 -19.454 1.00 . A A . 97 SER C 1 1 1 760 1 1 97 SER CA C 2.636 12.785 -19.316 1.00 . A A . 97 SER CA 1 1 1 761 1 1 97 SER CB C 2.817 14.019 -18.406 1.00 . A A . 97 SER CB 1 1 1 762 1 1 97 SER N N 1.648 11.831 -18.844 1.00 . A A . 97 SER N 1 1 1 763 1 1 97 SER O O 4.604 11.727 -18.477 1.00 . A A . 97 SER O 1 1 1 764 1 1 97 SER OG O 1.673 14.859 -18.535 1.00 . A A . 97 SER OG 1 1 1 765 1 1 98 LEU C C 6.764 12.451 -20.584 1.00 . A A . 98 LEU C 1 1 1 766 1 1 98 LEU CA C 5.753 11.397 -20.994 1.00 . A A . 98 LEU CA 1 1 1 767 1 1 98 LEU CB C 5.903 11.047 -22.502 1.00 . A A . 98 LEU CB 1 1 1 768 1 1 98 LEU CD1 C 6.993 9.803 -24.414 1.00 . A A . 98 LEU CD1 1 1 1 769 1 1 98 LEU CD2 C 8.475 10.748 -22.672 1.00 . A A . 98 LEU CD2 1 1 1 770 1 1 98 LEU CG C 7.093 10.140 -22.920 1.00 . A A . 98 LEU CG 1 1 1 771 1 1 98 LEU N N 4.427 11.919 -20.706 1.00 . A A . 98 LEU N 1 1 1 772 1 1 98 LEU O O 6.646 13.603 -20.995 1.00 . A A . 98 LEU O 1 1 1 773 1 1 99 ASP C C 9.884 13.309 -19.679 1.00 . A A . 99 ASP C 1 1 1 774 1 1 99 ASP CA C 8.543 13.036 -19.004 1.00 . A A . 99 ASP CA 1 1 1 775 1 1 99 ASP CB C 8.793 12.363 -17.628 1.00 . A A . 99 ASP CB 1 1 1 776 1 1 99 ASP CG C 9.075 13.346 -16.507 1.00 . A A . 99 ASP CG 1 1 1 777 1 1 99 ASP N N 7.752 12.075 -19.740 1.00 . A A . 99 ASP N 1 1 1 778 1 1 99 ASP O O 10.404 14.420 -19.613 1.00 . A A . 99 ASP O 1 1 1 779 1 1 99 ASP OD1 O 8.070 13.863 -15.949 1.00 . A A . 99 ASP OD1 1 1 1 780 1 1 99 ASP OD2 O 10.273 13.514 -16.142 1.00 . A A . 99 ASP OD2 1 1 1 781 1 1 100 PHE C C 11.716 13.149 -22.285 1.00 . A A . 100 PHE C 1 1 1 782 1 1 100 PHE CA C 11.761 12.318 -20.979 1.00 . A A . 100 PHE CA 1 1 1 783 1 1 100 PHE CB C 12.257 10.903 -21.416 1.00 . A A . 100 PHE CB 1 1 1 784 1 1 100 PHE CD1 C 11.951 9.621 -19.224 1.00 . A A . 100 PHE CD1 1 1 1 785 1 1 100 PHE CD2 C 14.078 9.514 -20.370 1.00 . A A . 100 PHE CD2 1 1 1 786 1 1 100 PHE CE1 C 12.446 8.759 -18.240 1.00 . A A . 100 PHE CE1 1 1 1 787 1 1 100 PHE CE2 C 14.571 8.648 -19.386 1.00 . A A . 100 PHE CE2 1 1 1 788 1 1 100 PHE CG C 12.765 10.022 -20.299 1.00 . A A . 100 PHE CG 1 1 1 789 1 1 100 PHE CZ C 13.755 8.273 -18.315 1.00 . A A . 100 PHE CZ 1 1 1 790 1 1 100 PHE N N 10.460 12.275 -20.335 1.00 . A A . 100 PHE N 1 1 1 791 1 1 100 PHE O O 12.466 14.155 -22.388 1.00 . A A . 100 PHE O 1 1 1 792 1 1 100 PHE OXT O 10.971 12.728 -23.212 1.00 . A A . 100 PHE OXT 1 1 1 793 2 1 1 ARG C C -14.559 5.909 7.479 1.00 . B B . 1 ARG C 1 1 1 794 2 1 1 ARG CA C -14.691 4.767 8.474 1.00 . B B . 1 ARG CA 1 1 1 795 2 1 1 ARG CB C -13.645 4.903 9.620 1.00 . B B . 1 ARG CB 1 1 1 796 2 1 1 ARG CD C -13.796 2.560 10.905 1.00 . B B . 1 ARG CD 1 1 1 797 2 1 1 ARG CG C -12.973 3.588 10.091 1.00 . B B . 1 ARG CG 1 1 1 798 2 1 1 ARG CZ C -14.410 0.915 9.077 1.00 . B B . 1 ARG CZ 1 1 1 799 2 1 1 ARG N N -16.060 4.608 9.038 1.00 . B B . 1 ARG N 1 1 1 800 2 1 1 ARG NE N -14.773 1.791 10.042 1.00 . B B . 1 ARG NE 1 1 1 801 2 1 1 ARG NH1 N -13.130 0.636 8.795 1.00 . B B . 1 ARG NH1 1 1 1 802 2 1 1 ARG NH2 N -15.359 0.257 8.395 1.00 . B B . 1 ARG NH2 1 1 1 803 2 1 1 ARG O O -14.219 7.032 7.853 1.00 . B B . 1 ARG O 1 1 1 804 2 1 2 ARG C C -16.437 3.771 5.847 1.00 . B B . 2 ARG C 1 1 1 805 2 1 2 ARG CA C -15.979 5.196 5.539 1.00 . B B . 2 ARG CA 1 1 1 806 2 1 2 ARG CB C -17.187 6.160 5.704 1.00 . B B . 2 ARG CB 1 1 1 807 2 1 2 ARG CD C -16.293 8.623 5.811 1.00 . B B . 2 ARG CD 1 1 1 808 2 1 2 ARG CG C -17.028 7.536 5.015 1.00 . B B . 2 ARG CG 1 1 1 809 2 1 2 ARG CZ C -16.647 9.550 8.117 1.00 . B B . 2 ARG CZ 1 1 1 810 2 1 2 ARG N N -14.749 5.683 6.160 1.00 . B B . 2 ARG N 1 1 1 811 2 1 2 ARG NE N -17.132 8.942 7.016 1.00 . B B . 2 ARG NE 1 1 1 812 2 1 2 ARG NH1 N -15.391 9.358 8.541 1.00 . B B . 2 ARG NH1 1 1 1 813 2 1 2 ARG NH2 N -17.455 10.341 8.840 1.00 . B B . 2 ARG NH2 1 1 1 814 2 1 2 ARG O O -17.110 3.562 6.852 1.00 . B B . 2 ARG O 1 1 1 815 2 1 3 THR C C -15.097 2.861 2.796 1.00 . B B . 3 THR C 1 1 1 816 2 1 3 THR CA C -14.982 2.452 4.242 1.00 . B B . 3 THR CA 1 1 1 817 2 1 3 THR CB C -13.622 2.810 4.842 1.00 . B B . 3 THR CB 1 1 1 818 2 1 3 THR CG2 C -12.546 2.001 4.135 1.00 . B B . 3 THR CG2 1 1 1 819 2 1 3 THR N N -16.180 2.735 5.022 1.00 . B B . 3 THR N 1 1 1 820 2 1 3 THR O O -15.471 2.071 1.934 1.00 . B B . 3 THR O 1 1 1 821 2 1 3 THR OG1 O -13.541 2.435 6.205 1.00 . B B . 3 THR OG1 1 1 1 822 2 1 4 THR C C -13.133 4.719 0.908 1.00 . B B . 4 THR C 1 1 1 823 2 1 4 THR CA C -14.622 4.679 1.169 1.00 . B B . 4 THR CA 1 1 1 824 2 1 4 THR CB C -15.175 6.101 1.134 1.00 . B B . 4 THR CB 1 1 1 825 2 1 4 THR CG2 C -16.707 6.055 1.281 1.00 . B B . 4 THR CG2 1 1 1 826 2 1 4 THR N N -14.747 4.122 2.494 1.00 . B B . 4 THR N 1 1 1 827 2 1 4 THR O O -12.500 5.766 1.043 1.00 . B B . 4 THR O 1 1 1 828 2 1 4 THR OG1 O -14.642 6.864 2.220 1.00 . B B . 4 THR OG1 1 1 1 829 2 1 5 ASN C C -10.699 3.458 -0.981 1.00 . B B . 5 ASN C 1 1 1 830 2 1 5 ASN CA C -11.092 3.427 0.477 1.00 . B B . 5 ASN CA 1 1 1 831 2 1 5 ASN CB C -10.532 2.161 1.222 1.00 . B B . 5 ASN CB 1 1 1 832 2 1 5 ASN CG C -11.336 0.841 1.148 1.00 . B B . 5 ASN CG 1 1 1 833 2 1 5 ASN N N -12.533 3.553 0.601 1.00 . B B . 5 ASN N 1 1 1 834 2 1 5 ASN ND2 N -12.035 0.514 0.036 1.00 . B B . 5 ASN ND2 1 1 1 835 2 1 5 ASN O O -10.848 4.454 -1.685 1.00 . B B . 5 ASN O 1 1 1 836 2 1 5 ASN OD1 O -11.323 0.085 2.120 1.00 . B B . 5 ASN OD1 1 1 1 837 2 1 6 ASP C C -10.964 1.356 -3.449 1.00 . B B . 6 ASP C 1 1 1 838 2 1 6 ASP CA C -9.777 2.031 -2.780 1.00 . B B . 6 ASP CA 1 1 1 839 2 1 6 ASP CB C -8.574 1.067 -2.651 1.00 . B B . 6 ASP CB 1 1 1 840 2 1 6 ASP CG C -7.501 1.659 -1.743 1.00 . B B . 6 ASP CG 1 1 1 841 2 1 6 ASP N N -10.224 2.308 -1.461 1.00 . B B . 6 ASP N 1 1 1 842 2 1 6 ASP O O -11.650 0.522 -2.857 1.00 . B B . 6 ASP O 1 1 1 843 2 1 6 ASP OD1 O -7.656 1.562 -0.497 1.00 . B B . 6 ASP OD1 1 1 1 844 2 1 6 ASP OD2 O -6.510 2.196 -2.299 1.00 . B B . 6 ASP OD2 1 1 1 845 2 1 7 GLY C C -9.353 1.261 -6.041 1.00 . B B . 7 GLY C 1 1 1 846 2 1 7 GLY CA C -10.836 1.411 -5.951 1.00 . B B . 7 GLY CA 1 1 1 847 2 1 7 GLY N N -11.366 1.820 -4.649 1.00 . B B . 7 GLY N 1 1 1 848 2 1 7 GLY O O -8.599 2.196 -5.800 1.00 . B B . 7 GLY O 1 1 1 849 2 1 8 PHE C C -6.576 0.090 -7.175 1.00 . B B . 8 PHE C 1 1 1 850 2 1 8 PHE CA C -7.536 -0.387 -6.104 1.00 . B B . 8 PHE CA 1 1 1 851 2 1 8 PHE CB C -7.469 -1.931 -5.936 1.00 . B B . 8 PHE CB 1 1 1 852 2 1 8 PHE CD1 C -8.350 -2.457 -3.624 1.00 . B B . 8 PHE CD1 1 1 1 853 2 1 8 PHE CD2 C -9.829 -2.748 -5.520 1.00 . B B . 8 PHE CD2 1 1 1 854 2 1 8 PHE CE1 C -9.388 -2.829 -2.759 1.00 . B B . 8 PHE CE1 1 1 1 855 2 1 8 PHE CE2 C -10.877 -3.090 -4.657 1.00 . B B . 8 PHE CE2 1 1 1 856 2 1 8 PHE CG C -8.561 -2.405 -5.009 1.00 . B B . 8 PHE CG 1 1 1 857 2 1 8 PHE CZ C -10.654 -3.135 -3.275 1.00 . B B . 8 PHE CZ 1 1 1 858 2 1 8 PHE N N -8.896 0.041 -6.363 1.00 . B B . 8 PHE N 1 1 1 859 2 1 8 PHE O O -6.076 -0.687 -7.985 1.00 . B B . 8 PHE O 1 1 1 860 2 1 9 HIS C C -4.325 2.741 -7.423 1.00 . B B . 9 HIS C 1 1 1 861 2 1 9 HIS CA C -5.437 2.039 -8.182 1.00 . B B . 9 HIS CA 1 1 1 862 2 1 9 HIS CB C -6.195 3.110 -9.022 1.00 . B B . 9 HIS CB 1 1 1 863 2 1 9 HIS CD2 C -8.126 1.737 -10.184 1.00 . B B . 9 HIS CD2 1 1 1 864 2 1 9 HIS CE1 C -9.811 2.869 -9.493 1.00 . B B . 9 HIS CE1 1 1 1 865 2 1 9 HIS CG C -7.614 2.732 -9.404 1.00 . B B . 