NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
639296 | 6dul | 30482 | cing | 4-filtered-FRED | STAR | entry | full | 144 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6dul # This FRED archive file contains, for PDB entry <6dul>: # # - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. 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.PDB_coordinate_file_version . _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_6dul _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6dul _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1481.93 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 $mastoparano_L A . 1 1 stop_ save_ save_mastoparano_L _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "mastoparano L" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code INLKALAALAKKILX _Entity.Number_of_monomers 15 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 ILE . 1 1 2 ASN . 1 1 3 LEU . 1 1 4 LYS . 1 1 5 ALA . 1 1 6 LEU . 1 1 7 ALA . 1 1 8 ALA . 1 1 9 LEU . 1 1 10 ALA . 1 1 11 LYS . 1 1 12 LYS . 1 1 13 ILE . 1 1 14 LEU . 1 1 15 NH2 $NH2 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 ILE 1 1 1 1 ASN 2 2 1 1 LEU 3 3 1 1 LYS 4 4 1 1 ALA 5 5 1 1 LEU 6 6 1 1 ALA 7 7 1 1 ALA 8 8 1 1 LEU 9 9 1 1 ALA 10 10 1 1 LYS 11 11 1 1 LYS 12 12 1 1 ILE 13 13 1 1 LEU 14 14 1 1 NH2 15 15 1 1 stop_ save_ save_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NH2 _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 ILE H1 . 1 . HT# 1 1 1 1 2 1 1 1 ILE HA . 1 . HA 1 1 2 1 1 1 1 1 ILE HA . 1 . HA 1 1 2 1 2 1 1 2 ASN HD21 . 2 . HD21 1 1 3 1 1 1 1 1 ILE HA . 1 . HA 1 1 3 1 2 1 1 2 ASN HD22 . 2 . HD22 1 1 4 1 1 1 1 1 ILE HB . 1 . HB 1 1 4 1 2 1 1 1 ILE HG12 . 1 . HG12 1 1 5 1 1 1 1 1 ILE HB . 1 . HB 1 1 5 1 2 1 1 2 ASN HD22 . 2 . HD22 1 1 6 1 1 1 1 1 ILE HG12 . 1 . HG12 1 1 6 1 2 1 1 2 ASN QB . 2 . HB# 1 1 7 1 1 1 1 1 ILE HG12 . 1 . HG12 1 1 7 1 2 1 1 2 ASN HD22 . 2 . HD22 1 1 8 1 1 1 1 2 ASN H . 2 . HN 1 1 8 1 2 1 1 2 ASN HD22 . 2 . HD22 1 1 9 1 1 1 1 2 ASN H . 2 . HN 1 1 9 1 2 1 1 3 LEU H . 3 . HN 1 1 10 1 1 1 1 2 ASN HA . 2 . HA 1 1 10 1 2 1 1 2 ASN HD22 . 2 . HD22 1 1 11 1 1 1 1 2 ASN HA . 2 . HA 1 1 11 1 2 1 1 3 LEU H . 3 . HN 1 1 12 1 1 1 1 2 ASN HA . 2 . HA 1 1 12 1 2 1 1 3 LEU HA . 3 . HA 1 1 13 1 1 1 1 2 ASN HA . 2 . HA 1 1 13 1 2 1 1 3 LEU HB2 . 3 . HB2 1 1 14 1 1 1 1 2 ASN HA . 2 . HA 1 1 14 1 2 1 1 3 LEU HG . 3 . HG 1 1 15 1 1 1 1 2 ASN HA . 2 . HA 1 1 15 1 2 1 1 5 ALA H . 5 . HN 1 1 16 1 1 1 1 2 ASN QB . 2 . HB# 1 1 16 1 2 1 1 3 LEU H . 3 . HN 1 1 17 1 1 1 1 3 LEU H . 3 . HN 1 1 17 1 2 1 1 3 LEU HB2 . 3 . HB2 1 1 18 1 1 1 1 3 LEU H . 3 . HN 1 1 18 1 2 1 1 3 LEU QD . 3 . HD## 1 1 19 1 1 1 1 3 LEU H . 3 . HN 1 1 19 1 2 1 1 3 LEU HG . 3 . HG 1 1 20 1 1 1 1 3 LEU H . 3 . HN 1 1 20 1 2 1 1 4 LYS HA . 4 . HA 1 1 21 1 1 1 1 3 LEU H . 3 . HN 1 1 21 1 2 1 1 5 ALA H . 5 . HN 1 1 22 1 1 1 1 3 LEU HA . 3 . HA 1 1 22 1 2 1 1 3 LEU HB2 . 3 . HB2 1 1 23 1 1 1 1 3 LEU HA . 3 . HA 1 1 23 1 2 1 1 3 LEU QB . 3 . HB# 1 1 24 1 1 1 1 3 LEU HA . 3 . HA 1 1 24 1 2 1 1 4 LYS H . 4 . HN 1 1 25 1 1 1 1 3 LEU QB . 3 . HB# 1 1 25 1 2 1 1 3 LEU HG . 3 . HG 1 1 26 1 1 1 1 3 LEU QD . 3 . HD## 1 1 26 1 2 1 1 4 LYS H . 4 . HN 1 1 27 1 1 1 1 4 LYS H . 4 . HN 1 1 27 1 2 1 1 4 LYS HB2 . 4 . HB2 1 1 28 1 1 1 1 4 LYS H . 4 . HN 1 1 28 1 2 1 1 4 LYS QB . 4 . HB# 1 1 29 1 1 1 1 4 LYS H . 4 . HN 1 1 29 1 2 1 1 4 LYS HD2 . 4 . HD2 1 1 30 1 1 1 1 4 LYS H . 4 . HN 1 1 30 1 2 1 1 4 LYS QE . 4 . HE# 1 1 31 1 1 1 1 4 LYS H . 4 . HN 1 1 31 1 2 1 1 4 LYS HG2 . 4 . HG2 1 1 32 1 1 1 1 4 LYS H . 4 . HN 1 1 32 1 2 1 1 5 ALA H . 5 . HN 1 1 33 1 1 1 1 4 LYS HA . 4 . HA 1 1 33 1 2 1 1 4 LYS HD2 . 4 . HD2 1 1 34 1 1 1 1 4 LYS HA . 4 . HA 1 1 34 1 2 1 1 4 LYS HD3 . 4 . HD1 1 1 35 1 1 1 1 4 LYS HA . 4 . HA 1 1 35 1 2 1 1 5 ALA H . 5 . HN 1 1 36 1 1 1 1 4 LYS QB . 4 . HB# 1 1 36 1 2 1 1 5 ALA H . 5 . HN 1 1 37 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 37 1 2 1 1 4 LYS QE . 4 . HE# 1 1 38 1 1 1 1 4 LYS HB2 . 4 . HB2 1 1 38 1 2 1 1 5 ALA HA . 5 . HA 1 1 39 1 1 1 1 4 LYS HE2 . 4 . HE2 1 1 39 1 2 1 1 4 LYS HG2 . 4 . HG2 1 1 40 1 1 1 1 5 ALA H . 5 . HN 1 1 40 1 2 1 1 5 ALA HA . 5 . HA 1 1 41 1 1 1 1 6 LEU H . 6 . HN 1 1 41 1 2 1 1 6 LEU HA . 6 . HA 1 1 42 1 1 1 1 6 LEU H . 6 . HN 1 1 42 1 2 1 1 6 LEU QB . 6 . HB# 1 1 43 1 1 1 1 6 LEU H . 6 . HN 1 1 43 1 2 1 1 6 LEU HG . 6 . HG 1 1 44 1 1 1 1 6 LEU HA . 6 . HA 1 1 44 1 2 1 1 6 LEU QD . 6 . HD## 1 1 45 1 1 1 1 6 LEU HA . 6 . HA 1 1 45 1 2 1 1 6 LEU HG . 6 . HG 1 1 46 1 1 1 1 6 LEU HA . 6 . HA 1 1 46 1 2 1 1 7 ALA H . 7 . HN 1 1 47 1 1 1 1 6 LEU QB . 6 . HB# 1 1 47 1 2 1 1 7 ALA H . 7 . HN 1 1 48 1 1 1 1 6 LEU QD . 6 . HD## 1 1 48 1 2 1 1 7 ALA H . 7 . HN 1 1 49 1 1 1 1 6 LEU HG . 6 . HG 1 1 49 1 2 1 1 7 ALA H . 7 . HN 1 1 50 1 1 1 1 7 ALA H . 7 . HN 1 1 50 1 2 1 1 7 ALA MB . 7 . HB# 1 1 51 1 1 1 1 7 ALA H . 7 . HN 1 1 51 1 2 1 1 8 ALA H . 8 . HN 1 1 52 1 1 1 1 7 ALA HA . 7 . HA 1 1 52 1 2 1 1 8 ALA H . 8 . HN 1 1 53 1 1 1 1 7 ALA HA . 7 . HA 1 1 53 1 2 1 1 10 ALA H . 10 . HN 1 1 54 1 1 1 1 7 ALA MB . 7 . HB# 1 1 54 1 2 1 1 8 ALA HA . 8 . HA 1 1 55 1 1 1 1 8 ALA H . 8 . HN 1 1 55 1 2 1 1 8 ALA MB . 8 . HB# 1 1 56 1 1 1 1 8 ALA HA . 8 . HA 1 1 56 1 2 1 1 9 LEU HG . 9 . HG 1 1 57 1 1 1 1 8 ALA HA . 8 . HA 1 1 57 1 2 1 1 11 LYS H . 11 . HN 1 1 58 1 1 1 1 9 LEU H . 9 . HN 1 1 58 1 2 1 1 9 LEU QB . 9 . HB# 1 1 59 1 1 1 1 9 LEU H . 9 . HN 1 1 59 1 2 1 1 9 LEU MD1 . 9 . HD1# 1 1 60 1 1 1 1 9 LEU H . 9 . HN 1 1 60 1 2 1 1 9 LEU HG . 9 . HG 1 1 61 1 1 1 1 9 LEU H . 9 . HN 1 1 61 1 2 1 1 10 ALA H . 10 . HN 1 1 62 1 1 1 1 9 LEU HA . 9 . HA 1 1 62 1 2 1 1 10 ALA H . 10 . HN 1 1 63 1 1 1 1 9 LEU HA . 9 . HA 1 1 63 1 2 1 1 12 LYS H . 12 . HN 1 1 64 1 1 1 1 9 LEU QB . 9 . HB# 1 1 64 1 2 1 1 10 ALA H . 10 . HN 1 1 65 1 1 1 1 9 LEU MD1 . 9 . HD1# 1 1 65 1 2 1 1 10 ALA H . 10 . HN 1 1 66 1 1 1 1 9 LEU MD2 . 9 . HD2# 1 1 66 1 2 1 1 10 ALA H . 10 . HN 1 1 67 1 1 1 1 10 ALA H . 10 . HN 1 1 67 1 2 1 1 10 ALA MB . 10 . HB# 1 1 68 1 1 1 1 10 ALA H . 10 . HN 1 1 68 1 2 1 1 11 LYS H . 11 . HN 1 1 69 1 1 1 1 10 ALA HA . 10 . HA 1 1 69 1 2 1 1 13 ILE H . 13 . HN 1 1 70 1 1 1 1 11 LYS H . 11 . HN 1 1 70 1 2 1 1 11 LYS HB2 . 11 . HB2 1 1 71 1 1 1 1 11 LYS H . 11 . HN 1 1 71 1 2 1 1 11 LYS QB . 11 . HB# 1 1 72 1 1 1 1 11 LYS H . 11 . HN 1 1 72 1 2 1 1 11 LYS HG2 . 11 . HG2 1 1 73 1 1 1 1 11 LYS H . 11 . HN 1 1 73 1 2 1 1 11 LYS QG . 11 . HG# 1 1 74 1 1 1 1 11 LYS H . 11 . HN 1 1 74 1 2 1 1 12 LYS H . 12 . HN 1 1 75 1 1 1 1 11 LYS H . 11 . HN 1 1 75 1 2 1 1 12 LYS HD2 . 12 . HD2 1 1 76 1 1 1 1 11 LYS H . 11 . HN 1 1 76 1 2 1 1 12 LYS HD3 . 12 . HD1 1 1 77 1 1 1 1 11 LYS HA . 11 . HA 1 1 77 1 2 1 1 11 LYS HB2 . 11 . HB2 1 1 78 1 1 1 1 11 LYS HA . 11 . HA 1 1 78 1 2 1 1 11 LYS QB . 11 . HB# 1 1 79 1 1 1 1 11 LYS HA . 11 . HA 1 1 79 1 2 1 1 11 LYS QG . 11 . HG# 1 1 80 1 1 1 1 11 LYS HA . 11 . HA 1 1 80 1 2 1 1 12 LYS H . 12 . HN 1 1 81 1 1 1 1 11 LYS HA . 11 . HA 1 1 81 1 2 1 1 12 LYS QD . 12 . HD# 1 1 82 1 1 1 1 11 LYS HA . 11 . HA 1 1 82 1 2 1 1 13 ILE H . 13 . HN 1 1 83 1 1 1 1 11 LYS HA . 11 . HA 1 1 83 1 2 1 1 14 LEU H . 14 . HN 1 1 84 1 1 1 1 11 LYS QB . 11 . HB# 1 1 84 1 2 1 1 12 LYS H . 12 . HN 1 1 85 1 1 1 1 11 LYS HB2 . 11 . HB2 1 1 85 1 2 1 1 12 LYS H . 12 . HN 1 1 86 1 1 1 1 11 LYS QE . 11 . HE# 1 1 86 1 2 1 1 11 LYS HG2 . 11 . HG2 1 1 87 1 1 1 1 11 LYS HG2 . 11 . HG2 1 1 87 1 2 1 1 12 LYS H . 12 . HN 1 1 88 1 1 1 1 12 LYS H . 12 . HN 1 1 88 1 2 1 1 12 LYS HA . 12 . HA 1 1 89 1 1 1 1 12 LYS H . 12 . HN 1 1 89 1 2 1 1 12 LYS HB2 . 12 . HB2 1 1 90 1 1 1 1 12 LYS H . 12 . HN 1 1 90 1 2 1 1 12 LYS QB . 12 . HB# 1 1 91 1 1 1 1 12 LYS H . 12 . HN 1 1 91 1 2 1 1 12 LYS HD2 . 12 . HD2 1 1 92 1 1 1 1 12 LYS H . 12 . HN 1 1 92 1 2 1 1 12 LYS QD . 12 . HD# 1 1 93 1 1 1 1 12 LYS H . 12 . HN 1 1 93 1 2 1 1 12 LYS QG . 12 . HG# 1 1 94 1 1 1 1 12 LYS H . 12 . HN 1 1 94 1 2 1 1 13 ILE H . 13 . HN 1 1 95 1 1 1 1 12 LYS HA . 12 . HA 1 1 95 1 2 1 1 12 LYS QB . 12 . HB# 1 1 96 1 1 1 1 12 LYS HA . 12 . HA 1 1 96 1 2 1 1 12 LYS QE . 12 . HE# 1 1 97 1 1 1 1 12 LYS HA . 12 . HA 1 1 97 1 2 1 1 12 LYS QG . 12 . HG# 1 1 98 1 1 1 1 12 LYS HA . 12 . HA 1 1 98 1 2 1 1 13 ILE HG12 . 13 . HG12 1 1 99 1 1 1 1 12 LYS QB . 12 . HB# 1 1 99 1 2 1 1 12 LYS QE . 12 . HE# 1 1 100 1 1 1 1 12 LYS QB . 12 . HB# 1 1 100 1 2 1 1 13 ILE H . 13 . HN 1 1 101 1 1 1 1 12 LYS HB2 . 12 . HB2 1 1 101 1 2 1 1 12 LYS QZ . 12 . HZ# 1 1 102 1 1 1 1 12 LYS HD2 . 12 . HD2 1 1 102 1 2 1 1 12 LYS QE . 12 . HE# 1 1 103 1 1 1 1 12 LYS QE . 12 . HE# 1 1 103 1 2 1 1 12 LYS QG . 12 . HG# 1 1 104 1 1 1 1 13 ILE H . 13 . HN 1 1 104 1 2 1 1 13 ILE HA . 13 . HA 1 1 105 1 1 1 1 13 ILE H . 13 . HN 1 1 105 1 2 1 1 13 ILE HB . 13 . HB 1 1 106 1 1 1 1 13 ILE H . 13 . HN 1 1 106 1 2 1 1 13 ILE MD . 13 . HD1# 1 1 107 1 1 1 1 13 ILE H . 13 . HN 1 1 107 1 2 1 1 13 ILE HG12 . 13 . HG12 1 1 108 1 1 1 1 13 ILE H . 13 . HN 1 1 108 1 2 1 1 13 ILE QG . 13 . HG1# 1 1 109 1 1 1 1 13 ILE H . 13 . HN 1 1 109 1 2 1 1 14 LEU H . 14 . HN 1 1 110 1 1 1 1 13 ILE H . 13 . HN 1 1 110 1 2 1 1 14 LEU QB . 14 . HB# 1 1 111 1 1 1 1 13 ILE HA . 13 . HA 1 1 111 1 2 1 1 13 ILE HB . 13 . HB 1 1 112 1 1 1 1 13 ILE HA . 13 . HA 1 1 112 1 2 1 1 13 ILE MD . 13 . HD1# 1 1 113 1 1 1 1 13 ILE HA . 13 . HA 1 1 113 1 2 1 1 13 ILE MG . 13 . HG2# 1 1 114 1 1 1 1 13 ILE HA . 13 . HA 1 1 114 1 2 1 1 14 LEU H . 14 . HN 1 1 115 1 1 1 1 13 ILE HB . 13 . HB 1 1 115 1 2 1 1 14 LEU H . 14 . HN 1 1 116 1 1 1 1 13 ILE MG . 13 . HG2# 1 1 116 1 2 1 1 14 LEU H . 14 . HN 1 1 117 1 1 1 1 13 ILE MG . 13 . HG2# 1 1 117 1 2 1 1 14 LEU HA . 14 . HA 1 1 118 1 1 1 1 14 LEU H . 14 . HN 1 1 118 1 2 1 1 14 LEU HB2 . 14 . HB2 1 1 119 1 1 1 1 14 LEU H . 14 . HN 1 1 119 1 2 1 1 14 LEU QB . 14 . HB# 1 1 120 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 120 1 2 1 1 14 LEU MD2 . 14 . HD2# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 5.0 1.8 5.0 1 1 2 1 . . . . . 5.0 1.8 5.0 1 1 3 1 . . . . . 5.0 1.8 5.0 1 1 4 1 . . . . . 2.8 1.8 2.8 1 1 5 1 . . . . . 5.0 1.8 5.0 1 1 6 1 . . . . . 5.0 1.8 5.0 1 1 7 1 . . . . . 5.0 1.8 5.0 1 1 8 1 . . . . . 5.0 1.8 5.0 1 1 9 1 . . . . . 5.0 1.8 5.0 1 1 10 1 . . . . . 5.0 1.8 5.0 1 1 11 1 . . . . . 3.4 1.8 3.4 1 1 12 1 . . . . . 5.0 1.8 5.0 1 1 13 1 . . . . . 5.0 1.8 5.0 1 1 14 1 . . . . . 5.0 1.8 5.0 1 1 15 1 . . . . . 5.0 1.8 5.0 1 1 16 1 . . . . . 5.0 1.8 5.0 1 1 17 1 . . . . . 2.8 1.8 2.8 1 1 18 1 . . . . . 5.0 1.8 5.0 1 1 19 1 . . . . . 5.0 1.8 5.0 1 1 20 1 . . . . . 5.0 1.8 5.0 1 1 21 1 . . . . . 5.0 1.8 5.0 1 1 22 1 . . . . . 2.8 1.8 2.8 1 1 23 1 . . . . . 2.8 1.8 2.8 1 1 24 1 . . . . . 5.0 1.8 5.0 1 1 25 1 . . . . . 2.8 1.8 2.8 1 1 26 1 . . . . . 5.0 1.8 5.0 1 1 27 1 . . . . . 3.4 1.8 3.4 1 1 28 1 . . . . . 2.8 1.8 2.8 1 1 29 1 . . . . . 