9 HIS CG 1 1 1 866 2 1 9 HIS N N -6.315 1.406 -7.217 1.00 . B B . 9 HIS N 1 1 1 867 2 1 9 HIS ND1 N -8.705 3.454 -8.973 1.00 . B B . 9 HIS ND1 1 1 1 868 2 1 9 HIS NE2 N -9.512 1.822 -10.233 1.00 . B B . 9 HIS NE2 1 1 1 869 2 1 9 HIS O O -4.607 3.583 -6.578 1.00 . B B . 9 HIS O 1 1 1 870 2 1 10 LEU C C -1.250 4.196 -7.358 1.00 . B B . 10 LEU C 1 1 1 871 2 1 10 LEU CA C -1.951 2.945 -6.825 1.00 . B B . 10 LEU CA 1 1 1 872 2 1 10 LEU CB C -0.891 1.828 -6.622 1.00 . B B . 10 LEU CB 1 1 1 873 2 1 10 LEU CD1 C -0.429 -0.542 -5.828 1.00 . B B . 10 LEU CD1 1 1 1 874 2 1 10 LEU CD2 C -1.314 1.156 -4.197 1.00 . B B . 10 LEU CD2 1 1 1 875 2 1 10 LEU CG C -1.330 0.694 -5.665 1.00 . B B . 10 LEU CG 1 1 1 876 2 1 10 LEU N N -3.031 2.456 -7.689 1.00 . B B . 10 LEU N 1 1 1 877 2 1 10 LEU O O -0.162 4.551 -6.908 1.00 . B B . 10 LEU O 1 1 1 878 2 1 11 LEU C C -1.764 7.392 -8.456 1.00 . B B . 11 LEU C 1 1 1 879 2 1 11 LEU CA C -1.232 6.068 -8.958 1.00 . B B . 11 LEU CA 1 1 1 880 2 1 11 LEU CB C -1.462 6.016 -10.482 1.00 . B B . 11 LEU CB 1 1 1 881 2 1 11 LEU CD1 C -1.237 4.791 -12.649 1.00 . B B . 11 LEU CD1 1 1 1 882 2 1 11 LEU CD2 C 0.704 4.796 -11.038 1.00 . B B . 11 LEU CD2 1 1 1 883 2 1 11 LEU CG C -0.825 4.801 -11.173 1.00 . B B . 11 LEU CG 1 1 1 884 2 1 11 LEU N N -1.868 4.926 -8.310 1.00 . B B . 11 LEU N 1 1 1 885 2 1 11 LEU O O -1.484 8.445 -9.022 1.00 . B B . 11 LEU O 1 1 1 886 2 1 12 LYS C C -2.668 9.691 -6.433 1.00 . B B . 12 LYS C 1 1 1 887 2 1 12 LYS CA C -3.391 8.422 -6.863 1.00 . B B . 12 LYS CA 1 1 1 888 2 1 12 LYS CB C -4.275 7.890 -5.702 1.00 . B B . 12 LYS CB 1 1 1 889 2 1 12 LYS CD C -6.396 8.244 -4.316 1.00 . B B . 12 LYS CD 1 1 1 890 2 1 12 LYS CE C -7.552 9.173 -3.917 1.00 . B B . 12 LYS CE 1 1 1 891 2 1 12 LYS CG C -5.325 8.901 -5.205 1.00 . B B . 12 LYS CG 1 1 1 892 2 1 12 LYS N N -2.560 7.347 -7.368 1.00 . B B . 12 LYS N 1 1 1 893 2 1 12 LYS NZ N -7.038 10.330 -3.148 1.00 . B B . 12 LYS NZ 1 1 1 894 2 1 12 LYS O O -3.037 10.784 -6.856 1.00 . B B . 12 LYS O 1 1 1 895 2 1 13 ALA C C -0.111 11.431 -6.115 1.00 . B B . 13 ALA C 1 1 1 896 2 1 13 ALA CA C -0.940 10.745 -5.045 1.00 . B B . 13 ALA CA 1 1 1 897 2 1 13 ALA CB C -0.020 10.327 -3.885 1.00 . B B . 13 ALA CB 1 1 1 898 2 1 13 ALA N N -1.635 9.590 -5.570 1.00 . B B . 13 ALA N 1 1 1 899 2 1 13 ALA O O 0.480 10.764 -6.965 1.00 . B B . 13 ALA O 1 1 1 900 2 1 14 GLY C C 2.110 13.566 -7.117 1.00 . B B . 14 GLY C 1 1 1 901 2 1 14 GLY CA C 0.604 13.602 -7.121 1.00 . B B . 14 GLY CA 1 1 1 902 2 1 14 GLY N N -0.042 12.787 -6.091 1.00 . B B . 14 GLY N 1 1 1 903 2 1 14 GLY O O 2.776 14.590 -7.014 1.00 . B B . 14 GLY O 1 1 1 904 2 1 15 GLY C C 4.308 10.636 -7.515 1.00 . B B . 15 GLY C 1 1 1 905 2 1 15 GLY CA C 4.075 12.107 -7.400 1.00 . B B . 15 GLY CA 1 1 1 906 2 1 15 GLY N N 2.659 12.354 -7.249 1.00 . B B . 15 GLY N 1 1 1 907 2 1 15 GLY O O 5.232 10.095 -6.920 1.00 . B B . 15 GLY O 1 1 1 908 2 1 16 SER C C 3.957 8.347 -10.027 1.00 . B B . 16 SER C 1 1 1 909 2 1 16 SER CA C 3.597 8.520 -8.569 1.00 . B B . 16 SER CA 1 1 1 910 2 1 16 SER CB C 2.297 7.709 -8.306 1.00 . B B . 16 SER CB 1 1 1 911 2 1 16 SER N N 3.456 9.943 -8.303 1.00 . B B . 16 SER N 1 1 1 912 2 1 16 SER O O 3.086 8.119 -10.863 1.00 . B B . 16 SER O 1 1 1 913 2 1 16 SER OG O 1.880 7.838 -6.949 1.00 . B B . 16 SER OG 1 1 1 914 2 1 17 CYS C C 5.688 6.817 -12.136 1.00 . B B . 17 CYS C 1 1 1 915 2 1 17 CYS CA C 5.670 8.295 -11.785 1.00 . B B . 17 CYS CA 1 1 1 916 2 1 17 CYS CB C 7.088 8.907 -11.999 1.00 . B B . 17 CYS CB 1 1 1 917 2 1 17 CYS N N 5.248 8.466 -10.402 1.00 . B B . 17 CYS N 1 1 1 918 2 1 17 CYS O O 5.912 5.985 -11.259 1.00 . B B . 17 CYS O 1 1 1 919 2 1 17 CYS SG S 7.666 9.009 -13.740 1.00 . B B . 17 CYS SG 1 1 1 920 2 1 18 PHE C C 6.750 4.963 -14.875 1.00 . B B . 18 PHE C 1 1 1 921 2 1 18 PHE CA C 5.675 5.071 -13.824 1.00 . B B . 18 PHE CA 1 1 1 922 2 1 18 PHE CB C 4.400 4.261 -14.159 1.00 . B B . 18 PHE CB 1 1 1 923 2 1 18 PHE CD1 C 2.654 5.813 -15.103 1.00 . B B . 18 PHE CD1 1 1 1 924 2 1 18 PHE CD2 C 3.619 4.127 -16.547 1.00 . B B . 18 PHE CD2 1 1 1 925 2 1 18 PHE CE1 C 1.808 6.221 -16.138 1.00 . B B . 18 PHE CE1 1 1 1 926 2 1 18 PHE CE2 C 2.751 4.509 -17.574 1.00 . B B . 18 PHE CE2 1 1 1 927 2 1 18 PHE CG C 3.570 4.768 -15.300 1.00 . B B . 18 PHE CG 1 1 1 928 2 1 18 PHE CZ C 1.843 5.556 -17.369 1.00 . B B . 18 PHE CZ 1 1 1 929 2 1 18 PHE N N 5.464 6.446 -13.421 1.00 . B B . 18 PHE N 1 1 1 930 2 1 18 PHE O O 6.668 5.527 -15.962 1.00 . B B . 18 PHE O 1 1 1 931 2 1 19 ALA C C 8.160 2.542 -16.198 1.00 . B B . 19 ALA C 1 1 1 932 2 1 19 ALA CA C 8.776 3.749 -15.518 1.00 . B B . 19 ALA CA 1 1 1 933 2 1 19 ALA CB C 10.157 3.434 -14.919 1.00 . B B . 19 ALA CB 1 1 1 934 2 1 19 ALA N N 7.847 4.263 -14.541 1.00 . B B . 19 ALA N 1 1 1 935 2 1 19 ALA O O 7.824 1.566 -15.535 1.00 . B B . 19 ALA O 1 1 1 936 2 1 20 LEU C C 8.437 0.874 -19.038 1.00 . B B . 20 LEU C 1 1 1 937 2 1 20 LEU CA C 7.333 1.508 -18.253 1.00 . B B . 20 LEU CA 1 1 1 938 2 1 20 LEU CB C 6.255 2.088 -19.194 1.00 . B B . 20 LEU CB 1 1 1 939 2 1 20 LEU CD1 C 4.588 0.203 -18.810 1.00 . B B . 20 LEU CD1 1 1 1 940 2 1 20 LEU CD2 C 4.330 1.716 -20.793 1.00 . B B . 20 LEU CD2 1 1 1 941 2 1 20 LEU CG C 5.342 1.039 -19.855 1.00 . B B . 20 LEU CG 1 1 1 942 2 1 20 LEU N N 7.956 2.570 -17.517 1.00 . B B . 20 LEU N 1 1 1 943 2 1 20 LEU O O 8.971 1.505 -19.950 1.00 . B B . 20 LEU O 1 1 1 944 2 1 21 ILE C C 9.680 -2.027 -20.144 1.00 . B B . 21 ILE C 1 1 1 945 2 1 21 ILE CA C 10.075 -0.903 -19.215 1.00 . B B . 21 ILE CA 1 1 1 946 2 1 21 ILE CB C 11.096 -1.357 -18.176 1.00 . B B . 21 ILE CB 1 1 1 947 2 1 21 ILE CD1 C 10.589 -0.332 -15.836 1.00 . B B . 21 ILE CD1 1 1 1 948 2 1 21 ILE CG1 C 11.416 -0.261 -17.121 1.00 . B B . 21 ILE CG1 1 1 1 949 2 1 21 ILE CG2 C 12.392 -1.801 -18.888 1.00 . B B . 21 ILE CG2 1 1 1 950 2 1 21 ILE N N 8.865 -0.344 -18.652 1.00 . B B . 21 ILE N 1 1 1 951 2 1 21 ILE O O 9.314 -3.121 -19.715 1.00 . B B . 21 ILE O 1 1 1 952 2 1 22 SER C C 10.683 -3.340 -23.082 1.00 . B B . 22 SER C 1 1 1 953 2 1 22 SER CA C 9.448 -2.696 -22.529 1.00 . B B . 22 SER CA 1 1 1 954 2 1 22 SER CB C 8.737 -2.052 -23.737 1.00 . B B . 22 SER CB 1 1 1 955 2 1 22 SER N N 9.774 -1.752 -21.462 1.00 . B B . 22 SER N 1 1 1 956 2 1 22 SER O O 11.014 -3.213 -24.260 1.00 . B B . 22 SER O 1 1 1 957 2 1 22 SER OG O 7.416 -1.714 -23.356 1.00 . B B . 22 SER OG 1 1 1 958 2 1 23 GLY C C 12.164 -6.151 -23.302 1.00 . B B . 23 GLY C 1 1 1 959 2 1 23 GLY CA C 12.550 -4.869 -22.619 1.00 . B B . 23 GLY CA 1 1 1 960 2 1 23 GLY N N 11.418 -4.054 -22.218 1.00 . B B . 23 GLY N 1 1 1 961 2 1 23 GLY O O 11.089 -6.700 -23.081 1.00 . B B . 23 GLY O 1 1 1 962 2 1 24 THR C C 12.808 -9.098 -23.502 1.00 . B B . 24 THR C 1 1 1 963 2 1 24 THR CA C 12.930 -8.089 -24.637 1.00 . B B . 24 THR CA 1 1 1 964 2 1 24 THR CB C 14.077 -8.428 -25.585 1.00 . B B . 24 THR CB 1 1 1 965 2 1 24 THR CG2 C 13.814 -9.713 -26.388 1.00 . B B . 24 THR CG2 1 1 1 966 2 1 24 THR N N 13.076 -6.739 -24.097 1.00 . B B . 24 THR N 1 1 1 967 2 1 24 THR O O 13.378 -8.903 -22.433 1.00 . B B . 24 THR O 1 1 1 968 2 1 24 THR OG1 O 14.210 -7.371 -26.528 1.00 . B B . 24 THR OG1 1 1 1 969 2 1 25 ALA C C 12.582 -11.604 -21.675 1.00 . B B . 25 ALA C 1 1 1 970 2 1 25 ALA CA C 11.503 -10.987 -22.553 1.00 . B B . 25 ALA CA 1 1 1 971 2 1 25 ALA CB C 10.591 -12.099 -23.109 1.00 . B B . 