5.0 1.8 5.0 1 1 30 1 . . . . . 5.0 1.8 5.0 1 1 31 1 . . . . . 5.0 1.8 5.0 1 1 32 1 . . . . . 3.4 1.8 3.4 1 1 33 1 . . . . . 5.0 1.8 5.0 1 1 34 1 . . . . . 5.0 1.8 5.0 1 1 35 1 . . . . . 5.0 1.8 5.0 1 1 36 1 . . . . . 2.8 1.8 2.8 1 1 37 1 . . . . . 5.0 1.8 5.0 1 1 38 1 . . . . . 5.0 1.8 5.0 1 1 39 1 . . . . . 2.8 1.8 2.8 1 1 40 1 . . . . . 2.8 1.8 2.8 1 1 41 1 . . . . . 2.8 1.8 2.8 1 1 42 1 . . . . . 2.8 1.8 2.8 1 1 43 1 . . . . . 3.4 1.8 3.4 1 1 44 1 . . . . . 3.4 1.8 3.4 1 1 45 1 . . . . . 3.4 1.8 3.4 1 1 46 1 . . . . . 5.0 1.8 5.0 1 1 47 1 . . . . . . 1.8 3.4 1 1 48 1 . . . . . 5.0 1.8 5.0 1 1 49 1 . . . . . 5.0 1.8 5.0 1 1 50 1 . . . . . 2.8 1.8 2.8 1 1 51 1 . . . . . 3.4 1.8 3.4 1 1 52 1 . . . . . 3.4 1.8 3.4 1 1 53 1 . . . . . 5.0 1.8 5.0 1 1 54 1 . . . . . 5.0 1.8 5.0 1 1 55 1 . . . . . 2.8 1.8 2.8 1 1 56 1 . . . . . 5.0 1.8 5.0 1 1 57 1 . . . . . 5.0 1.8 5.0 1 1 58 1 . . . . . 3.4 1.8 3.4 1 1 59 1 . . . . . 5.0 1.8 5.0 1 1 60 1 . . . . . 2.8 1.8 2.8 1 1 61 1 . . . . . 3.4 1.8 3.4 1 1 62 1 . . . . . 5.0 1.8 5.0 1 1 63 1 . . . . . 5.0 1.8 5.0 1 1 64 1 . . . . . 5.0 1.8 5.0 1 1 65 1 . . . . . 5.0 1.8 5.0 1 1 66 1 . . . . . 5.0 1.8 5.0 1 1 67 1 . . . . . 2.8 1.8 2.8 1 1 68 1 . . . . . 5.0 1.8 5.0 1 1 69 1 . . . . . 5.0 1.8 5.0 1 1 70 1 . . . . . 3.4 1.8 3.4 1 1 71 1 . . . . . 3.4 1.8 3.4 1 1 72 1 . . . . . 5.0 1.8 5.0 1 1 73 1 . . . . . 5.0 1.8 5.0 1 1 74 1 . . . . . 5.0 1.8 5.0 1 1 75 1 . . . . . 5.0 1.8 5.0 1 1 76 1 . . . . . 5.0 1.8 5.0 1 1 77 1 . . . . . 2.8 1.8 2.8 1 1 78 1 . . . . . 2.8 1.8 2.8 1 1 79 1 . . . . . 3.4 1.8 3.4 1 1 80 1 . . . . . 5.0 1.8 5.0 1 1 81 1 . . . . . 5.0 1.8 5.0 1 1 82 1 . . . . . 5.0 1.8 5.0 1 1 83 1 . . . . . 5.0 1.8 5.0 1 1 84 1 . . . . . . 1.8 3.4 1 1 85 1 . . . . . 5.0 1.8 5.0 1 1 86 1 . . . . . 2.8 1.8 2.8 1 1 87 1 . . . . . 5.0 1.8 5.0 1 1 88 1 . . . . . 2.8 1.8 2.8 1 1 89 1 . . . . . 3.4 1.8 3.4 1 1 90 1 . . . . . 3.4 1.8 3.4 1 1 91 1 . . . . . 5.0 1.8 5.0 1 1 92 1 . . . . . 5.0 1.8 5.0 1 1 93 1 . . . . . 5.0 1.8 5.0 1 1 94 1 . . . . . 5.0 1.8 5.0 1 1 95 1 . . . . . 2.8 1.8 2.8 1 1 96 1 . . . . . 5.0 1.8 5.0 1 1 97 1 . . . . . 3.4 1.8 3.4 1 1 98 1 . . . . . 5.0 1.8 5.0 1 1 99 1 . . . . . 3.4 1.8 3.4 1 1 100 1 . . . . . 5.0 1.8 5.0 1 1 101 1 . . . . . 5.0 1.8 5.0 1 1 102 1 . . . . . 2.8 1.8 2.8 1 1 103 1 . . . . . 3.4 1.8 3.4 1 1 104 1 . . . . . 2.8 1.8 2.8 1 1 105 1 . . . . . . 1.8 2.8 1 1 106 1 . . . . . 5.0 1.8 5.0 1 1 107 1 . . . . . 3.4 1.8 3.4 1 1 108 1 . . . . . 3.4 1.8 3.4 1 1 109 1 . . . . . 3.4 1.8 3.4 1 1 110 1 . . . . . 5.0 1.8 5.0 1 1 111 1 . . . . . 2.8 1.8 2.8 1 1 112 1 . . . . . . 1.8 3.4 1 1 113 1 . . . . . 3.4 1.8 3.4 1 1 114 1 . . . . . 5.0 1.8 5.0 1 1 115 1 . . . . . 3.4 1.8 3.4 1 1 116 1 . . . . . 5.0 1.8 5.0 1 1 117 1 . . . . . 5.0 1.8 5.0 1 1 118 1 . . . . . 3.4 1.8 3.4 1 1 119 1 . . . . . 2.8 1.8 2.8 1 1 120 1 . . . . . 3.4 1.8 3.4 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 ILE C 1 1 2 ASN N 1 1 2 ASN CA 1 1 2 ASN C -106.943 -57.031 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 2 ASN C 1 1 3 LEU N 1 1 3 LEU CA 1 1 3 LEU C -65.058 -57.641994 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 3 . 1 1 3 LEU C 1 1 4 LYS N 1 1 4 LYS CA 1 1 4 LYS C -64.387 -54.803 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 4 . 1 1 4 LYS C 1 1 5 ALA N 1 1 5 ALA CA 1 1 5 ALA C -68.08 -59.768 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 5 . 1 1 5 ALA C 1 1 6 LEU N 1 1 6 LEU CA 1 1 6 LEU C -69.161 -57.755 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 6 . 1 1 6 LEU C 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C -68.165 -57.748997 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 7 . 1 1 7 ALA C 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C -68.196 -59.862 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 8 . 1 1 8 ALA C 1 1 9 LEU N 1 1 9 LEU CA 1 1 9 LEU C -68.91799 -59.528 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 9 . 1 1 9 LEU C 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C -66.55 -55.422 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 10 . 1 1 10 ALA C 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C -66.643 -52.891 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 11 . 1 1 11 LYS C 1 1 12 LYS N 1 1 12 LYS CA 1 1 12 LYS C -77.95 -60.047997 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 12 . 1 1 12 LYS C 1 1 13 ILE N 1 1 13 ILE CA 1 1 13 ILE C -90.204 -70.676 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 13 . 1 1 2 ASN N 1 1 2 ASN CA 1 1 2 ASN C 1 1 3 LEU N -171.248 -103.306 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1 14 . 1 1 3 LEU N 1 1 3 LEU CA 1 1 3 LEU C 1 1 4 LYS N -42.774 -24.661999 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1 15 . 1 1 4 LYS N 1 1 4 LYS CA 1 1 4 LYS C 1 1 5 ALA N -47.091 -37.421 . 4 . N . 4 . CA . 4 . C . 5 . N 1 1 16 . 1 1 5 ALA N 1 1 5 ALA CA 1 1 5 ALA C 1 1 6 LEU N -44.124 -38.726 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 17 . 1 1 6 LEU N 1 1 6 LEU CA 1 1 6 LEU C 1 1 7 ALA N -43.157 -37.077 . 6 . N . 6 . CA . 6 . C . 7 . N 1 1 18 . 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C 1 1 8 ALA N -48.62 -25.16 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 19 . 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C 1 1 9 LEU N -46.556 -36.836 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 20 . 1 1 9 LEU N 1 1 9 LEU CA 1 1 9 LEU C 1 1 10 ALA N -45.296 -39.366 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 21 . 1 1 10 ALA N 1 1 10 ALA CA 1 1 10 ALA C 1 1 11 LYS N -49.846 -36.022 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1 22 . 1 1 11 LYS N 1 1 11 LYS CA 1 1 11 LYS C 1 1 12 LYS N -49.602 -21.304 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1 23 . 1 1 12 LYS N 1 1 12 LYS CA 1 1 12 LYS C 1 1 13 ILE N -47.447 -25.525 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1 24 . 1 1 13 ILE N 1 1 13 ILE CA 1 1 13 ILE C 1 1 14 LEU N -39.779 -9.457 . 13 . N . 13 . CA . 13 . C . 14 . N 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 ILE C C 1.775 0.520 0.492 1.00 . A A . 1 ILE C 1 1 1 2 1 1 1 ILE CA C 1.241 -0.772 -0.115 1.00 . A A . 1 ILE CA 1 1 1 3 1 1 1 ILE CB C 1.579 -1.983 0.774 1.00 . A A . 1 ILE CB 1 1 1 4 1 1 1 ILE CD1 C 3.394 -3.253 -0.443 1.00 . A A . 1 ILE CD1 1 1 1 5 1 1 1 ILE CG1 C 3.088 -2.285 0.709 1.00 . A A . 1 ILE CG1 1 1 1 6 1 1 1 ILE CG2 C 0.788 -3.202 0.294 1.00 . A A . 1 ILE CG2 1 1 1 7 1 1 1 ILE H1 H 1.840 -0.042 -1.965 1.00 . A A . 1 ILE H1 1 1 1 8 1 1 1 ILE H2 H 1.286 -1.640 -2.003 1.00 . A A . 1 ILE H2 1 1 1 9 1 1 1 ILE H3 H 2.821 -1.288 -1.365 1.00 . A A . 1 ILE H3 1 1 1 10 1 1 1 ILE HA H 0.168 -0.694 -0.216 1.00 . A A . 1 ILE HA 1 1 1 11 1 1 1 ILE HB H 1.298 -1.763 1.799 1.00 . A A . 1 ILE HB 1 1 1 12 1 1 1 ILE HD11 H 2.611 -3.195 -1.185 1.00 . A A . 1 ILE HD11 1 1 1 13 1 1 1 ILE HD12 H 3.450 -4.262 -0.059 1.00 . A A . 1 ILE HD12 1 1 1 14 1 1 1 ILE HD13 H 4.338 -2.986 -0.894 1.00 . A A . 1 ILE HD13 1 1 1 15 1 1 1 ILE HG12 H 3.633 -1.365 0.554 1.00 . A A . 1 ILE HG12 1 1 1 16 1 1 1 ILE HG13 H 3.402 -2.732 1.640 1.00 . A A . 1 ILE HG13 1 1 1 17 1 1 1 ILE HG21 H 0.981 -3.365 -0.756 1.00 . A A . 1 ILE HG21 1 1 1 18 1 1 1 ILE HG22 H -0.266 -3.027 0.443 1.00 . A A . 1 ILE HG22 1 1 1 19 1 1 1 ILE HG23 H 1.092 -4.076 0.855 1.00 . A A . 1 ILE HG23 1 1 1 20 1 1 1 ILE N N 1.842 -0.950 -1.462 1.00 . A A . 1 ILE N 1 1 1 21 1 1 1 ILE O O 1.539 1.603 -0.045 1.00 . A A . 1 ILE O 1 1 1 22 1 1 2 ASN C C 4.542 1.701 2.020 1.00 . A A . 2 ASN C 1 1 1 23 1 1 2 ASN CA C 3.044 1.586 2.269 1.00 . A A . 2 ASN CA 1 1 1 24 1 1 2 ASN CB C 2.779 1.517 3.781 1.00 . A A . 2 ASN CB 1 1 1 25 1 1 2 ASN CG C 2.448 0.093 4.208 1.00 . A A . 2 ASN CG 1 1 1 26 1 1 2 ASN H H 2.648 -0.477 1.992 1.00 . A A . 2 ASN H 1 1 1 27 1 1 2 ASN HA H 2.565 2.465 1.878 1.00 . A A . 2 ASN HA 1 1 1 28 1 1 2 ASN HB2 H 3.655 1.851 4.314 1.00 . A A . 2 ASN HB2 1 1 1 29 1 1 2 ASN HB3 H 1.946 2.161 4.023 1.00 . A A . 2 ASN HB3 1 1 1 30 1 1 2 ASN HD21 H 0.511 0.281 3.833 1.00 . A A . 2 ASN HD21 1 1 1 31 1 1 2 ASN HD22 H 0.987 -1.232 4.441 1.00 . A A . 2 ASN HD22 1 1 1 32 1 1 2 ASN N N 2.492 0.408 1.607 1.00 . A A . 2 ASN N 1 1 1 33 1 1 2 ASN ND2 N 1.216 -0.322 4.154 1.00 . A A . 2 ASN ND2 1 1 1 34 1 1 2 ASN O O 5.121 0.919 1.263 1.00 . A A . 2 ASN O 1 1 1 35 1 1 2 ASN OD1 O 3.337 -0.668 4.588 1.00 . A A . 2 ASN OD1 1 1 1 36 1 1 3 LEU C C 7.370 1.756 3.125 1.00 . A A . 3 LEU C 1 1 1 37 1 1 3 LEU CA C 6.590 2.915 2.546 1.00 . A A . 3 LEU CA 1 1 1 38 1 1 3 LEU CB C 6.971 4.185 3.272 1.00 . A A . 3 LEU CB 1 1 1 39 1 1 3 LEU CD1 C 4.869 5.525 3.424 1.00 . A A . 3 LEU CD1 1 1 1 40 1 1 3 LEU CD2 C 7.028 6.638 2.853 1.00 . A A . 3 LEU CD2 1 1 1 41 1 1 3 LEU CG C 6.199 5.367 2.687 1.00 . A A . 3 LEU CG 1 1 1 42 1 1 3 LEU H H 4.634 3.254 3.268 1.00 . A A . 3 LEU H 1 1 1 43 1 1 3 LEU HA H 6.840 3.028 1.516 1.00 . A A . 3 LEU HA 1 1 1 44 1 1 3 LEU HB2 H 6.724 4.067 4.301 1.00 . A A . 3 LEU HB2 1 1 1 45 1 1 3 LEU HB3 H 8.030 4.356 3.170 1.00 . A A . 3 LEU HB3 1 1 1 46 1 1 3 LEU HD11 H 4.105 4.951 2.920 1.00 . A A . 3 LEU HD11 1 1 1 47 1 1 3 LEU HD12 H 4.588 6.566 3.435 1.00 . A A . 3 LEU HD12 1 1 1 48 1 1 3 LEU HD13 H 4.975 5.170 4.440 1.00 . A A . 3 LEU HD13 1 1 1 49 1 1 3 LEU HD21 H 6.369 7.491 2.904 1.00 . A A . 3 LEU HD21 1 1 1 50 1 1 3 LEU HD22 H 7.690 6.743 2.007 1.00 . A A . 3 LEU HD22 1 1 1 51 1 1 3 LEU HD23 H 7.611 6.577 3.761 1.00 . A A . 3 LEU HD23 1 1 1 52 1 1 3 LEU HG H 6.012 5.194 1.639 1.00 . A A . 3 LEU HG 1 1 1 53 1 1 3 LEU N N 5.158 2.679 2.676 1.00 . A A . 3 LEU N 1 1 1 54 1 1 3 LEU O O 8.518 1.514 2.755 1.00 . A A . 3 LEU O 1 1 1 55 1 1 4 LYS C C 7.938 -1.028 3.647 1.00 . A A . 4 LYS C 1 1 1 56 1 1 4 LYS CA C 7.372 -0.075 4.690 1.00 . A A . 4 LYS CA 1 1 1 57 1 1 4 LYS CB C 6.326 -0.792 5.526 1.00 . A A . 4 LYS CB 1 1 1 58 1 1 4 LYS CD C 6.261 -0.082 7.929 1.00 . A A . 4 LYS CD 1 1 1 59 1 1 4 LYS CE C 5.878 1.073 8.858 1.00 . A A . 4 LYS CE 1 1 1 60 1 1 4 LYS CG C 5.704 0.189 6.530 1.00 . A A . 4 LYS CG 1 1 1 61 1 1 4 LYS H H 5.830 1.292 4.310 1.00 . A A . 4 LYS H 1 1 1 62 1 1 4 LYS HA H 8.162 0.278 5.330 1.00 . A A . 4 LYS HA 1 1 1 63 1 1 4 LYS HB2 H 5.555 -1.170 4.868 1.00 . A A . 4 LYS HB2 1 1 1 64 1 1 4 LYS HB3 H 6.786 -1.607 6.054 1.00 . A A . 4 LYS HB3 1 1 1 65 1 1 4 LYS HD2 H 5.844 -1.006 8.310 1.00 . A A . 4 LYS HD2 1 1 1 66 1 1 4 LYS HD3 H 7.335 -0.164 7.881 1.00 . A A . 4 LYS HD3 1 1 1 67 1 1 4 LYS HE2 H 4.813 1.230 8.815 1.00 . A A . 4 LYS HE2 1 1 1 68 1 1 4 LYS HE3 H 6.163 0.828 9.870 1.00 . A A . 4 LYS HE3 1 1 1 69 1 1 4 LYS HG2 H 5.937 1.204 6.240 1.00 . A A . 4 LYS HG2 1 1 1 70 1 1 4 LYS HG3 H 4.630 0.056 6.542 1.00 . A A . 4 LYS HG3 1 1 1 71 1 1 4 LYS HZ1 H 6.617 2.981 9.236 1.00 . A A . 