25 ALA CB 1 1 1 972 2 1 25 ALA N N 12.003 -10.178 -23.657 1.00 . B B . 25 ALA N 1 1 1 973 2 1 25 ALA O O 12.587 -11.459 -20.450 1.00 . B B . 25 ALA O 1 1 1 974 2 1 26 ASN C C 15.551 -11.807 -20.984 1.00 . B B . 26 ASN C 1 1 1 975 2 1 26 ASN CA C 14.743 -12.858 -21.726 1.00 . B B . 26 ASN CA 1 1 1 976 2 1 26 ASN CB C 15.656 -13.535 -22.795 1.00 . B B . 26 ASN CB 1 1 1 977 2 1 26 ASN CG C 14.941 -14.696 -23.498 1.00 . B B . 26 ASN CG 1 1 1 978 2 1 26 ASN N N 13.564 -12.266 -22.325 1.00 . B B . 26 ASN N 1 1 1 979 2 1 26 ASN ND2 N 15.595 -15.273 -24.541 1.00 . B B . 26 ASN ND2 1 1 1 980 2 1 26 ASN O O 16.013 -12.036 -19.870 1.00 . B B . 26 ASN O 1 1 1 981 2 1 26 ASN OD1 O 13.828 -15.084 -23.142 1.00 . B B . 26 ASN OD1 1 1 1 982 2 1 27 GLN C C 15.641 -8.977 -19.746 1.00 . B B . 27 GLN C 1 1 1 983 2 1 27 GLN CA C 16.366 -9.471 -20.980 1.00 . B B . 27 GLN CA 1 1 1 984 2 1 27 GLN CB C 16.586 -8.338 -22.012 1.00 . B B . 27 GLN CB 1 1 1 985 2 1 27 GLN CD C 17.927 -6.300 -22.664 1.00 . B B . 27 GLN CD 1 1 1 986 2 1 27 GLN CG C 17.546 -7.240 -21.517 1.00 . B B . 27 GLN CG 1 1 1 987 2 1 27 GLN N N 15.674 -10.592 -21.567 1.00 . B B . 27 GLN N 1 1 1 988 2 1 27 GLN NE2 N 19.239 -5.975 -22.768 1.00 . B B . 27 GLN NE2 1 1 1 989 2 1 27 GLN O O 16.270 -8.838 -18.701 1.00 . B B . 27 GLN O 1 1 1 990 2 1 27 GLN OE1 O 17.076 -5.859 -23.440 1.00 . B B . 27 GLN OE1 1 1 1 991 2 1 28 VAL C C 13.553 -9.483 -17.509 1.00 . B B . 28 VAL C 1 1 1 992 2 1 28 VAL CA C 13.461 -8.461 -18.638 1.00 . B B . 28 VAL CA 1 1 1 993 2 1 28 VAL CB C 12.017 -8.243 -19.034 1.00 . B B . 28 VAL CB 1 1 1 994 2 1 28 VAL CG1 C 11.074 -8.060 -17.831 1.00 . B B . 28 VAL CG1 1 1 1 995 2 1 28 VAL CG2 C 11.971 -6.979 -19.896 1.00 . B B . 28 VAL CG2 1 1 1 996 2 1 28 VAL N N 14.301 -8.780 -19.801 1.00 . B B . 28 VAL N 1 1 1 997 2 1 28 VAL O O 13.691 -9.139 -16.330 1.00 . B B . 28 VAL O 1 1 1 998 2 1 29 LYS C C 15.068 -11.846 -16.237 1.00 . B B . 29 LYS C 1 1 1 999 2 1 29 LYS CA C 13.721 -11.892 -16.952 1.00 . B B . 29 LYS CA 1 1 1 1000 2 1 29 LYS CB C 13.533 -13.213 -17.736 1.00 . B B . 29 LYS CB 1 1 1 1001 2 1 29 LYS CD C 12.828 -15.647 -17.792 1.00 . B B . 29 LYS CD 1 1 1 1002 2 1 29 LYS CE C 12.156 -16.833 -17.084 1.00 . B B . 29 LYS CE 1 1 1 1003 2 1 29 LYS CG C 13.205 -14.455 -16.890 1.00 . B B . 29 LYS CG 1 1 1 1004 2 1 29 LYS N N 13.552 -10.783 -17.869 1.00 . B B . 29 LYS N 1 1 1 1005 2 1 29 LYS NZ N 13.080 -17.475 -16.125 1.00 . B B . 29 LYS NZ 1 1 1 1006 2 1 29 LYS O O 15.129 -11.911 -15.009 1.00 . B B . 29 LYS O 1 1 1 1007 2 1 30 CYS C C 17.629 -10.218 -15.627 1.00 . B B . 30 CYS C 1 1 1 1008 2 1 30 CYS CA C 17.506 -11.485 -16.454 1.00 . B B . 30 CYS CA 1 1 1 1009 2 1 30 CYS CB C 18.590 -11.488 -17.559 1.00 . B B . 30 CYS CB 1 1 1 1010 2 1 30 CYS N N 16.172 -11.662 -16.999 1.00 . B B . 30 CYS N 1 1 1 1011 2 1 30 CYS O O 18.115 -10.275 -14.499 1.00 . B B . 30 CYS O 1 1 1 1012 2 1 30 CYS SG S 18.728 -13.113 -18.372 1.00 . B B . 30 CYS SG 1 1 1 1013 2 1 31 TYR C C 16.604 -7.845 -14.069 1.00 . B B . 31 TYR C 1 1 1 1014 2 1 31 TYR CA C 17.080 -7.750 -15.505 1.00 . B B . 31 TYR CA 1 1 1 1015 2 1 31 TYR CB C 16.143 -6.807 -16.329 1.00 . B B . 31 TYR CB 1 1 1 1016 2 1 31 TYR CD1 C 17.281 -4.573 -15.936 1.00 . B B . 31 TYR CD1 1 1 1 1017 2 1 31 TYR CD2 C 14.884 -4.735 -15.633 1.00 . B B . 31 TYR CD2 1 1 1 1018 2 1 31 TYR CE1 C 17.222 -3.199 -15.657 1.00 . B B . 31 TYR CE1 1 1 1 1019 2 1 31 TYR CE2 C 14.818 -3.360 -15.372 1.00 . B B . 31 TYR CE2 1 1 1 1020 2 1 31 TYR CG C 16.114 -5.356 -15.919 1.00 . B B . 31 TYR CG 1 1 1 1021 2 1 31 TYR CZ C 15.988 -2.599 -15.371 1.00 . B B . 31 TYR CZ 1 1 1 1022 2 1 31 TYR N N 17.148 -9.058 -16.148 1.00 . B B . 31 TYR N 1 1 1 1023 2 1 31 TYR O O 17.347 -7.505 -13.151 1.00 . B B . 31 TYR O 1 1 1 1024 2 1 31 TYR OH O 15.922 -1.225 -15.079 1.00 . B B . 31 TYR OH 1 1 1 1025 2 1 32 ARG C C 15.502 -9.334 -11.562 1.00 . B B . 32 ARG C 1 1 1 1026 2 1 32 ARG CA C 14.764 -8.433 -12.531 1.00 . B B . 32 ARG CA 1 1 1 1027 2 1 32 ARG CB C 13.302 -8.930 -12.622 1.00 . B B . 32 ARG CB 1 1 1 1028 2 1 32 ARG CD C 11.090 -9.316 -11.422 1.00 . B B . 32 ARG CD 1 1 1 1029 2 1 32 ARG CG C 12.486 -8.697 -11.333 1.00 . B B . 32 ARG CG 1 1 1 1030 2 1 32 ARG CZ C 9.091 -8.379 -10.199 1.00 . B B . 32 ARG CZ 1 1 1 1031 2 1 32 ARG N N 15.386 -8.386 -13.845 1.00 . B B . 32 ARG N 1 1 1 1032 2 1 32 ARG NE N 10.320 -8.935 -10.182 1.00 . B B . 32 ARG NE 1 1 1 1033 2 1 32 ARG NH1 N 8.554 -7.869 -11.317 1.00 . B B . 32 ARG NH1 1 1 1 1034 2 1 32 ARG NH2 N 8.359 -8.362 -9.077 1.00 . B B . 32 ARG NH2 1 1 1 1035 2 1 32 ARG O O 15.730 -8.983 -10.403 1.00 . B B . 32 ARG O 1 1 1 1036 2 1 33 PHE C C 17.926 -10.988 -10.747 1.00 . B B . 33 PHE C 1 1 1 1037 2 1 33 PHE CA C 16.625 -11.536 -11.293 1.00 . B B . 33 PHE CA 1 1 1 1038 2 1 33 PHE CB C 16.900 -12.763 -12.205 1.00 . B B . 33 PHE CB 1 1 1 1039 2 1 33 PHE CD1 C 16.234 -14.840 -10.960 1.00 . B B . 33 PHE CD1 1 1 1 1040 2 1 33 PHE CD2 C 18.590 -14.286 -11.081 1.00 . B B . 33 PHE CD2 1 1 1 1041 2 1 33 PHE CE1 C 16.539 -15.979 -10.207 1.00 . B B . 33 PHE CE1 1 1 1 1042 2 1 33 PHE CE2 C 18.897 -15.423 -10.322 1.00 . B B . 33 PHE CE2 1 1 1 1043 2 1 33 PHE CG C 17.254 -13.984 -11.403 1.00 . B B . 33 PHE CG 1 1 1 1044 2 1 33 PHE CZ C 17.871 -16.267 -9.886 1.00 . B B . 33 PHE CZ 1 1 1 1045 2 1 33 PHE N N 15.915 -10.528 -12.054 1.00 . B B . 33 PHE N 1 1 1 1046 2 1 33 PHE O O 18.286 -11.219 -9.593 1.00 . B B . 33 PHE O 1 1 1 1047 2 1 34 ARG C C 19.631 -8.314 -10.364 1.00 . B B . 34 ARG C 1 1 1 1048 2 1 34 ARG CA C 19.863 -9.513 -11.280 1.00 . B B . 34 ARG CA 1 1 1 1049 2 1 34 ARG CB C 20.505 -9.073 -12.620 1.00 . B B . 34 ARG CB 1 1 1 1050 2 1 34 ARG CD C 22.561 -8.522 -13.997 1.00 . B B . 34 ARG CD 1 1 1 1051 2 1 34 ARG CG C 22.014 -8.769 -12.583 1.00 . B B . 34 ARG CG 1 1 1 1052 2 1 34 ARG CZ C 24.822 -7.826 -14.857 1.00 . B B . 34 ARG CZ 1 1 1 1053 2 1 34 ARG N N 18.629 -10.204 -11.592 1.00 . B B . 34 ARG N 1 1 1 1054 2 1 34 ARG NE N 24.057 -8.424 -13.921 1.00 . B B . 34 ARG NE 1 1 1 1055 2 1 34 ARG NH1 N 24.278 -7.186 -15.898 1.00 . B B . 34 ARG NH1 1 1 1 1056 2 1 34 ARG NH2 N 26.161 -7.877 -14.774 1.00 . B B . 34 ARG NH2 1 1 1 1057 2 1 34 ARG O O 20.306 -8.133 -9.351 1.00 . B B . 34 ARG O 1 1 1 1058 2 1 35 VAL C C 17.752 -6.451 -8.585 1.00 . B B . 35 VAL C 1 1 1 1059 2 1 35 VAL CA C 18.239 -6.253 -10.000 1.00 . B B . 35 VAL CA 1 1 1 1060 2 1 35 VAL CB C 17.220 -5.452 -10.822 1.00 . B B . 35 VAL CB 1 1 1 1061 2 1 35 VAL CG1 C 16.115 -4.699 -10.037 1.00 . B B . 35 VAL CG1 1 1 1 1062 2 1 35 VAL CG2 C 18.011 -4.521 -11.763 1.00 . B B . 35 VAL CG2 1 1 1 1063 2 1 35 VAL N N 18.630 -7.469 -10.702 1.00 . B B . 35 VAL N 1 1 1 1064 2 1 35 VAL O O 18.165 -5.692 -7.709 1.00 . B B . 35 VAL O 1 1 1 1065 2 1 36 LYS C C 16.947 -7.492 -5.771 1.00 . B B . 36 LYS C 1 1 1 1066 2 1 36 LYS CA C 16.123 -7.527 -7.058 1.00 . B B . 36 LYS CA 1 1 1 1067 2 1 36 LYS CB C 15.200 -8.773 -7.028 1.00 . B B . 36 LYS CB 1 1 1 1068 2 1 36 LYS CD C 13.159 -9.885 -5.862 1.00 . B B . 36 LYS CD 1 1 1 1069 2 1 36 LYS CE C 13.805 -11.066 -5.128 1.00 . B B . 36 LYS CE 1 1 1 1070 2 1 36 LYS CG C 14.083 -8.659 -5.973 1.00 . B B . 36 LYS CG 1 1 1 1071 2 1 36 LYS N N 16.868 -7.448 -8.311 1.00 . B B . 36 LYS N 1 1 1 1072 2 1 36 LYS NZ N 12.794 -12.120 -4.882 1.00 . B B . 36 LYS NZ 1 1 1 1073 2 1 36 LYS O O 16.496 -6.970 -4.754 1.00 . B B . 36 LYS O 1 1 1 1074 2 1 37 LYS C C 19.497 -6.660 -4.153 1.00 . B B . 37 LYS C 1 1 1 1075 2 1 37 LYS CA C 19.111 -8.036 -4.681 1.00 . B B . 37 LYS CA 1 1 1 1076 2 1 37 LYS CB C 20.436 -8.736 -5.068 1.00 . B B . 37 LYS CB 1 1 1 1077 2 1 37 LYS CD C 21.680 -10.796 -5.804 1.00 . B B . 37 LYS CD 1 1 1 1078 2 1 37 LYS CE C 21.664 -12.306 -6.034 1.00 . B B . 37 LYS CE 1 1 1 1079 2 1 37 LYS CG C 20.311 -10.230 -5.388 1.00 . B B . 37 LYS CG 1 1 1 1080 2 1 37 LYS N N 18.186 -8.026 -5.801 1.00 . B B . 37 LYS N 1 1 1 1081 2 1 37 LYS NZ N 23.010 -12.764 -6.524 1.00 . B B . 37 LYS NZ 1 1 1 1082 2 1 37 LYS O O 19.273 -6.355 -2.986 1.00 . B B . 37 LYS O 1 1 1 1083 2 1 38 ASN C C 19.970 -3.416 -4.979 1.00 . B B . 38 ASN C 1 1 1 1084 2 1 38 ASN CA C 20.783 -4.598 -4.535 1.00 . B B . 38 ASN CA 1 1 1 1085 2 1 38 ASN CB C 22.214 -4.458 -5.106 1.00 . B B . 38 ASN CB 1 1 1 1086 2 1 38 ASN CG C 23.030 -5.654 -4.630 1.00 . B B . 38 ASN CG 1 1 1 1087 2 1 38 ASN N N 20.148 -5.828 -4.986 1.00 . B B . 38 ASN N 1 1 1 1088 2 1 38 ASN ND2 N 23.741 -5.484 -3.484 1.00 . B B . 38 ASN ND2 1 1 1 1089 2 1 38 ASN O O 19.915 -2.374 -4.327 1.00 . B B . 38 ASN O 1 1 1 1090 2 1 38 ASN OD1 O 23.016 -6.718 -5.253 1.00 . B B . 38 ASN OD1 1 1 1 1091 2 1 39 HIS C C 17.018 -2.720 -6.384 1.00 . B B . 39 HIS C 1 1 1 1092 2 1 39 HIS CA C 18.476 -2.537 -6.711 1.00 . B B . 39 HIS CA 1 1 1 1093 2 1 39 HIS CB C 18.701 -2.470 -8.221 1.00 . B B . 39 HIS CB 1 1 1 1094 2 1 39 HIS CD2 C 21.008 -3.321 -8.827 1.00 . B B . 39 HIS CD2 1 1 1 1095 2 1 39 HIS CE1 C 22.231 -1.648 -8.297 1.00 . B B . 39 HIS CE1 1 1 1 1096 2 1 39 HIS CG C 20.158 -2.331 -8.475 1.00 . B B . 39 HIS CG 1 1 1 1097 2 1 39 HIS N N 19.271 -3.579 -6.116 1.00 . B B . 39 HIS N 1 1 1 1098 2 1 39 HIS ND1 N 20.944 -1.254 -8.130 1.00 . B B . 39 HIS ND1 1 1 1 1099 2 1 39 HIS NE2 N 22.312 -2.896 -8.713 1.00 . B B . 39 HIS NE2 1 1 1 1100 2 1 39 HIS O O 16.144 -2.366 -7.170 1.00 . B B . 39 HIS O 1 1 1 1101 2 1 40 ARG C C 14.955 -1.701 -4.369 1.00 . B B . 40 ARG C 1 1 1 1102 2 1 40 ARG CA C 15.387 -3.149 -4.579 1.00 . B B . 40 ARG CA 1 1 1 1103 2 1 40 ARG CB C 15.347 -3.937 -3.248 1.00 . B B . 40 ARG CB 1 1 1 1104 2 1 40 ARG CD C 12.835 -3.540 -2.637 1.00 . B B . 40 ARG CD 1 1 1 1105 2 1 40 ARG CG C 13.973 -4.540 -2.880 1.00 . B B . 40 ARG CG 1 1 1 1106 2 1 40 ARG CZ C 10.554 -3.774 -1.646 1.00 . B B . 40 ARG CZ 1 1 1 1107 2 1 40 ARG N N 16.722 -3.188 -5.151 1.00 . B B . 40 ARG N 1 1 1 1108 2 1 40 ARG NE N 11.681 -4.336 -2.113 1.00 . B B . 40 ARG NE 1 1 1 1109 2 1 40 ARG NH1 N 10.260 -2.481 -1.817 1.00 . B B . 40 ARG NH1 1 1 1 1110 2 1 40 ARG NH2 N 9.629 -4.504 -1.004 1.00 . B B . 40 ARG NH2 1 1 1 1111 2 1 40 ARG O O 13.844 -1.299 -4.707 1.00 . B B . 40 ARG O 1 1 1 1112 2 1 41 HIS C C 15.714 1.333 -5.088 1.00 . B B . 41 HIS C 1 1 1 1113 2 1 41 HIS CA C 15.715 0.579 -3.759 1.00 . B B . 41 HIS CA 1 1 1 1114 2 1 41 HIS CB C 16.764 1.215 -2.813 1.00 . B B . 41 HIS CB 1 1 1 1115 2 1 41 HIS CD2 C 18.649 2.379 -4.129 1.00 . B B . 41 HIS CD2 1 1 1 1116 2 1 41 HIS CE1 C 19.838 0.675 -4.628 1.00 . B B . 41 HIS CE1 1 1 1 1117 2 1 41 HIS CG C 18.106 1.323 -3.464 1.00 . B B . 41 HIS CG 1 1 1 1118 2 1 41 HIS N N 15.896 -0.852 -3.897 1.00 . B B . 41 HIS N 1 1 1 1119 2 1 41 HIS ND1 N 18.883 0.238 -3.784 1.00 . B B . 41 HIS ND1 1 1 1 1120 2 1 41 HIS NE2 N 19.742 1.967 -4.876 1.00 . B B . 41 HIS NE2 1 1 1 1121 2 1 41 HIS O O 15.853 2.555 -5.107 1.00 . B B . 41 HIS O 1 1 1 1122 2 1 42 ARG C C 13.624 1.374 -7.570 1.00 . B B . 42 ARG C 1 1 1 1123 2 1 42 ARG CA C 15.122 1.280 -7.462 1.00 . B B . 42 ARG CA 1 1 1 1124 2 1 42 ARG CB C 15.591 0.532 -8.727 1.00 . B B . 42 ARG CB 1 1 1 1125 2 1 42 ARG CD C 17.444 2.064 -9.747 1.00 . B B . 42 ARG CD 1 1 1 1126 2 1 42 ARG CG C 17.075 0.740 -9.044 1.00 . B B . 42 ARG CG 1 1 1 1127 2 1 42 ARG CZ C 18.234 3.525 -7.823 1.00 . B B . 42 ARG CZ 1 1 1 1128 2 1 42 ARG N N 15.509 0.631 -6.227 1.00 . B B . 42 ARG N 1 1 1 1129 2 1 42 ARG NE N 17.389 3.288 -8.850 1.00 . B B . 42 ARG NE 1 1 1 1130 2 1 42 ARG NH1 N 19.126 2.603 -7.460 1.00 . B B . 42 ARG NH1 1 1 1 1131 2 1 42 ARG NH2 N 18.190 4.691 -7.170 1.00 . B B . 42 ARG NH2 1 1 1 1132 2 1 42 ARG O O 13.124 2.027 -8.481 1.00 . B B . 42 ARG O 1 1 1 1133 2 1 43 TYR C C 10.756 0.740 -5.432 1.00 . B B . 43 TYR C 1 1 1 1134 2 1 43 TYR CA C 11.414 0.840 -6.790 1.00 . B B . 43 TYR CA 1 1 1 1135 2 1 43 TYR CB C 10.841 -0.205 -7.800 1.00 . B B . 43 TYR CB 1 1 1 1136 2 1 43 TYR CD1 C 10.422 -2.328 -6.520 1.00 . B B . 43 TYR CD1 1 1 1 1137 2 1 43 TYR CD2 C 12.411 -2.202 -7.896 1.00 . B B . 43 TYR CD2 1 1 1 1138 2 1 43 TYR CE1 C 10.811 -3.592 -6.067 1.00 . B B . 43 TYR CE1 1 1 1 1139 2 1 43 TYR CE2 C 12.797 -3.475 -7.457 1.00 . B B . 43 TYR CE2 1 1 1 1140 2 1 43 TYR CG C 11.226 -1.612 -7.419 1.00 . B B . 43 TYR CG 1 1 1 1141 2 1 43 TYR CZ C 12.002 -4.161 -6.531 1.00 . B B . 43 TYR CZ 1 1 1 1142 2 1 43 TYR N N 12.851 0.743 -6.669 1.00 . B B . 43 TYR N 1 1 1 1143 2 1 43 TYR O O 11.383 0.388 -4.432 1.00 . B B . 43 TYR O 1 1 1 1144 2 1 43 TYR OH O 12.386 -5.420 -6.039 1.00 . B B . 43 TYR OH 1 1 1 1145 2 1 44 GLU C C 7.666 -0.262 -4.595 1.00 . B B . 44 GLU C 1 1 1 1146 2 1 44 GLU CA C 8.604 0.851 -4.238 1.00 . B B . 44 GLU CA 1 1 1 1147 2 1 44 GLU CB C 7.829 2.124 -3.882 1.00 . B B . 44 GLU CB 1 1 1 1148 2 1 44 GLU CD C 7.997 4.444 -3.055 1.00 . B B . 44 GLU CD 1 1 1 1149 2 1 44 GLU CG C 8.742 3.135 -3.173 1.00 . B B . 44 GLU CG 1 1 1 1150 2 1 44 GLU N N 9.451 1.077 -5.383 1.00 . B B . 44 GLU N 1 1 1 1151 2 1 44 GLU O O 7.837 -1.391 -4.147 1.00 . B B . 44 GLU O 1 1 1 1152 2 1 44 GLU OE1 O 6.938 4.474 -2.376 1.00 . B B . 44 GLU OE1 1 1 1 1153 2 1 44 GLU OE2 O 8.479 5.419 -3.695 1.00 . B B . 44 GLU OE2 1 1 1 1154 2 1 45 ASN C C 6.194 -1.081 -7.565 1.00 . B B . 45 ASN C 1 1 1 1155 2 1 45 ASN CA C 5.864 -1.016 -6.079 1.00 . B B . 45 ASN CA 1 1 1 1156 2 1 45 ASN CB C 4.340 -0.806 -5.838 1.00 . B B . 45 ASN CB 1 1 1 1157 2 1 45 ASN CG C 3.976 -1.212 -4.403 1.00 . B B . 45 ASN CG 1 1 1 1158 2 1 45 ASN N N 6.683 0.018 -5.477 1.00 . B B . 45 ASN N 1 1 1 1159 2 1 45 ASN ND2 N 3.476 -0.262 -3.573 1.00 . B B . 45 ASN ND2 1 1 1 1160 2 1 45 ASN O O 6.634 -0.116 -8.193 1.00 . B B . 45 ASN O 1 1 1 1161 2 1 45 ASN OD1 O 4.110 -2.374 -4.015 1.00 . B B . 45 ASN OD1 1 1 1 1162 2 1 46 CYS C C 5.397 -3.707 -9.944 1.00 . B B . 46 CYS C 1 1 1 1163 2 1 46 CYS CA C 6.328 -2.582 -9.541 1.00 . B B . 46 CYS CA 1 1 1 1164 2 1 46 CYS CB C 7.800 -3.024 -9.776 1.00 . B B . 46 CYS CB 1 1 1 1165 2 1 46 CYS N N 6.050 -2.286 -8.152 1.00 . B B . 46 CYS N 1 1 1 1166 2 1 46 CYS O O 4.766 -4.298 -9.075 1.00 . B B . 46 CYS O 1 1 1 1167 2 1 46 CYS SG S 8.301 -4.590 -8.965 1.00 . B B . 46 CYS SG 1 1 1 1168 2 1 47 THR C C 4.911 -6.516 -11.757 1.00 . B B . 47 THR C 1 1 1 1169 2 1 47 THR CA C 4.328 -5.104 -11.655 1.00 . B B . 47 THR CA 1 1 1 1170 2 1 47 THR CB C 3.662 -4.745 -12.984 1.00 . B B . 47 THR CB 1 1 1 1171 2 1 47 THR CG2 C 2.854 -3.454 -12.786 1.00 . B B . 47 THR CG2 1 1 1 1172 2 1 47 THR N N 5.277 -4.067 -11.239 1.00 . B B . 47 THR N 1 1 1 1173 2 1 47 THR O O 6.009 -6.847 -11.284 1.00 . B B . 47 THR O 1 1 1 1174 2 1 47 THR OG1 O 4.630 -4.538 -14.013 1.00 . B B . 47 THR OG1 1 1 1 1175 2 1 48 THR C C 5.029 -8.244 -14.459 1.00 . B B . 