4 LYS HZ1 1 1 1 72 1 1 4 LYS HZ2 H 6.068 2.759 7.643 1.00 . A A . 4 LYS HZ2 1 1 1 73 1 1 4 LYS HZ3 H 7.548 2.088 8.139 1.00 . A A . 4 LYS HZ3 1 1 1 74 1 1 4 LYS N N 6.739 1.047 4.045 1.00 . A A . 4 LYS N 1 1 1 75 1 1 4 LYS NZ N 6.579 2.315 8.436 1.00 . A A . 4 LYS NZ 1 1 1 76 1 1 4 LYS O O 9.091 -1.451 3.738 1.00 . A A . 4 LYS O 1 1 1 77 1 1 5 ALA C C 8.687 -1.565 0.786 1.00 . A A . 5 ALA C 1 1 1 78 1 1 5 ALA CA C 7.578 -2.235 1.586 1.00 . A A . 5 ALA CA 1 1 1 79 1 1 5 ALA CB C 6.411 -2.581 0.657 1.00 . A A . 5 ALA CB 1 1 1 80 1 1 5 ALA H H 6.226 -0.966 2.620 1.00 . A A . 5 ALA H 1 1 1 81 1 1 5 ALA HA H 7.959 -3.145 2.024 1.00 . A A . 5 ALA HA 1 1 1 82 1 1 5 ALA HB1 H 5.645 -3.089 1.219 1.00 . A A . 5 ALA HB1 1 1 1 83 1 1 5 ALA HB2 H 6.762 -3.225 -0.139 1.00 . A A . 5 ALA HB2 1 1 1 84 1 1 5 ALA HB3 H 6.008 -1.674 0.233 1.00 . A A . 5 ALA HB3 1 1 1 85 1 1 5 ALA N N 7.130 -1.346 2.648 1.00 . A A . 5 ALA N 1 1 1 86 1 1 5 ALA O O 9.717 -2.174 0.500 1.00 . A A . 5 ALA O 1 1 1 87 1 1 6 LEU C C 10.752 0.564 0.485 1.00 . A A . 6 LEU C 1 1 1 88 1 1 6 LEU CA C 9.460 0.450 -0.309 1.00 . A A . 6 LEU CA 1 1 1 89 1 1 6 LEU CB C 8.913 1.845 -0.591 1.00 . A A . 6 LEU CB 1 1 1 90 1 1 6 LEU CD1 C 7.009 3.137 -1.580 1.00 . A A . 6 LEU CD1 1 1 1 91 1 1 6 LEU CD2 C 7.422 0.781 -2.311 1.00 . A A . 6 LEU CD2 1 1 1 92 1 1 6 LEU CG C 7.474 1.752 -1.124 1.00 . A A . 6 LEU CG 1 1 1 93 1 1 6 LEU H H 7.651 0.143 0.712 1.00 . A A . 6 LEU H 1 1 1 94 1 1 6 LEU HA H 9.655 -0.052 -1.244 1.00 . A A . 6 LEU HA 1 1 1 95 1 1 6 LEU HB2 H 8.917 2.415 0.326 1.00 . A A . 6 LEU HB2 1 1 1 96 1 1 6 LEU HB3 H 9.536 2.333 -1.322 1.00 . A A . 6 LEU HB3 1 1 1 97 1 1 6 LEU HD11 H 7.339 3.882 -0.871 1.00 . A A . 6 LEU HD11 1 1 1 98 1 1 6 LEU HD12 H 5.930 3.152 -1.640 1.00 . A A . 6 LEU HD12 1 1 1 99 1 1 6 LEU HD13 H 7.424 3.358 -2.554 1.00 . A A . 6 LEU HD13 1 1 1 100 1 1 6 LEU HD21 H 6.552 1.000 -2.912 1.00 . A A . 6 LEU HD21 1 1 1 101 1 1 6 LEU HD22 H 7.364 -0.236 -1.950 1.00 . A A . 6 LEU HD22 1 1 1 102 1 1 6 LEU HD23 H 8.311 0.901 -2.913 1.00 . A A . 6 LEU HD23 1 1 1 103 1 1 6 LEU HG H 6.822 1.397 -0.338 1.00 . A A . 6 LEU HG 1 1 1 104 1 1 6 LEU N N 8.477 -0.302 0.445 1.00 . A A . 6 LEU N 1 1 1 105 1 1 6 LEU O O 11.851 0.407 -0.047 1.00 . A A . 6 LEU O 1 1 1 106 1 1 7 ALA C C 12.493 -0.349 2.743 1.00 . A A . 7 ALA C 1 1 1 107 1 1 7 ALA CA C 11.754 0.973 2.642 1.00 . A A . 7 ALA CA 1 1 1 108 1 1 7 ALA CB C 11.312 1.424 4.038 1.00 . A A . 7 ALA CB 1 1 1 109 1 1 7 ALA H H 9.696 0.961 2.129 1.00 . A A . 7 ALA H 1 1 1 110 1 1 7 ALA HA H 12.419 1.710 2.228 1.00 . A A . 7 ALA HA 1 1 1 111 1 1 7 ALA HB1 H 11.091 2.481 4.020 1.00 . A A . 7 ALA HB1 1 1 1 112 1 1 7 ALA HB2 H 12.106 1.235 4.747 1.00 . A A . 7 ALA HB2 1 1 1 113 1 1 7 ALA HB3 H 10.430 0.877 4.331 1.00 . A A . 7 ALA HB3 1 1 1 114 1 1 7 ALA N N 10.604 0.841 1.766 1.00 . A A . 7 ALA N 1 1 1 115 1 1 7 ALA O O 13.715 -0.377 2.873 1.00 . A A . 7 ALA O 1 1 1 116 1 1 8 ALA C C 13.373 -2.968 1.671 1.00 . A A . 8 ALA C 1 1 1 117 1 1 8 ALA CA C 12.359 -2.764 2.786 1.00 . A A . 8 ALA CA 1 1 1 118 1 1 8 ALA CB C 11.283 -3.850 2.698 1.00 . A A . 8 ALA CB 1 1 1 119 1 1 8 ALA H H 10.776 -1.359 2.584 1.00 . A A . 8 ALA H 1 1 1 120 1 1 8 ALA HA H 12.863 -2.847 3.732 1.00 . A A . 8 ALA HA 1 1 1 121 1 1 8 ALA HB1 H 10.854 -3.853 1.706 1.00 . A A . 8 ALA HB1 1 1 1 122 1 1 8 ALA HB2 H 10.509 -3.651 3.423 1.00 . A A . 8 ALA HB2 1 1 1 123 1 1 8 ALA HB3 H 11.726 -4.813 2.899 1.00 . A A . 8 ALA HB3 1 1 1 124 1 1 8 ALA N N 11.748 -1.444 2.687 1.00 . A A . 8 ALA N 1 1 1 125 1 1 8 ALA O O 14.525 -3.327 1.926 1.00 . A A . 8 ALA O 1 1 1 126 1 1 9 LEU C C 14.900 -1.746 -0.653 1.00 . A A . 9 LEU C 1 1 1 127 1 1 9 LEU CA C 13.867 -2.860 -0.691 1.00 . A A . 9 LEU CA 1 1 1 128 1 1 9 LEU CB C 13.120 -2.845 -2.033 1.00 . A A . 9 LEU CB 1 1 1 129 1 1 9 LEU CD1 C 11.964 -0.911 -3.102 1.00 . A A . 9 LEU CD1 1 1 1 130 1 1 9 LEU CD2 C 10.630 -2.771 -2.112 1.00 . A A . 9 LEU CD2 1 1 1 131 1 1 9 LEU CG C 11.897 -1.931 -1.967 1.00 . A A . 9 LEU CG 1 1 1 132 1 1 9 LEU H H 12.033 -2.416 0.299 1.00 . A A . 9 LEU H 1 1 1 133 1 1 9 LEU HA H 14.377 -3.803 -0.595 1.00 . A A . 9 LEU HA 1 1 1 134 1 1 9 LEU HB2 H 13.788 -2.492 -2.807 1.00 . A A . 9 LEU HB2 1 1 1 135 1 1 9 LEU HB3 H 12.801 -3.848 -2.273 1.00 . A A . 9 LEU HB3 1 1 1 136 1 1 9 LEU HD11 H 12.641 -0.119 -2.827 1.00 . A A . 9 LEU HD11 1 1 1 137 1 1 9 LEU HD12 H 10.980 -0.501 -3.275 1.00 . A A . 9 LEU HD12 1 1 1 138 1 1 9 LEU HD13 H 12.318 -1.393 -4.002 1.00 . A A . 9 LEU HD13 1 1 1 139 1 1 9 LEU HD21 H 9.778 -2.118 -2.233 1.00 . A A . 9 LEU HD21 1 1 1 140 1 1 9 LEU HD22 H 10.498 -3.377 -1.229 1.00 . A A . 9 LEU HD22 1 1 1 141 1 1 9 LEU HD23 H 10.720 -3.409 -2.976 1.00 . A A . 9 LEU HD23 1 1 1 142 1 1 9 LEU HG H 11.882 -1.411 -1.024 1.00 . A A . 9 LEU HG 1 1 1 143 1 1 9 LEU N N 12.955 -2.716 0.441 1.00 . A A . 9 LEU N 1 1 1 144 1 1 9 LEU O O 16.100 -1.985 -0.817 1.00 . A A . 9 LEU O 1 1 1 145 1 1 10 ALA C C 16.395 0.403 0.690 1.00 . A A . 10 ALA C 1 1 1 146 1 1 10 ALA CA C 15.301 0.634 -0.345 1.00 . A A . 10 ALA CA 1 1 1 147 1 1 10 ALA CB C 14.500 1.885 0.027 1.00 . A A . 10 ALA CB 1 1 1 148 1 1 10 ALA H H 13.456 -0.410 -0.287 1.00 . A A . 10 ALA H 1 1 1 149 1 1 10 ALA HA H 15.761 0.791 -1.311 1.00 . A A . 10 ALA HA 1 1 1 150 1 1 10 ALA HB1 H 15.078 2.767 -0.214 1.00 . A A . 10 ALA HB1 1 1 1 151 1 1 10 ALA HB2 H 14.289 1.877 1.087 1.00 . A A . 