48 THR C 1 1 1 1176 2 1 48 THR CA C 4.615 -8.626 -13.045 1.00 . B B . 48 THR CA 1 1 1 1177 2 1 48 THR CB C 3.534 -9.715 -13.071 1.00 . B B . 48 THR CB 1 1 1 1178 2 1 48 THR CG2 C 3.102 -10.021 -11.630 1.00 . B B . 48 THR CG2 1 1 1 1179 2 1 48 THR N N 4.142 -7.402 -12.433 1.00 . B B . 48 THR N 1 1 1 1180 2 1 48 THR O O 5.189 -7.058 -14.758 1.00 . B B . 48 THR O 1 1 1 1181 2 1 48 THR OG1 O 2.366 -9.306 -13.778 1.00 . B B . 48 THR OG1 1 1 1 1182 2 1 49 THR C C 4.395 -9.003 -17.623 1.00 . B B . 49 THR C 1 1 1 1183 2 1 49 THR CA C 5.619 -8.940 -16.749 1.00 . B B . 49 THR CA 1 1 1 1184 2 1 49 THR CB C 6.613 -9.958 -17.301 1.00 . B B . 49 THR CB 1 1 1 1185 2 1 49 THR CG2 C 7.968 -9.748 -16.621 1.00 . B B . 49 THR CG2 1 1 1 1186 2 1 49 THR N N 5.225 -9.218 -15.373 1.00 . B B . 49 THR N 1 1 1 1187 2 1 49 THR O O 3.889 -10.094 -17.894 1.00 . B B . 49 THR O 1 1 1 1188 2 1 49 THR OG1 O 6.195 -11.290 -17.035 1.00 . B B . 49 THR OG1 1 1 1 1189 2 1 50 TRP C C 3.000 -7.609 -20.364 1.00 . B B . 50 TRP C 1 1 1 1190 2 1 50 TRP CA C 2.668 -7.834 -18.901 1.00 . B B . 50 TRP CA 1 1 1 1191 2 1 50 TRP CB C 1.534 -6.914 -18.337 1.00 . B B . 50 TRP CB 1 1 1 1192 2 1 50 TRP CD1 C 2.406 -4.831 -17.039 1.00 . B B . 50 TRP CD1 1 1 1 1193 2 1 50 TRP CD2 C 1.462 -4.372 -19.026 1.00 . B B . 50 TRP CD2 1 1 1 1194 2 1 50 TRP CE2 C 1.882 -3.162 -18.435 1.00 . B B . 50 TRP CE2 1 1 1 1195 2 1 50 TRP CE3 C 0.815 -4.376 -20.258 1.00 . B B . 50 TRP CE3 1 1 1 1196 2 1 50 TRP CG C 1.829 -5.434 -18.124 1.00 . B B . 50 TRP CG 1 1 1 1197 2 1 50 TRP CH2 C 1.055 -1.950 -20.337 1.00 . B B . 50 TRP CH2 1 1 1 1198 2 1 50 TRP CZ2 C 1.667 -1.946 -19.073 1.00 . B B . 50 TRP CZ2 1 1 1 1199 2 1 50 TRP CZ3 C 0.639 -3.153 -20.923 1.00 . B B . 50 TRP CZ3 1 1 1 1200 2 1 50 TRP N N 3.890 -7.845 -18.101 1.00 . B B . 50 TRP N 1 1 1 1201 2 1 50 TRP NE1 N 2.484 -3.468 -17.233 1.00 . B B . 50 TRP NE1 1 1 1 1202 2 1 50 TRP O O 4.162 -7.440 -20.734 1.00 . B B . 50 TRP O 1 1 1 1203 2 1 51 PHE C C 1.005 -6.842 -23.168 1.00 . B B . 51 PHE C 1 1 1 1204 2 1 51 PHE CA C 2.147 -7.686 -22.674 1.00 . B B . 51 PHE CA 1 1 1 1205 2 1 51 PHE CB C 2.041 -9.115 -23.283 1.00 . B B . 51 PHE CB 1 1 1 1206 2 1 51 PHE CD1 C 4.425 -9.939 -23.089 1.00 . B B . 51 PHE CD1 1 1 1 1207 2 1 51 PHE CD2 C 2.765 -10.861 -21.590 1.00 . B B . 51 PHE CD2 1 1 1 1208 2 1 51 PHE CE1 C 5.421 -10.686 -22.448 1.00 . B B . 51 PHE CE1 1 1 1 1209 2 1 51 PHE CE2 C 3.758 -11.606 -20.944 1.00 . B B . 51 PHE CE2 1 1 1 1210 2 1 51 PHE CG C 3.089 -10.004 -22.660 1.00 . B B . 51 PHE CG 1 1 1 1211 2 1 51 PHE CZ C 5.090 -11.516 -21.370 1.00 . B B . 51 PHE CZ 1 1 1 1212 2 1 51 PHE N N 1.976 -7.689 -21.242 1.00 . B B . 51 PHE N 1 1 1 1213 2 1 51 PHE O O -0.016 -6.740 -22.481 1.00 . B B . 51 PHE O 1 1 1 1214 2 1 52 THR C C -0.442 -6.196 -26.141 1.00 . B B . 52 THR C 1 1 1 1215 2 1 52 THR CA C 0.006 -5.461 -24.915 1.00 . B B . 52 THR CA 1 1 1 1216 2 1 52 THR CB C 0.323 -4.013 -25.284 1.00 . B B . 52 THR CB 1 1 1 1217 2 1 52 THR CG2 C -0.968 -3.171 -25.263 1.00 . B B . 52 THR CG2 1 1 1 1218 2 1 52 THR N N 1.116 -6.231 -24.364 1.00 . B B . 52 THR N 1 1 1 1219 2 1 52 THR O O 0.352 -6.909 -26.750 1.00 . B B . 52 THR O 1 1 1 1220 2 1 52 THR OG1 O 1.201 -3.436 -24.325 1.00 . B B . 52 THR OG1 1 1 1 1221 2 1 53 VAL C C -1.965 -5.465 -28.870 1.00 . B B . 53 VAL C 1 1 1 1222 2 1 53 VAL CA C -2.181 -6.544 -27.826 1.00 . B B . 53 VAL CA 1 1 1 1223 2 1 53 VAL CB C -3.640 -7.004 -27.820 1.00 . B B . 53 VAL CB 1 1 1 1224 2 1 53 VAL CG1 C -3.823 -8.100 -26.752 1.00 . B B . 53 VAL CG1 1 1 1 1225 2 1 53 VAL CG2 C -4.611 -5.835 -27.567 1.00 . B B . 53 VAL CG2 1 1 1 1226 2 1 53 VAL N N -1.721 -6.053 -26.543 1.00 . B B . 53 VAL N 1 1 1 1227 2 1 53 VAL O O -1.926 -4.277 -28.550 1.00 . B B . 53 VAL O 1 1 1 1228 2 1 54 ALA C C -3.422 -4.884 -31.708 1.00 . B B . 54 ALA C 1 1 1 1229 2 1 54 ALA CA C -1.974 -4.914 -31.253 1.00 . B B . 54 ALA CA 1 1 1 1230 2 1 54 ALA CB C -1.062 -5.267 -32.440 1.00 . B B . 54 ALA CB 1 1 1 1231 2 1 54 ALA N N -1.808 -5.843 -30.157 1.00 . B B . 54 ALA N 1 1 1 1232 2 1 54 ALA O O -4.232 -5.724 -31.319 1.00 . B B . 54 ALA O 1 1 1 1233 2 1 55 ASP C C -5.373 -4.478 -34.303 1.00 . B B . 55 ASP C 1 1 1 1234 2 1 55 ASP CA C -5.149 -3.711 -33.000 1.00 . B B . 55 ASP CA 1 1 1 1235 2 1 55 ASP CB C -5.463 -2.189 -33.088 1.00 . B B . 55 ASP CB 1 1 1 1236 2 1 55 ASP CG C -6.917 -1.946 -33.451 1.00 . B B . 55 ASP CG 1 1 1 1237 2 1 55 ASP N N -3.785 -3.889 -32.550 1.00 . B B . 55 ASP N 1 1 1 1238 2 1 55 ASP O O -5.977 -5.549 -34.309 1.00 . B B . 55 ASP O 1 1 1 1239 2 1 55 ASP OD1 O -7.275 -2.259 -34.614 1.00 . B B . 55 ASP OD1 1 1 1 1240 2 1 55 ASP OD2 O -7.719 -1.553 -32.561 1.00 . B B . 55 ASP OD2 1 1 1 1241 2 1 56 ASN C C -4.223 -5.589 -37.183 1.00 . B B . 56 ASN C 1 1 1 1242 2 1 56 ASN CA C -5.208 -4.498 -36.767 1.00 . B B . 56 ASN CA 1 1 1 1243 2 1 56 ASN CB C -5.170 -3.371 -37.847 1.00 . B B . 56 ASN CB 1 1 1 1244 2 1 56 ASN CG C -6.551 -2.819 -38.224 1.00 . B B . 56 ASN CG 1 1 1 1245 2 1 56 ASN N N -4.886 -3.949 -35.452 1.00 . B B . 56 ASN N 1 1 1 1246 2 1 56 ASN ND2 N -7.428 -2.489 -37.247 1.00 . B B . 56 ASN ND2 1 1 1 1247 2 1 56 ASN O O -4.582 -6.537 -37.881 1.00 . B B . 56 ASN O 1 1 1 1248 2 1 56 ASN OD1 O -6.826 -2.670 -39.419 1.00 . B B . 56 ASN OD1 1 1 1 1249 2 1 57 GLY C C -2.237 -7.669 -35.970 1.00 . B B . 57 GLY C 1 1 1 1250 2 1 57 GLY CA C -1.977 -6.569 -36.962 1.00 . B B . 57 GLY CA 1 1 1 1251 2 1 57 GLY N N -2.935 -5.484 -36.788 1.00 . B B . 57 GLY N 1 1 1 1252 2 1 57 GLY O O -2.545 -7.393 -34.814 1.00 . B B . 57 GLY O 1 1 1 1253 2 1 58 ALA C C -1.453 -10.350 -34.349 1.00 . B B . 58 ALA C 1 1 1 1254 2 1 58 ALA CA C -2.417 -10.095 -35.511 1.00 . B B . 58 ALA CA 1 1 1 1255 2 1 58 ALA CB C -2.512 -11.365 -36.382 1.00 . B B . 58 ALA CB 1 1 1 1256 2 1 58 ALA N N -2.078 -8.958 -36.360 1.00 . B B . 58 ALA N 1 1 1 1257 2 1 58 ALA O O -1.361 -11.465 -33.821 1.00 . B B . 58 ALA O 1 1 1 1258 2 1 59 GLU C C 0.001 -8.889 -31.539 1.00 . B B . 59 GLU C 1 1 1 1259 2 1 59 GLU CA C 0.337 -9.391 -32.934 1.00 . B B . 59 GLU CA 1 1 1 1260 2 1 59 GLU CB C 1.595 -8.666 -33.473 1.00 . B B . 59 GLU CB 1 1 1 1261 2 1 59 GLU CD C 3.308 -10.521 -32.896 1.00 . B B . 59 GLU CD 1 1 1 1262 2 1 59 GLU CG C 2.684 -9.639 -33.986 1.00 . B B . 59 GLU CG 1 1 1 1263 2 1 59 GLU N N -0.757 -9.305 -33.871 1.00 . B B . 59 GLU N 1 1 1 1264 2 1 59 GLU O O -1.056 -8.321 -31.257 1.00 . B B . 59 GLU O 1 1 1 1265 2 1 59 GLU OE1 O 2.865 -10.482 -31.718 1.00 . B B . 59 GLU OE1 1 1 1 1266 2 1 59 GLU OE2 O 4.240 -11.276 -33.261 1.00 . B B . 59 GLU OE2 1 1 1 1267 2 1 60 ARG C C 2.320 -7.740 -29.302 1.00 . B B . 60 ARG C 1 1 1 1268 2 1 60 ARG CA C 1.045 -8.584 -29.300 1.00 . B B . 60 ARG CA 1 1 1 1269 2 1 60 ARG CB C 1.129 -9.711 -28.212 1.00 . B B . 60 ARG CB 1 1 1 1270 2 1 60 ARG CD C -0.803 -11.464 -28.187 1.00 . B B . 60 ARG CD 1 1 1 1271 2 1 60 ARG CG C -0.208 -10.185 -27.593 1.00 . B B . 60 ARG CG 1 1 1 1272 2 1 60 ARG CZ C -1.680 -11.481 -30.539 1.00 . B B . 60 ARG CZ 1 1 1 1273 2 1 60 ARG N N 0.947 -9.140 -30.626 1.00 . B B . 60 ARG N 1 1 1 1274 2 1 60 ARG NE N -1.783 -11.078 -29.258 1.00 . B B . 60 ARG NE 1 1 1 1275 2 1 60 ARG NH1 N -0.628 -12.180 -30.995 1.00 . B B . 60 ARG NH1 1 1 1 1276 2 1 60 ARG NH2 N -2.571 -11.092 -31.457 1.00 . B B . 60 ARG NH2 1 1 1 1277 2 1 60 ARG O O 2.902 -7.433 -30.339 1.00 . B B . 60 ARG O 1 1 1 1278 2 1 61 GLN C C 4.784 -8.417 -27.338 1.00 . B B . 61 GLN C 1 1 1 1279 2 1 61 GLN CA C 4.221 -7.122 -27.874 1.00 . B B . 61 GLN CA 1 1 1 1280 2 1 61 GLN CB C 4.436 -6.031 -26.787 1.00 . B B . 61 GLN CB 1 1 1 1281 2 1 61 GLN CD C 3.681 -4.176 -28.356 1.00 . B B . 61 GLN CD 1 1 1 1282 2 1 61 GLN CG C 4.726 -4.618 -27.334 1.00 . B B . 61 GLN CG 1 1 1 1283 2 1 61 GLN N N 2.825 -7.415 -28.098 1.00 . B B . 61 GLN N 1 1 1 1284 2 1 61 GLN NE2 N 4.148 -4.002 -29.619 1.00 . B B . 61 GLN NE2 1 1 1 1285 2 1 61 GLN O O 4.271 -8.981 -26.374 1.00 . B B . 61 GLN O 1 1 1 1286 2 1 61 GLN OE1 O 2.491 -4.016 -28.067 1.00 . B B . 61 GLN OE1 1 1 1 1287 2 1 62 GLY C C 7.537 -9.751 -26.425 1.00 . B B . 62 GLY C 1 1 1 1288 2 1 62 GLY CA C 6.613 -10.100 -27.561 1.00 . B B . 62 GLY CA 1 1 1 1289 2 1 62 GLY N N 5.831 -8.952 -28.014 1.00 . B B . 62 GLY N 1 1 1 1290 2 1 62 GLY O O 7.921 -10.583 -25.605 1.00 . B B . 62 GLY O 1 1 1 1291 2 1 63 GLN C C 7.843 -7.740 -24.082 1.00 . B B . 63 GLN C 1 1 1 1292 2 1 63 GLN CA C 8.684 -7.835 -25.334 1.00 . B B . 63 GLN CA 1 1 1 1293 2 1 63 GLN CB C 9.138 -6.404 -25.726 1.00 . B B . 63 GLN CB 1 1 1 1294 2 1 63 GLN CD C 9.563 -6.564 -28.266 1.00 . B B . 63 GLN CD 1 1 1 1295 2 1 63 GLN CG C 10.171 -6.350 -26.876 1.00 . B B . 63 GLN CG 1 1 1 1296 2 1 63 GLN N N 7.949 -8.472 -26.392 1.00 . B B . 63 GLN N 1 1 1 1297 2 1 63 GLN NE2 N 10.457 -6.646 -29.282 1.00 . B B . 63 GLN NE2 1 1 1 1298 2 1 63 GLN O O 6.616 -7.643 -24.122 1.00 . B B . 63 GLN O 1 1 1 1299 2 1 63 GLN OE1 O 8.345 -6.669 -28.454 1.00 . B B . 63 GLN OE1 1 1 1 1300 2 1 64 ALA C C 7.769 -6.458 -21.091 1.00 . B B . 64 ALA C 1 1 1 1301 2 1 64 ALA CA C 7.836 -7.849 -21.656 1.00 . B B . 64 ALA CA 1 1 1 1302 2 1 64 ALA CB C 8.562 -8.793 -20.684 1.00 . B B . 64 ALA CB 1 1 1 1303 2 1 64 ALA N N 8.513 -7.785 -22.923 1.00 . B B . 64 ALA N 1 1 1 1304 2 1 64 ALA O O 8.770 -5.751 -21.007 1.00 . B B . 64 ALA O 1 1 1 1305 2 1 65 GLN C C 6.073 -4.710 -18.806 1.00 . B B . 65 GLN C 1 1 1 1306 2 1 65 GLN CA C 6.258 -4.693 -20.300 1.00 . B B . 65 GLN CA 1 1 1 1307 2 1 65 GLN CB C 4.985 -4.225 -21.042 1.00 . B B . 65 GLN CB 1 1 1 1308 2 1 65 GLN CD C 4.428 -2.346 -22.735 1.00 . B B . 65 GLN CD 1 1 1 1309 2 1 65 GLN CG C 5.013 -2.720 -21.366 1.00 . B B . 65 GLN CG 1 1 1 1310 2 1 65 GLN N N 6.551 -6.026 -20.728 1.00 . B B . 65 GLN N 1 1 1 1311 2 1 65 GLN NE2 N 4.713 -3.135 -23.802 1.00 . B B . 65 GLN NE2 1 1 1 1312 2 1 65 GLN O O 5.022 -5.074 -18.289 1.00 . B B . 65 GLN O 1 1 1 1313 2 1 65 GLN OE1 O 3.775 -1.310 -22.863 1.00 . B B . 65 GLN OE1 1 1 1 1314 2 1 66 ILE C C 6.701 -2.707 -16.340 1.00 . B B . 66 ILE C 1 1 1 1315 2 1 66 ILE CA C 7.000 -4.170 -16.609 1.00 . B B . 66 ILE CA 1 1 1 1316 2 1 66 ILE CB C 8.176 -4.662 -15.773 1.00 . B B . 66 ILE CB 1 1 1 1317 2 1 66 ILE CD1 C 10.703 -4.382 -15.297 1.00 . B B . 66 ILE CD1 1 1 1 1318 2 1 66 ILE CG1 C 9.490 -3.942 -16.125 1.00 . B B . 66 ILE CG1 1 1 1 1319 2 1 66 ILE CG2 C 8.321 -6.180 -15.977 1.00 . B B . 66 ILE CG2 1 1 1 1320 2 1 66 ILE N N 7.133 -4.396 -18.040 1.00 . B B . 66 ILE N 1 1 1 1321 2 1 66 ILE O O 7.117 -1.827 -17.094 1.00 . B B . 66 ILE O 1 1 1 1322 2 1 67 LEU C C 6.189 -0.789 -13.484 1.00 . B B . 67 LEU C 1 1 1 1323 2 1 67 LEU CA C 5.675 -1.029 -14.894 1.00 . B B . 67 LEU CA 1 1 1 1324 2 1 67 LEU CB C 4.151 -0.873 -15.095 1.00 . B B . 67 LEU CB 1 1 1 1325 2 1 67 LEU CD1 C 2.188 0.521 -15.761 1.00 . B B . 67 LEU CD1 1 1 1 1326 2 1 67 LEU CD2 C 3.300 0.968 -13.548 1.00 . B B . 67 LEU CD2 1 1 1 1327 2 1 67 LEU CG C 3.527 0.527 -15.001 1.00 . B B . 67 LEU CG 1 1 1 1328 2 1 67 LEU N N 5.998 -2.395 -15.239 1.00 . B B . 67 LEU N 1 1 1 1329 2 1 67 LEU O O 6.009 -1.633 -12.609 1.00 . B B . 67 LEU O 1 1 1 1330 2 1 68 ILE C C 7.239 1.943 -11.467 1.00 . B B . 68 ILE C 1 1 1 1331 2 1 68 ILE CA C 7.657 0.596 -12.021 1.00 . B B . 68 ILE CA 1 1 1 1332 2 1 68 ILE CB C 9.175 0.546 -12.266 1.00 . B B . 68 ILE CB 1 1 1 1333 2 1 68 ILE CD1 C 11.166 -1.122 -12.402 1.00 . B B . 68 ILE CD1 1 1 1 1334 2 1 68 ILE CG1 C 9.653 -0.926 -12.248 1.00 . B B . 68 ILE CG1 1 1 1 1335 2 1 68 ILE CG2 C 9.984 1.423 -11.283 1.00 . B B . 68 ILE CG2 1 1 1 1336 2 1 68 ILE N N 6.925 0.331 -13.259 1.00 . B B . 68 ILE N 1 1 1 1337 2 1 68 ILE O O 7.444 2.972 -12.116 1.00 . B B . 68 ILE O 1 1 1 1338 2 1 69 THR C C 7.100 3.444 -8.320 1.00 . B B . 69 THR C 1 1 1 1339 2 1 69 THR CA C 6.248 3.192 -9.551 1.00 . B B . 69 THR CA 1 1 1 1340 2 1 69 THR CB C 4.766 3.334 -9.206 1.00 . B B . 69 THR CB 1 1 1 1341 2 1 69 THR CG2 C 3.931 3.151 -10.479 1.00 . B B . 69 THR CG2 1 1 1 1342 2 1 69 THR N N 6.618 1.968 -10.253 1.00 . B B . 69 THR N 1 1 1 1343 2 1 69 THR O O 6.888 2.850 -7.257 1.00 . B B . 69 THR O 1 1 1 1344 2 1 69 THR OG1 O 4.332 2.365 -8.266 1.00 . B B . 69 THR OG1 1 1 1 1345 2 1 70 PHE C C 8.308 6.381 -7.131 1.00 . B B . 70 PHE C 1 1 1 1346 2 1 70 PHE CA C 8.809 4.970 -7.364 1.00 . B B . 70 PHE CA 1 1 1 1347 2 1 70 PHE CB C 10.335 5.004 -7.674 1.00 . B B . 70 PHE CB 1 1 1 1348 2 1 70 PHE CD1 C 10.543 6.637 -9.653 1.00 . B B . 70 PHE CD1 1 1 1 1349 2 1 70 PHE CD2 C 11.287 4.356 -9.920 1.00 . B B . 70 PHE CD2 1 1 1 1350 2 1 70 PHE CE1 C 10.939 6.920 -10.968 1.00 . B B . 70 PHE CE1 1 1 1 1351 2 1 70 PHE CE2 C 11.724 4.642 -11.218 1.00 . B B . 70 PHE CE2 1 1 1 1352 2 1 70 PHE CG C 10.697 5.345 -9.112 1.00 . B B . 70 PHE CG 1 1 1 1353 2 1 70 PHE CZ C 11.535 5.921 -11.749 1.00 . B B . 70 PHE CZ 1 1 1 1354 2 1 70 PHE N N 8.067 4.374 -8.446 1.00 . B B . 70 PHE N 1 1 1 1355 2 1 70 PHE O O 7.851 7.050 -8.060 1.00 . B B . 70 PHE O 1 1 1 1356 2 1 71 GLY C C 9.377 9.126 -5.995 1.00 . B B . 71 GLY C 1 1 1 1357 2 1 71 GLY CA C 8.214 8.273 -5.563 1.00 . B B . 71 GLY CA 1 1 1 1358 2 1 71 GLY N N 8.396 6.868 -5.873 1.00 . B B . 71 GLY N 1 1 1 1359 2 1 71 GLY O O 9.205 10.197 -6.566 1.00 . B B . 71 GLY O 1 1 1 1360 2 1 72 SER C C 12.205 9.841 -7.273 1.00 . B B . 72 SER C 1 1 1 1361 2 1 72 SER CA C 11.769 9.595 -5.832 1.00 . B B . 72 SER CA 1 1 1 1362 2 1 72 SER CB C 12.999 9.150 -4.999 1.00 . B B . 72 SER CB 1 1 1 1363 2 1 72 SER N N 10.621 8.709 -5.692 1.00 . B B . 72 SER N 1 1 1 1364 2 1 72 SER O O 12.338 8.882 -8.035 1.00 . B B . 72 SER O 1 1 1 1365 2 1 72 SER OG O 12.684 9.176 -3.607 1.00 . B B . 72 SER OG 1 1 1 1366 2 1 73 PRO C C 14.667 10.851 -8.815 1.00 . B B . 73 PRO C 1 1 1 1367 2 1 73 PRO CA C 13.228 11.286 -8.968 1.00 . B B . 73 PRO CA 1 1 1 1368 2 1 73 PRO CB C 13.108 12.794 -9.236 1.00 . B B . 73 PRO CB 1 1 1 1369 2 1 73 PRO CD C 12.114 12.332 -7.090 1.00 . B B . 73 PRO CD 1 1 1 1370 2 1 73 PRO CG C 12.878 13.418 -7.856 1.00 . B B . 73 PRO CG 1 1 1 1371 2 1 73 PRO N N 12.529 11.070 -7.708 1.00 . B B . 73 PRO N 1 1 1 1372 2 1 73 PRO O O 15.302 10.481 -9.800 1.00 . B B . 73 PRO O 1 1 1 1373 2 1 74 SER C C 16.557 8.755 -7.595 1.00 . B B . 74 SER C 1 1 1 1374 2 1 74 SER CA C 16.487 10.216 -7.248 1.00 . B B . 74 SER CA 1 1 1 1375 2 1 74 SER CB C 16.876 10.329 -5.753 1.00 . B B . 74 SER CB 1 1 1 1376 2 1 74 SER N N 15.201 10.814 -7.569 1.00 . B B . 74 SER N 1 1 1 1377 2 1 74 SER O O 17.605 8.199 -7.909 1.00 . B B . 74 SER O 1 1 1 1378 2 1 74 SER OG O 16.637 11.642 -5.254 1.00 . B B . 74 SER OG 1 1 1 1379 2 1 75 GLN C C 15.681 6.538 -9.489 1.00 . B B . 75 GLN C 1 1 1 1380 2 1 75 GLN CA C 15.282 6.711 -8.035 1.00 . B B . 