10 ALA HB2 1 1 1 152 1 1 10 ALA HB3 H 13.572 1.904 -0.525 1.00 . A A . 10 ALA HB3 1 1 1 153 1 1 10 ALA N N 14.422 -0.528 -0.419 1.00 . A A . 10 ALA N 1 1 1 154 1 1 10 ALA O O 17.529 0.841 0.507 1.00 . A A . 10 ALA O 1 1 1 155 1 1 11 LYS C C 18.288 -1.156 2.245 1.00 . A A . 11 LYS C 1 1 1 156 1 1 11 LYS CA C 17.019 -0.561 2.835 1.00 . A A . 11 LYS CA 1 1 1 157 1 1 11 LYS CB C 16.418 -1.533 3.862 1.00 . A A . 11 LYS CB 1 1 1 158 1 1 11 LYS CD C 15.495 -1.699 6.191 1.00 . A A . 11 LYS CD 1 1 1 159 1 1 11 LYS CE C 16.226 -1.853 7.529 1.00 . A A . 11 LYS CE 1 1 1 160 1 1 11 LYS CG C 16.340 -0.849 5.233 1.00 . A A . 11 LYS CG 1 1 1 161 1 1 11 LYS H H 15.127 -0.607 1.871 1.00 . A A . 11 LYS H 1 1 1 162 1 1 11 LYS HA H 17.262 0.356 3.331 1.00 . A A . 11 LYS HA 1 1 1 163 1 1 11 LYS HB2 H 15.428 -1.817 3.547 1.00 . A A . 11 LYS HB2 1 1 1 164 1 1 11 LYS HB3 H 17.040 -2.414 3.936 1.00 . A A . 11 LYS HB3 1 1 1 165 1 1 11 LYS HD2 H 14.543 -1.215 6.356 1.00 . A A . 11 LYS HD2 1 1 1 166 1 1 11 LYS HD3 H 15.332 -2.675 5.758 1.00 . A A . 11 LYS HD3 1 1 1 167 1 1 11 LYS HE2 H 17.290 -1.939 7.353 1.00 . A A . 11 LYS HE2 1 1 1 168 1 1 11 LYS HE3 H 16.032 -0.990 8.148 1.00 . A A . 11 LYS HE3 1 1 1 169 1 1 11 LYS HG2 H 17.338 -0.731 5.633 1.00 . A A . 11 LYS HG2 1 1 1 170 1 1 11 LYS HG3 H 15.882 0.123 5.122 1.00 . A A . 11 LYS HG3 1 1 1 171 1 1 11 LYS HZ1 H 14.703 -3.109 8.182 1.00 . A A . 11 LYS HZ1 1 1 1 172 1 1 11 LYS HZ2 H 16.048 -3.065 9.213 1.00 . A A . 11 LYS HZ2 1 1 1 173 1 1 11 LYS HZ3 H 16.127 -3.921 7.748 1.00 . A A . 11 LYS HZ3 1 1 1 174 1 1 11 LYS N N 16.050 -0.285 1.777 1.00 . A A . 11 LYS N 1 1 1 175 1 1 11 LYS NZ N 15.740 -3.078 8.219 1.00 . A A . 11 LYS NZ 1 1 1 176 1 1 11 LYS O O 19.395 -0.839 2.682 1.00 . A A . 11 LYS O 1 1 1 177 1 1 12 LYS C C 20.000 -1.629 -0.280 1.00 . A A . 12 LYS C 1 1 1 178 1 1 12 LYS CA C 19.265 -2.633 0.600 1.00 . A A . 12 LYS CA 1 1 1 179 1 1 12 LYS CB C 18.796 -3.826 -0.235 1.00 . A A . 12 LYS CB 1 1 1 180 1 1 12 LYS CD C 17.055 -4.804 1.278 1.00 . A A . 12 LYS CD 1 1 1 181 1 1 12 LYS CE C 16.023 -5.426 0.338 1.00 . A A . 12 LYS CE 1 1 1 182 1 1 12 LYS CG C 18.461 -4.997 0.696 1.00 . A A . 12 LYS CG 1 1 1 183 1 1 12 LYS H H 17.222 -2.207 0.927 1.00 . A A . 12 LYS H 1 1 1 184 1 1 12 LYS HA H 19.939 -2.987 1.363 1.00 . A A . 12 LYS HA 1 1 1 185 1 1 12 LYS HB2 H 17.913 -3.549 -0.797 1.00 . A A . 12 LYS HB2 1 1 1 186 1 1 12 LYS HB3 H 19.578 -4.122 -0.916 1.00 . A A . 12 LYS HB3 1 1 1 187 1 1 12 LYS HD2 H 16.995 -5.275 2.246 1.00 . A A . 12 LYS HD2 1 1 1 188 1 1 12 LYS HD3 H 16.847 -3.749 1.382 1.00 . A A . 12 LYS HD3 1 1 1 189 1 1 12 LYS HE2 H 15.036 -5.137 0.652 1.00 . A A . 12 LYS HE2 1 1 1 190 1 1 12 LYS HE3 H 16.197 -5.072 -0.669 1.00 . A A . 12 LYS HE3 1 1 1 191 1 1 12 LYS HG2 H 18.498 -5.919 0.134 1.00 . A A . 12 LYS HG2 1 1 1 192 1 1 12 LYS HG3 H 19.181 -5.039 1.501 1.00 . A A . 12 LYS HG3 1 1 1 193 1 1 12 LYS HZ1 H 17.028 -7.180 0.843 1.00 . A A . 12 LYS HZ1 1 1 1 194 1 1 12 LYS HZ2 H 16.128 -7.279 -0.600 1.00 . A A . 12 LYS HZ2 1 1 1 195 1 1 12 LYS HZ3 H 15.339 -7.313 0.895 1.00 . A A . 12 LYS HZ3 1 1 1 196 1 1 12 LYS N N 18.125 -2.006 1.244 1.00 . A A . 12 LYS N 1 1 1 197 1 1 12 LYS NZ N 16.138 -6.909 0.373 1.00 . A A . 12 LYS NZ 1 1 1 198 1 1 12 LYS O O 21.227 -1.681 -0.412 1.00 . A A . 12 LYS O 1 1 1 199 1 1 13 ILE C C 20.464 1.394 -0.860 1.00 . A A . 13 ILE C 1 1 1 200 1 1 13 ILE CA C 19.832 0.314 -1.722 1.00 . A A . 13 ILE CA 1 1 1 201 1 1 13 ILE CB C 18.768 0.936 -2.625 1.00 . A A . 13 ILE CB 1 1 1 202 1 1 13 ILE CD1 C 18.669 -1.040 -4.182 1.00 . A A . 13 ILE CD1 1 1 1 203 1 1 13 ILE CG1 C 17.869 -0.162 -3.209 1.00 . A A . 13 ILE CG1 1 1 1 204 1 1 13 ILE CG2 C 19.445 1.696 -3.769 1.00 . A A . 13 ILE CG2 1 1 1 205 1 1 13 ILE H H 18.283 -0.711 -0.718 1.00 . A A . 13 ILE H 1 1 1 206 1 1 13 ILE HA H 20.584 -0.132 -2.336 1.00 . A A . 13 ILE HA 1 1 1 207 1 1 13 ILE HB H 18.173 1.620 -2.043 1.00 . A A . 13 ILE HB 1 1 1 208 1 1 13 ILE HD11 H 18.477 -2.081 -3.967 1.00 . A A . 13 ILE HD11 1 1 1 209 1 1 13 ILE HD12 H 19.723 -0.840 -4.072 1.00 . A A . 13 ILE HD12 1 1 1 210 1 1 13 ILE HD13 H 18.365 -0.820 -5.195 1.00 . A A . 13 ILE HD13 1 1 1 211 1 1 13 ILE HG12 H 17.485 -0.775 -2.407 1.00 . A A . 13 ILE HG12 1 1 1 212 1 1 13 ILE HG13 H 17.046 0.295 -3.735 1.00 . A A . 13 ILE HG13 1 1 1 213 1 1 13 ILE HG21 H 20.128 1.037 -4.283 1.00 . A A . 13 ILE HG21 1 1 1 214 1 1 13 ILE HG22 H 19.989 2.538 -3.368 1.00 . A A . 13 ILE HG22 1 1 1 215 1 1 13 ILE HG23 H 18.694 2.048 -4.459 1.00 . A A . 13 ILE HG23 1 1 1 216 1 1 13 ILE N N 19.247 -0.709 -0.871 1.00 . A A . 13 ILE N 1 1 1 217 1 1 13 ILE O O 21.561 1.875 -1.151 1.00 . A A . 13 ILE O 1 1 1 218 1 1 14 LEU C C 21.506 2.257 1.860 1.00 . A A . 14 LEU C 1 1 1 219 1 1 14 LEU CA C 20.281 2.777 1.121 1.00 . A A . 14 LEU CA 1 1 1 220 1 1 14 LEU CB C 19.194 3.158 2.134 1.00 . A A . 14 LEU CB 1 1 1 221 1 1 14 LEU CD1 C 19.456 5.587 1.559 1.00 . A A . 14 LEU CD1 1 1 1 222 1 1 14 LEU CD2 C 17.797 4.188 0.325 1.00 . A A . 14 LEU CD2 1 1 1 223 1 1 14 LEU CG C 18.464 4.428 1.679 1.00 . A A . 14 LEU CG 1 1 1 224 1 1 14 LEU H H 18.907 1.334 0.398 1.00 . A A . 14 LEU H 1 1 1 225 1 1 14 LEU HA H 20.559 3.651 0.553 1.00 . A A . 14 LEU HA 1 1 1 226 1 1 14 LEU HB2 H 18.482 2.349 2.218 1.00 . A A . 14 LEU HB2 1 1 1 227 1 1 14 LEU HB3 H 19.647 3.335 3.097 1.00 . A A . 14 LEU HB3 1 1 1 228 1 1 14 LEU HD11 H 18.971 6.502 1.855 1.00 . A A . 14 LEU HD11 1 1 1 229 1 1 14 LEU HD12 H 19.792 5.673 0.534 1.00 . A A . 14 LEU HD12 1 1 1 230 1 1 14 LEU HD13 H 20.306 5.405 2.200 1.00 . A A . 14 LEU HD13 1 1 1 231 1 1 14 LEU HD21 H 18.549 4.172 -0.449 1.00 . A A . 14 LEU HD21 1 1 1 232 1 1 14 LEU HD22 H 17.092 4.982 0.125 1.00 . A A . 14 LEU HD22 1 1 1 233 1 1 14 LEU HD23 H 17.277 3.242 0.341 1.00 . A A . 14 LEU HD23 1 1 1 234 1 1 14 LEU HG H 17.711 4.683 2.409 1.00 . A A . 14 LEU HG 1 1 1 235 1 1 14 LEU N N 19.775 1.760 0.211 1.00 . A A . 14 LEU N 1 1 1 236 1 1 14 LEU O O 22.535 2.930 1.919 1.00 . A A . 14 LEU O 1 1 1 237 1 1 15 NH2 HN1 H 20.636 0.550 2.381 1.00 . A A . 15 NH2 HN1 1 1 1 238 1 1 15 NH2 N N 21.458 1.087 2.430 1.00 . A A . 15 NH2 N 1 1 2 239 1 1 1 ILE C C 3.109 0.343 -1.484 1.00 . A A . 1 ILE C 1 1 2 240 1 1 1 ILE CA C 3.025 -0.925 -2.337 1.00 . A A . 1 ILE CA 1 1 2 241 1 1 1 ILE CB C 4.377 -1.678 -2.316 1.00 . A A . 1 ILE CB 1 1 2 242 1 1 1 ILE CD1 C 5.568 0.196 -3.505 1.00 . A A . 1 ILE CD1 1 1 2 243 1 1 1 ILE CG1 C 5.546 -0.679 -2.250 1.00 . A A . 1 ILE CG1 1 1 2 244 1 1 1 ILE CG2 C 4.521 -2.551 -3.574 1.00 . A A . 1 ILE CG2 1 1 2 245 1 1 1 ILE H1 H 2.664 -1.390 -4.339 1.00 . A A . 1 ILE H1 1 1 2 246 1 1 1 ILE H2 H 3.380 0.127 -4.094 1.00 . A A . 1 ILE H2 1 1 2 247 1 1 1 ILE H3 H 1.738 -0.100 -3.755 1.00 . A A . 1 ILE H3 1 1 2 248 1 1 1 ILE HA H 2.253 -1.566 -1.932 1.00 . A A . 1 ILE HA 1 1 2 249 1 1 1 ILE HB H 4.408 -2.316 -1.443 1.00 . A A . 1 ILE HB 1 1 2 250 1 1 1 ILE HD11 H 5.166 -0.360 -4.341 1.00 . A A . 1 ILE HD11 1 1 2 251 1 1 1 ILE HD12 H 6.587 0.485 -3.725 1.00 . A A . 1 ILE HD12 1 1 2 252 1 1 1 ILE HD13 H 4.972 1.079 -3.338 1.00 . A A . 1 ILE HD13 1 1 2 253 1 1 1 ILE HG12 H 5.432 -0.053 -1.377 1.00 . A A . 1 ILE HG12 1 1 2 254 1 1 1 ILE HG13 H 6.477 -1.223 -2.179 1.00 . A A . 1 ILE HG13 1 1 2 255 1 1 1 ILE HG21 H 3.567 -2.999 -3.815 1.00 . A A . 1 ILE HG21 1 1 2 256 1 1 1 ILE HG22 H 5.246 -3.331 -3.392 1.00 . A A . 1 ILE HG22 1 1 2 257 1 1 1 ILE HG23 H 4.852 -1.943 -4.403 1.00 . A A . 1 ILE HG23 1 1 2 258 1 1 1 ILE N N 2.675 -0.544 -3.738 1.00 . A A . 1 ILE N 1 1 2 259 1 1 1 ILE O O 2.999 1.461 -1.996 1.00 . A A . 1 ILE O 1 1 2 260 1 1 2 ASN C C 4.852 1.561 1.105 1.00 . A A . 2 ASN C 1 1 2 261 1 1 2 ASN CA C 3.403 1.277 0.740 1.00 . A A . 2 ASN CA 1 1 2 262 1 1 2 ASN CB C 2.595 0.968 1.993 1.00 . A A . 2 ASN CB 1 1 2 263 1 1 2 ASN CG C 3.314 -0.087 2.813 1.00 . A A . 2 ASN CG 1 1 2 264 1 1 2 ASN H H 3.384 -0.758 0.160 1.00 . A A . 2 ASN H 1 1 2 265 1 1 2 ASN HA H 2.989 2.160 0.277 1.00 . A A . 2 ASN HA 1 1 2 266 1 1 2 ASN HB2 H 2.475 1.868 2.579 1.00 . A A . 2 ASN HB2 1 1 2 267 1 1 2 ASN HB3 H 1.625 0.596 1.705 1.00 . A A . 2 ASN HB3 1 1 2 268 1 1 2 ASN HD21 H 2.845 -1.562 1.567 1.00 . A A . 2 ASN HD21 1 1 2 269 1 1 2 ASN HD22 H 3.779 -2.018 2.910 1.00 . A A . 2 ASN HD22 1 1 2 270 1 1 2 ASN N N 3.306 0.157 -0.187 1.00 . A A . 2 ASN N 1 1 2 271 1 1 2 ASN ND2 N 3.313 -1.324 2.398 1.00 . A A . 2 ASN ND2 1 1 2 272 1 1 2 ASN O O 5.783 1.014 0.509 1.00 . A A . 2 ASN O 1 1 2 273 1 1 2 ASN OD1 O 3.898 0.228 3.848 1.00 . A A . 2 ASN OD1 1 1 2 274 1 1 3 LEU C C 7.106 1.648 3.117 1.00 . A A . 3 LEU C 1 1 2 275 1 1 3 LEU CA C 6.356 2.823 2.522 1.00 . A A . 3 LEU CA 1 1 2 276 1 1 3 LEU CB C 6.232 3.918 3.561 1.00 . A A . 3 LEU CB 1 1 2 277 1 1 3 LEU CD1 C 4.023 5.126 3.460 1.00 . A A . 3 LEU CD1 1 1 2 278 1 1 3 LEU CD2 C 6.171 6.422 3.401 1.00 . A A . 3 LEU CD2 1 1 2 279 1 1 3 LEU CG C 5.479 5.122 2.972 1.00 . A A . 3 LEU CG 1 1 2 280 1 1 3 LEU H H 4.255 2.829 2.513 1.00 . A A . 3 LEU H 1 1 2 281 1 1 3 LEU HA H 6.902 3.208 1.694 1.00 . A A . 3 LEU HA 1 1 2 282 1 1 3 LEU HB2 H 5.691 3.525 4.392 1.00 . A A . 3 LEU HB2 1 1 2 283 1 1 3 LEU HB3 H 7.216 4.226 3.881 1.00 . A A . 3 LEU HB3 1 1 2 284 1 1 3 LEU HD11 H 3.366 4.940 2.623 1.00 . A A . 3 LEU HD11 1 1 2 285 1 1 3 LEU HD12 H 3.787 6.089 3.890 1.00 . A A . 3 LEU HD12 1 1 2 286 1 1 3 LEU HD13 H 3.883 4.357 4.204 1.00 . A A . 3 LEU HD13 1 1 2 287 1 1 3 LEU HD21 H 5.502 7.257 3.247 1.00 . A A . 3 LEU HD21 1 1 2 288 1 1 3 LEU HD22 H 7.062 6.564 2.808 1.00 . A A . 3 LEU HD22 1 1 2 289 1 1 3 LEU HD23 H 6.440 6.364 4.446 1.00 . A A . 3 LEU HD23 1 1 2 290 1 1 3 LEU HG H 5.489 5.053 1.892 1.00 . A A . 3 LEU HG 1 1 2 291 1 1 3 LEU N N 5.032 2.433 2.080 1.00 . A A . 3 LEU N 1 1 2 292 1 1 3 LEU O O 8.325 1.534 2.960 1.00 . A A . 3 LEU O 1 1 2 293 1 1 4 LYS C C 7.786 -1.168 3.413 1.00 . A A . 4 LYS C 1 1 2 294 1 1 4 LYS CA C 6.996 -0.364 4.436 1.00 . A A . 4 LYS CA 1 1 2 295 1 1 4 LYS CB C 5.922 -1.247 5.060 1.00 . A A . 4 LYS CB 1 1 2 296 1 1 4 LYS CD C 4.251 -1.470 6.894 1.00 . A A . 4 LYS CD 1 1 2 297 1 1 4 LYS CE C 3.294 -0.645 7.751 1.00 . A A . 4 LYS CE 1 1 2 298 1 1 4 LYS CG C 5.307 -0.552 6.281 1.00 . A A . 4 LYS CG 1 1 2 299 1 1 4 LYS H H 5.413 0.922 3.915 1.00 . A A . 4 LYS H 1 1 2 300 1 1 4 LYS HA H 7.657 -0.017 5.206 1.00 . A A . 4 LYS HA 1 1 2 301 1 1 4 LYS HB2 H 5.153 -1.436 4.328 1.00 . A A . 4 LYS HB2 1 1 2 302 1 1 4 LYS HB3 H 6.365 -2.178 5.365 1.00 . A A . 4 LYS HB3 1 1 2 303 1 1 4 LYS HD2 H 3.695 -1.954 6.103 1.00 . A A . 4 LYS HD2 1 1 2 304 1 1 4 LYS HD3 H 4.735 -2.219 7.507 1.00 . A A . 4 LYS HD3 1 1 2 305 1 1 4 LYS HE2 H 3.855 -0.106 8.498 1.00 . A A . 4 LYS HE2 1 1 2 306 1 1 4 LYS HE3 H 2.765 0.056 7.121 1.00 . A A . 