75 GLN CA 1 1 1 1381 2 1 75 GLN CB C 13.882 6.111 -7.802 1.00 . B B . 75 GLN CB 1 1 1 1382 2 1 75 GLN CD C 13.418 5.185 -5.461 1.00 . B B . 75 GLN CD 1 1 1 1383 2 1 75 GLN CG C 13.877 4.865 -6.888 1.00 . B B . 75 GLN CG 1 1 1 1384 2 1 75 GLN N N 15.392 8.091 -7.623 1.00 . B B . 75 GLN N 1 1 1 1385 2 1 75 GLN NE2 N 14.138 4.635 -4.456 1.00 . B B . 75 GLN NE2 1 1 1 1386 2 1 75 GLN O O 16.466 5.644 -9.801 1.00 . B B . 75 GLN O 1 1 1 1387 2 1 75 GLN OE1 O 12.420 5.874 -5.244 1.00 . B B . 75 GLN OE1 1 1 1 1388 2 1 76 ARG C C 16.779 7.892 -12.200 1.00 . B B . 76 ARG C 1 1 1 1389 2 1 76 ARG CA C 15.389 7.439 -11.814 1.00 . B B . 76 ARG CA 1 1 1 1390 2 1 76 ARG CB C 14.362 8.438 -12.450 1.00 . B B . 76 ARG CB 1 1 1 1391 2 1 76 ARG CD C 13.232 9.411 -14.602 1.00 . B B . 76 ARG CD 1 1 1 1392 2 1 76 ARG CG C 14.156 8.338 -13.981 1.00 . B B . 76 ARG CG 1 1 1 1393 2 1 76 ARG CZ C 13.420 11.865 -15.167 1.00 . B B . 76 ARG CZ 1 1 1 1394 2 1 76 ARG N N 15.176 7.427 -10.375 1.00 . B B . 76 ARG N 1 1 1 1395 2 1 76 ARG NE N 13.980 10.707 -14.725 1.00 . B B . 76 ARG NE 1 1 1 1396 2 1 76 ARG NH1 N 12.164 11.908 -15.652 1.00 . B B . 76 ARG NH1 1 1 1 1397 2 1 76 ARG NH2 N 14.174 12.975 -15.150 1.00 . B B . 76 ARG NH2 1 1 1 1398 2 1 76 ARG O O 17.276 7.584 -13.282 1.00 . B B . 76 ARG O 1 1 1 1399 2 1 77 GLN C C 19.846 8.524 -11.006 1.00 . B B . 77 GLN C 1 1 1 1400 2 1 77 GLN CA C 18.688 9.308 -11.579 1.00 . B B . 77 GLN CA 1 1 1 1401 2 1 77 GLN CB C 18.621 10.762 -11.056 1.00 . B B . 77 GLN CB 1 1 1 1402 2 1 77 GLN CD C 18.473 13.045 -12.135 1.00 . B B . 77 GLN CD 1 1 1 1403 2 1 77 GLN CG C 19.322 11.777 -11.986 1.00 . B B . 77 GLN CG 1 1 1 1404 2 1 77 GLN N N 17.428 8.655 -11.308 1.00 . B B . 77 GLN N 1 1 1 1405 2 1 77 GLN NE2 N 18.802 14.110 -11.364 1.00 . B B . 77 GLN NE2 1 1 1 1406 2 1 77 GLN O O 20.824 8.246 -11.698 1.00 . B B . 77 GLN O 1 1 1 1407 2 1 77 GLN OE1 O 17.521 13.082 -12.919 1.00 . B B . 77 GLN OE1 1 1 1 1408 2 1 78 ASP C C 20.676 5.792 -9.637 1.00 . B B . 78 ASP C 1 1 1 1409 2 1 78 ASP CA C 20.749 7.223 -9.105 1.00 . B B . 78 ASP CA 1 1 1 1410 2 1 78 ASP CB C 20.711 7.334 -7.560 1.00 . B B . 78 ASP CB 1 1 1 1411 2 1 78 ASP CG C 20.943 8.790 -7.172 1.00 . B B . 78 ASP CG 1 1 1 1412 2 1 78 ASP N N 19.752 8.079 -9.727 1.00 . B B . 78 ASP N 1 1 1 1413 2 1 78 ASP O O 21.536 4.950 -9.373 1.00 . B B . 78 ASP O 1 1 1 1414 2 1 78 ASP OD1 O 21.964 9.373 -7.638 1.00 . B B . 78 ASP OD1 1 1 1 1415 2 1 78 ASP OD2 O 20.110 9.357 -6.426 1.00 . B B . 78 ASP OD2 1 1 1 1416 2 1 79 PHE C C 20.874 4.271 -12.209 1.00 . B B . 79 PHE C 1 1 1 1417 2 1 79 PHE CA C 19.573 4.487 -11.488 1.00 . B B . 79 PHE CA 1 1 1 1418 2 1 79 PHE CB C 18.409 4.820 -12.460 1.00 . B B . 79 PHE CB 1 1 1 1419 2 1 79 PHE CD1 C 18.439 2.500 -13.596 1.00 . B B . 79 PHE CD1 1 1 1 1420 2 1 79 PHE CD2 C 16.642 4.051 -14.031 1.00 . B B . 79 PHE CD2 1 1 1 1421 2 1 79 PHE CE1 C 17.860 1.582 -14.480 1.00 . B B . 79 PHE CE1 1 1 1 1422 2 1 79 PHE CE2 C 16.045 3.133 -14.899 1.00 . B B . 79 PHE CE2 1 1 1 1423 2 1 79 PHE CG C 17.843 3.751 -13.363 1.00 . B B . 79 PHE CG 1 1 1 1424 2 1 79 PHE CZ C 16.660 1.899 -15.128 1.00 . B B . 79 PHE CZ 1 1 1 1425 2 1 79 PHE N N 19.667 5.552 -10.511 1.00 . B B . 79 PHE N 1 1 1 1426 2 1 79 PHE O O 21.503 3.251 -11.971 1.00 . B B . 79 PHE O 1 1 1 1427 2 1 80 LEU C C 23.795 4.721 -13.308 1.00 . B B . 80 LEU C 1 1 1 1428 2 1 80 LEU CA C 22.445 4.951 -13.963 1.00 . B B . 80 LEU CA 1 1 1 1429 2 1 80 LEU CB C 22.559 6.071 -15.019 1.00 . B B . 80 LEU CB 1 1 1 1430 2 1 80 LEU CD1 C 21.565 4.969 -17.078 1.00 . B B . 80 LEU CD1 1 1 1 1431 2 1 80 LEU CD2 C 23.536 6.532 -17.323 1.00 . B B . 80 LEU CD2 1 1 1 1432 2 1 80 LEU CG C 22.849 5.499 -16.420 1.00 . B B . 80 LEU CG 1 1 1 1433 2 1 80 LEU N N 21.345 5.209 -13.058 1.00 . B B . 80 LEU N 1 1 1 1434 2 1 80 LEU O O 24.676 4.060 -13.852 1.00 . B B . 80 LEU O 1 1 1 1435 2 1 81 LYS C C 25.146 3.700 -10.663 1.00 . B B . 81 LYS C 1 1 1 1436 2 1 81 LYS CA C 25.092 5.110 -11.219 1.00 . B B . 81 LYS CA 1 1 1 1437 2 1 81 LYS CB C 24.955 6.064 -10.005 1.00 . B B . 81 LYS CB 1 1 1 1438 2 1 81 LYS CD C 24.707 8.372 -9.076 1.00 . B B . 81 LYS CD 1 1 1 1439 2 1 81 LYS CE C 24.798 9.894 -9.219 1.00 . B B . 81 LYS CE 1 1 1 1440 2 1 81 LYS CG C 25.206 7.555 -10.279 1.00 . B B . 81 LYS CG 1 1 1 1441 2 1 81 LYS N N 23.949 5.267 -12.095 1.00 . B B . 81 LYS N 1 1 1 1442 2 1 81 LYS NZ N 24.197 10.511 -8.018 1.00 . B B . 81 LYS NZ 1 1 1 1443 2 1 81 LYS O O 26.145 2.995 -10.775 1.00 . B B . 81 LYS O 1 1 1 1444 2 1 82 HIS C C 23.640 0.881 -10.082 1.00 . B B . 82 HIS C 1 1 1 1445 2 1 82 HIS CA C 24.002 2.073 -9.230 1.00 . B B . 82 HIS CA 1 1 1 1446 2 1 82 HIS CB C 23.086 2.224 -8.000 1.00 . B B . 82 HIS CB 1 1 1 1447 2 1 82 HIS CD2 C 23.664 4.560 -6.998 1.00 . B B . 82 HIS CD2 1 1 1 1448 2 1 82 HIS CE1 C 25.014 3.981 -5.440 1.00 . B B . 82 HIS CE1 1 1 1 1449 2 1 82 HIS CG C 23.698 3.199 -7.022 1.00 . B B . 82 HIS CG 1 1 1 1450 2 1 82 HIS N N 24.039 3.288 -10.006 1.00 . B B . 82 HIS N 1 1 1 1451 2 1 82 HIS ND1 N 24.571 2.836 -6.020 1.00 . B B . 82 HIS ND1 1 1 1 1452 2 1 82 HIS NE2 N 24.488 5.051 -6.003 1.00 . B B . 82 HIS NE2 1 1 1 1453 2 1 82 HIS O O 24.234 -0.178 -9.907 1.00 . B B . 82 HIS O 1 1 1 1454 2 1 83 VAL C C 22.378 0.600 -13.424 1.00 . B B . 83 VAL C 1 1 1 1455 2 1 83 VAL CA C 22.467 -0.024 -12.036 1.00 . B B . 83 VAL CA 1 1 1 1456 2 1 83 VAL CB C 21.284 -0.911 -11.679 1.00 . B B . 83 VAL CB 1 1 1 1457 2 1 83 VAL CG1 C 19.953 -0.159 -11.485 1.00 . B B . 83 VAL CG1 1 1 1 1458 2 1 83 VAL CG2 C 21.165 -2.097 -12.655 1.00 . B B . 83 VAL CG2 1 1 1 1459 2 1 83 VAL N N 22.680 0.995 -11.030 1.00 . B B . 83 VAL N 1 1 1 1460 2 1 83 VAL O O 21.294 0.986 -13.865 1.00 . B B . 83 VAL O 1 1 1 1461 2 1 84 PRO C C 22.599 0.378 -16.460 1.00 . B B . 84 PRO C 1 1 1 1462 2 1 84 PRO CA C 23.401 1.273 -15.540 1.00 . B B . 84 PRO CA 1 1 1 1463 2 1 84 PRO CB C 24.871 1.402 -15.983 1.00 . B B . 84 PRO CB 1 1 1 1464 2 1 84 PRO CD C 24.852 0.561 -13.742 1.00 . B B . 84 PRO CD 1 1 1 1465 2 1 84 PRO CG C 25.646 0.469 -15.045 1.00 . B B . 84 PRO CG 1 1 1 1466 2 1 84 PRO N N 23.467 0.729 -14.189 1.00 . B B . 84 PRO N 1 1 1 1467 2 1 84 PRO O O 22.723 -0.846 -16.399 1.00 . B B . 84 PRO O 1 1 1 1468 2 1 85 LEU C C 21.519 -0.453 -19.280 1.00 . B B . 85 LEU C 1 1 1 1469 2 1 85 LEU CA C 20.800 0.272 -18.138 1.00 . B B . 85 LEU CA 1 1 1 1470 2 1 85 LEU CB C 19.778 1.272 -18.736 1.00 . B B . 85 LEU CB 1 1 1 1471 2 1 85 LEU CD1 C 17.540 0.087 -18.358 1.00 . B B . 85 LEU CD1 1 1 1 1472 2 1 85 LEU CD2 C 17.817 1.702 -20.259 1.00 . B B . 85 LEU CD2 1 1 1 1473 2 1 85 LEU CG C 18.524 0.651 -19.392 1.00 . B B . 85 LEU CG 1 1 1 1474 2 1 85 LEU N N 21.729 0.987 -17.290 1.00 . B B . 85 LEU N 1 1 1 1475 2 1 85 LEU O O 22.421 0.137 -19.878 1.00 . B B . 85 LEU O 1 1 1 1476 2 1 86 PRO C C 21.123 -1.729 -22.139 1.00 . B B . 86 PRO C 1 1 1 1477 2 1 86 PRO CA C 21.699 -2.321 -20.849 1.00 . B B . 86 PRO CA 1 1 1 1478 2 1 86 PRO CB C 21.240 -3.789 -20.709 1.00 . B B . 86 PRO CB 1 1 1 1479 2 1 86 PRO CD C 20.553 -2.658 -18.736 1.00 . B B . 86 PRO CD 1 1 1 1480 2 1 86 PRO CG C 21.089 -4.007 -19.202 1.00 . B B . 86 PRO CG 1 1 1 1481 2 1 86 PRO N N 21.178 -1.690 -19.640 1.00 . B B . 86 PRO N 1 1 1 1482 2 1 86 PRO O O 20.040 -1.147 -22.071 1.00 . B B . 86 PRO O 1 1 1 1483 2 1 87 PRO C C 20.101 -2.678 -24.952 1.00 . B B . 87 PRO C 1 1 1 1484 2 1 87 PRO CA C 21.103 -1.590 -24.587 1.00 . B B . 87 PRO CA 1 1 1 1485 2 1 87 PRO CB C 22.286 -1.592 -25.568 1.00 . B B . 87 PRO CB 1 1 1 1486 2 1 87 PRO CD C 23.126 -2.340 -23.468 1.00 . B B . 87 PRO CD 1 1 1 1487 2 1 87 PRO CG C 23.266 -2.603 -24.966 1.00 . B B . 87 PRO CG 1 1 1 1488 2 1 87 PRO N N 21.751 -1.860 -23.306 1.00 . B B . 87 PRO N 1 1 1 1489 2 1 87 PRO O O 20.010 -3.700 -24.272 1.00 . B B . 87 PRO O 1 1 1 1490 2 1 88 GLY C C 16.968 -3.265 -25.931 1.00 . B B . 88 GLY C 1 1 1 1491 2 1 88 GLY CA C 18.343 -3.470 -26.507 1.00 . B B . 88 GLY CA 1 1 1 1492 2 1 88 GLY N N 19.306 -2.475 -26.028 1.00 . B B . 88 GLY N 1 1 1 1493 2 1 88 GLY O O 15.954 -3.509 -26.583 1.00 . B B . 88 GLY O 1 1 1 1494 2 1 89 MET C C 15.546 -0.913 -24.067 1.00 . B B . 89 MET C 1 1 1 1495 2 1 89 MET CA C 15.687 -2.416 -24.038 1.00 . B B . 89 MET CA 1 1 1 1496 2 1 89 MET CB C 15.608 -2.954 -22.589 1.00 . B B . 89 MET CB 1 1 1 1497 2 1 89 MET CE C 15.364 -3.474 -19.462 1.00 . B B . 89 MET CE 1 1 1 1498 2 1 89 MET CG C 16.683 -2.428 -21.616 1.00 . B B . 89 MET CG 1 1 1 1499 2 1 89 MET N N 16.915 -2.812 -24.672 1.00 . B B . 89 MET N 1 1 1 1500 2 1 89 MET O O 16.459 -0.170 -24.419 1.00 . B B . 89 MET O 1 1 1 1501 2 1 89 MET SD S 17.012 -3.549 -20.218 1.00 . B B . 89 MET SD 1 1 1 1502 2 1 90 ASN C C 13.220 0.998 -22.223 1.00 . B B . 90 ASN C 1 1 1 1503 2 1 90 ASN CA C 14.084 0.958 -23.459 1.00 . B B . 90 ASN CA 1 1 1 1504 2 1 90 ASN CB C 13.341 1.611 -24.654 1.00 . B B . 90 ASN CB 1 1 1 1505 2 1 90 ASN CG C 14.304 2.442 -25.503 1.00 . B B . 90 ASN CG 1 1 1 1506 2 1 90 ASN N N 14.354 -0.434 -23.681 1.00 . B B . 90 ASN N 1 1 1 1507 2 1 90 ASN ND2 N 14.140 2.401 -26.849 1.00 . B B . 90 ASN ND2 1 1 1 1508 2 1 90 ASN O O 12.624 -0.004 -21.825 1.00 . B B . 90 ASN O 1 1 1 1509 2 1 90 ASN OD1 O 15.136 3.175 -24.968 1.00 . B B . 90 ASN OD1 1 1 1 1510 2 1 91 ILE C C 11.684 3.722 -20.767 1.00 . B B . 91 ILE C 1 1 1 1511 2 1 91 ILE CA C 12.474 2.506 -20.384 1.00 . B B . 91 ILE CA 1 1 1 1512 2 1 91 ILE CB C 13.411 2.893 -19.227 1.00 . B B . 91 ILE CB 1 1 1 1513 2 1 91 ILE CD1 C 15.229 4.551 -18.387 1.00 . B B . 91 ILE CD1 1 1 1 1514 2 1 91 ILE CG1 C 14.405 4.042 -19.577 1.00 . B B . 91 ILE CG1 1 1 1 1515 2 1 91 ILE CG2 C 14.172 1.628 -18.782 1.00 . B B . 91 ILE CG2 1 1 1 1516 2 1 91 ILE N N 13.183 2.180 -21.591 1.00 . B B . 91 ILE N 1 1 1 1517 2 1 91 ILE O O 12.112 4.493 -21.627 1.00 . B B . 91 ILE O 1 1 1 1518 2 1 92 SER C C 9.272 5.776 -19.076 1.00 . B B . 92 SER C 1 1 1 1519 2 1 92 SER CA C 9.965 5.341 -20.324 1.00 . B B . 92 SER CA 1 1 1 1520 2 1 92 SER CB C 9.092 5.569 -21.571 1.00 . B B . 92 SER CB 1 1 1 1521 2 1 92 SER N N 10.495 3.988 -20.210 1.00 . B B . 92 SER N 1 1 1 1522 2 1 92 SER O O 8.421 5.065 -18.552 1.00 . B B . 92 SER O 1 1 1 1523 2 1 92 SER OG O 9.958 5.704 -22.695 1.00 . B B . 92 SER OG 1 1 1 1524 2 1 93 GLY C C 7.852 8.346 -17.793 1.00 . B B . 93 GLY C 1 1 1 1525 2 1 93 GLY CA C 9.054 7.570 -17.392 1.00 . B B . 93 GLY CA 1 1 1 1526 2 1 93 GLY N N 9.633 6.980 -18.582 1.00 . B B . 93 GLY N 1 1 1 1527 2 1 93 GLY O O 7.969 9.401 -18.413 1.00 . B B . 93 GLY O 1 1 1 1528 2 1 94 PHE C C 4.998 9.004 -16.355 1.00 . B B . 94 PHE C 1 1 1 1529 2 1 94 PHE CA C 5.440 8.518 -17.705 1.00 . B B . 94 PHE CA 1 1 1 1530 2 1 94 PHE CB C 4.361 7.600 -18.313 1.00 . B B . 94 PHE CB 1 1 1 1531 2 1 94 PHE CD1 C 4.069 8.162 -20.754 1.00 . B B . 94 PHE CD1 1 1 1 1532 2 1 94 PHE CD2 C 5.355 6.193 -20.180 1.00 . B B . 94 PHE CD2 1 1 1 1533 2 1 94 PHE CE1 C 4.269 7.895 -22.114 1.00 . B B . 94 PHE CE1 1 1 1 1534 2 1 94 PHE CE2 C 5.545 5.916 -21.541 1.00 . B B . 94 PHE CE2 1 1 1 1535 2 1 94 PHE CG C 4.617 7.319 -19.771 1.00 . B B . 94 PHE CG 1 1 1 1536 2 1 94 PHE CZ C 5.009 6.775 -22.509 1.00 . B B . 94 PHE CZ 1 1 1 1537 2 1 94 PHE N N 6.672 7.822 -17.459 1.00 . B B . 94 PHE N 1 1 1 1538 2 1 94 PHE O O 4.830 8.227 -15.419 1.00 . B B . 94 PHE O 1 1 1 1539 2 1 95 THR C C 3.004 11.131 -15.020 1.00 . B B . 95 THR C 1 1 1 1540 2 1 95 THR CA C 4.499 10.967 -14.956 1.00 . B B . 95 THR CA 1 1 1 1541 2 1 95 THR CB C 5.204 12.307 -14.783 1.00 . B B . 95 THR CB 1 1 1 1542 2 1 95 THR CG2 C 4.831 12.922 -13.424 1.00 . B B . 95 THR CG2 1 1 1 1543 2 1 95 THR N N 4.802 10.319 -16.206 1.00 . B B . 95 THR N 1 1 1 1544 2 1 95 THR O O 2.434 11.630 -15.989 1.00 . B B . 95 THR O 1 1 1 1545 2 1 95 THR OG1 O 6.617 12.106 -14.788 1.00 . B B . 95 THR OG1 1 1 1 1546 2 1 96 ALA C C 0.069 11.290 -13.464 1.00 . B B . 96 ALA C 1 1 1 1547 2 1 96 ALA CA C 0.931 10.236 -14.115 1.00 . B B . 96 ALA CA 1 1 1 1548 2 1 96 ALA CB C 0.687 8.881 -13.419 1.00 . B B . 96 ALA CB 1 1 1 1549 2 1 96 ALA N N 2.327 10.574 -14.012 1.00 . B B . 96 ALA N 1 1 1 1550 2 1 96 ALA O O 0.219 11.574 -12.279 1.00 . B B . 96 ALA O 1 1 1 1551 2 1 97 SER C C -3.173 12.244 -13.646 1.00 . B B . 97 SER C 1 1 1 1552 2 1 97 SER CA C -1.803 12.861 -13.683 1.00 . B B . 97 SER CA 1 1 1 1553 2 1 97 SER CB C -1.913 14.179 -14.486 1.00 . B B . 97 SER CB 1 1 1 1554 2 1 97 SER N N -0.868 11.891 -14.231 1.00 . B B . 97 SER N 1 1 1 1555 2 1 97 SER O O -3.704 11.800 -14.659 1.00 . B B . 97 SER O 1 1 1 1556 2 1 97 SER OG O -0.762 14.986 -14.245 1.00 . B B . 97 SER OG 1 1 1 1557 2 1 98 LEU C C -6.091 12.935 -12.706 1.00 . B B . 98 LEU C 1 1 1 1558 2 1 98 LEU CA C -5.172 11.800 -12.250 1.00 . B B . 98 LEU CA 1 1 1 1559 2 1 98 LEU CB C -5.392 11.473 -10.750 1.00 . B B . 98 LEU CB 1 1 1 1560 2 1 98 LEU CD1 C -6.550 10.272 -8.875 1.00 . B B . 98 LEU CD1 1 1 1 1561 2 1 98 LEU CD2 C -7.981 11.188 -10.674 1.00 . B B . 98 LEU CD2 1 1 1 1562 2 1 98 LEU CG C -6.609 10.591 -10.373 1.00 . B B . 98 LEU CG 1 1 1 1563 2 1 98 LEU N N -3.786 12.186 -12.451 1.00 . B B . 98 LEU N 1 1 1 1564 2 1 98 LEU O O -5.857 14.086 -12.347 1.00 . B B . 98 LEU O 1 1 1 1565 2 1 99 ASP C C -9.261 13.919 -13.445 1.00 . B B . 99 ASP C 1 1 1 1566 2 1 99 ASP CA C -7.944 13.641 -14.171 1.00 . B B . 99 ASP CA 1 1 1 1567 2 1 99 ASP CB C -8.215 13.142 -15.614 1.00 . B B . 99 ASP CB 1 1 1 1568 2 1 99 ASP CG C -8.663 14.284 -16.509 1.00 . B B . 99 ASP CG 1 1 1 1569 2 1 99 ASP N N -7.134 12.631 -13.516 1.00 . B B . 99 ASP N 1 1 1 1570 2 1 99 ASP O O -9.731 15.055 -13.419 1.00 . B B . 99 ASP O 1 1 1 1571 2 1 99 ASP OD1 O -7.788 15.097 -16.899 1.00 . B B . 99 ASP OD1 1 1 1 1572 2 1 99 ASP OD2 O -9.884 14.334 -16.827 1.00 . B B . 99 ASP OD2 1 1 1 1573 2 1 100 PHE C C -11.197 13.644 -10.888 1.00 . B B . 100 PHE C 1 1 1 1574 2 1 100 PHE CA C -11.203 12.904 -12.248 1.00 . B B . 100 PHE CA 1 1 1 1575 2 1 100 PHE CB C -11.733 11.476 -11.899 1.00 . B B . 100 PHE CB 1 1 1 1576 2 1 100 PHE CD1 C -11.532 10.457 -14.254 1.00 . B B . 100 PHE CD1 1 1 1 1577 2 1 100 PHE CD2 C -13.407 9.875 -12.843 1.00 . B B . 100 PHE CD2 1 1 1 1578 2 1 100 PHE CE1 C -12.015 9.587 -15.238 1.00 . B B . 100 PHE CE1 1 1 1 1579 2 1 100 PHE CE2 C -13.899 9.018 -13.831 1.00 . B B . 100 PHE CE2 1 1 1 1580 2 1 100 PHE CG C -12.228 10.621 -13.041 1.00 . B B . 100 PHE CG 1 1 1 1581 2 1 100 PHE CZ C -13.202 8.876 -15.035 1.00 . B B . 100 PHE CZ 1 1 1 1582 2 1 100 PHE N N -9.886 12.870 -12.866 1.00 . B B . 100 PHE N 1 1 1 1583 2 1 100 PHE O O -11.972 14.625 -10.729 1.00 . B B . 100 PHE O 1 1 1 1584 2 1 100 PHE OXT O -10.475 13.166 -9.969 1.00 . B B . 100 PHE OXT 1 1 stop_ save_
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