4 LYS HE3 1 1 2 307 1 1 4 LYS HG2 H 6.077 -0.354 7.011 1.00 . A A . 4 LYS HG2 1 1 2 308 1 1 4 LYS HG3 H 4.844 0.378 5.978 1.00 . A A . 4 LYS HG3 1 1 2 309 1 1 4 LYS HZ1 H 2.585 -2.546 8.229 1.00 . A A . 4 LYS HZ1 1 1 2 310 1 1 4 LYS HZ2 H 1.368 -1.374 8.044 1.00 . A A . 4 LYS HZ2 1 1 2 311 1 1 4 LYS HZ3 H 2.331 -1.380 9.439 1.00 . A A . 4 LYS HZ3 1 1 2 312 1 1 4 LYS N N 6.380 0.782 3.811 1.00 . A A . 4 LYS N 1 1 2 313 1 1 4 LYS NZ N 2.321 -1.554 8.416 1.00 . A A . 4 LYS NZ 1 1 2 314 1 1 4 LYS O O 8.941 -1.531 3.648 1.00 . A A . 4 LYS O 1 1 2 315 1 1 5 ALA C C 8.969 -1.402 0.643 1.00 . A A . 5 ALA C 1 1 2 316 1 1 5 ALA CA C 7.815 -2.204 1.226 1.00 . A A . 5 ALA CA 1 1 2 317 1 1 5 ALA CB C 6.811 -2.548 0.124 1.00 . A A . 5 ALA CB 1 1 2 318 1 1 5 ALA H H 6.239 -1.126 2.147 1.00 . A A . 5 ALA H 1 1 2 319 1 1 5 ALA HA H 8.200 -3.119 1.645 1.00 . A A . 5 ALA HA 1 1 2 320 1 1 5 ALA HB1 H 7.336 -2.719 -0.804 1.00 . A A . 5 ALA HB1 1 1 2 321 1 1 5 ALA HB2 H 6.117 -1.731 0.000 1.00 . A A . 5 ALA HB2 1 1 2 322 1 1 5 ALA HB3 H 6.269 -3.442 0.400 1.00 . A A . 5 ALA HB3 1 1 2 323 1 1 5 ALA N N 7.158 -1.442 2.278 1.00 . A A . 5 ALA N 1 1 2 324 1 1 5 ALA O O 10.070 -1.927 0.446 1.00 . A A . 5 ALA O 1 1 2 325 1 1 6 LEU C C 10.919 0.812 0.761 1.00 . A A . 6 LEU C 1 1 2 326 1 1 6 LEU CA C 9.728 0.759 -0.173 1.00 . A A . 6 LEU CA 1 1 2 327 1 1 6 LEU CB C 9.163 2.167 -0.334 1.00 . A A . 6 LEU CB 1 1 2 328 1 1 6 LEU CD1 C 7.035 2.566 -1.566 1.00 . A A . 6 LEU CD1 1 1 2 329 1 1 6 LEU CD2 C 9.198 3.448 -2.458 1.00 . A A . 6 LEU CD2 1 1 2 330 1 1 6 LEU CG C 8.530 2.297 -1.712 1.00 . A A . 6 LEU CG 1 1 2 331 1 1 6 LEU H H 7.816 0.231 0.569 1.00 . A A . 6 LEU H 1 1 2 332 1 1 6 LEU HA H 10.037 0.394 -1.139 1.00 . A A . 6 LEU HA 1 1 2 333 1 1 6 LEU HB2 H 8.419 2.348 0.428 1.00 . A A . 6 LEU HB2 1 1 2 334 1 1 6 LEU HB3 H 9.962 2.889 -0.237 1.00 . A A . 6 LEU HB3 1 1 2 335 1 1 6 LEU HD11 H 6.681 3.107 -2.427 1.00 . A A . 6 LEU HD11 1 1 2 336 1 1 6 LEU HD12 H 6.857 3.148 -0.673 1.00 . A A . 6 LEU HD12 1 1 2 337 1 1 6 LEU HD13 H 6.511 1.626 -1.491 1.00 . A A . 6 LEU HD13 1 1 2 338 1 1 6 LEU HD21 H 8.914 4.384 -2.000 1.00 . A A . 6 LEU HD21 1 1 2 339 1 1 6 LEU HD22 H 8.882 3.439 -3.490 1.00 . A A . 6 LEU HD22 1 1 2 340 1 1 6 LEU HD23 H 10.270 3.333 -2.408 1.00 . A A . 6 LEU HD23 1 1 2 341 1 1 6 LEU HG H 8.675 1.378 -2.263 1.00 . A A . 6 LEU HG 1 1 2 342 1 1 6 LEU N N 8.710 -0.125 0.380 1.00 . A A . 6 LEU N 1 1 2 343 1 1 6 LEU O O 12.072 0.736 0.335 1.00 . A A . 6 LEU O 1 1 2 344 1 1 7 ALA C C 12.417 -0.302 3.134 1.00 . A A . 7 ALA C 1 1 2 345 1 1 7 ALA CA C 11.661 1.015 3.053 1.00 . A A . 7 ALA CA 1 1 2 346 1 1 7 ALA CB C 11.052 1.337 4.418 1.00 . A A . 7 ALA CB 1 1 2 347 1 1 7 ALA H H 9.672 1.009 2.300 1.00 . A A . 7 ALA H 1 1 2 348 1 1 7 ALA HA H 12.353 1.794 2.790 1.00 . A A . 7 ALA HA 1 1 2 349 1 1 7 ALA HB1 H 11.832 1.669 5.085 1.00 . A A . 7 ALA HB1 1 1 2 350 1 1 7 ALA HB2 H 10.579 0.453 4.822 1.00 . A A . 7 ALA HB2 1 1 2 351 1 1 7 ALA HB3 H 10.316 2.121 4.308 1.00 . A A . 7 ALA HB3 1 1 2 352 1 1 7 ALA N N 10.618 0.946 2.037 1.00 . A A . 7 ALA N 1 1 2 353 1 1 7 ALA O O 13.617 -0.322 3.416 1.00 . A A . 7 ALA O 1 1 2 354 1 1 8 ALA C C 13.328 -2.901 1.860 1.00 . A A . 8 ALA C 1 1 2 355 1 1 8 ALA CA C 12.299 -2.721 2.961 1.00 . A A . 8 ALA CA 1 1 2 356 1 1 8 ALA CB C 11.214 -3.802 2.833 1.00 . A A . 8 ALA CB 1 1 2 357 1 1 8 ALA H H 10.748 -1.303 2.689 1.00 . A A . 8 ALA H 1 1 2 358 1 1 8 ALA HA H 12.792 -2.832 3.908 1.00 . A A . 8 ALA HA 1 1 2 359 1 1 8 ALA HB1 H 11.112 -4.325 3.773 1.00 . A A . 8 ALA HB1 1 1 2 360 1 1 8 ALA HB2 H 11.496 -4.504 2.062 1.00 . A A . 8 ALA HB2 1 1 2 361 1 1 8 ALA HB3 H 10.271 -3.343 2.573 1.00 . A A . 8 ALA HB3 1 1 2 362 1 1 8 ALA N N 11.699 -1.394 2.899 1.00 . A A . 8 ALA N 1 1 2 363 1 1 8 ALA O O 14.459 -3.315 2.118 1.00 . A A . 8 ALA O 1 1 2 364 1 1 9 LEU C C 14.934 -1.623 -0.411 1.00 . A A . 9 LEU C 1 1 2 365 1 1 9 LEU CA C 13.865 -2.710 -0.489 1.00 . A A . 9 LEU CA 1 1 2 366 1 1 9 LEU CB C 13.112 -2.617 -1.822 1.00 . A A . 9 LEU CB 1 1 2 367 1 1 9 LEU CD1 C 12.894 -0.210 -2.509 1.00 . A A . 9 LEU CD1 1 1 2 368 1 1 9 LEU CD2 C 10.907 -1.732 -2.596 1.00 . A A . 9 LEU CD2 1 1 2 369 1 1 9 LEU CG C 12.189 -1.391 -1.829 1.00 . A A . 9 LEU CG 1 1 2 370 1 1 9 LEU H H 12.028 -2.258 0.489 1.00 . A A . 9 LEU H 1 1 2 371 1 1 9 LEU HA H 14.348 -3.673 -0.430 1.00 . A A . 9 LEU HA 1 1 2 372 1 1 9 LEU HB2 H 13.828 -2.537 -2.632 1.00 . A A . 9 LEU HB2 1 1 2 373 1 1 9 LEU HB3 H 12.521 -3.511 -1.956 1.00 . A A . 9 LEU HB3 1 1 2 374 1 1 9 LEU HD11 H 12.715 0.693 -1.944 1.00 . A A . 9 LEU HD11 1 1 2 375 1 1 9 LEU HD12 H 12.511 -0.087 -3.512 1.00 . A A . 9 LEU HD12 1 1 2 376 1 1 9 LEU HD13 H 13.957 -0.399 -2.553 1.00 . A A . 9 LEU HD13 1 1 2 377 1 1 9 LEU HD21 H 11.164 -2.127 -3.567 1.00 . A A . 9 LEU HD21 1 1 2 378 1 1 9 LEU HD22 H 10.310 -0.839 -2.720 1.00 . A A . 9 LEU HD22 1 1 2 379 1 1 9 LEU HD23 H 10.341 -2.470 -2.046 1.00 . A A . 9 LEU HD23 1 1 2 380 1 1 9 LEU HG H 11.941 -1.123 -0.810 1.00 . A A . 9 LEU HG 1 1 2 381 1 1 9 LEU N N 12.942 -2.584 0.637 1.00 . A A . 9 LEU N 1 1 2 382 1 1 9 LEU O O 16.123 -1.888 -0.599 1.00 . A A . 9 LEU O 1 1 2 383 1 1 10 ALA C C 16.555 0.442 0.933 1.00 . A A . 10 ALA C 1 1 2 384 1 1 10 ALA CA C 15.423 0.732 -0.041 1.00 . A A . 10 ALA CA 1 1 2 385 1 1 10 ALA CB C 14.669 1.984 0.417 1.00 . A A . 10 ALA CB 1 1 2 386 1 1 10 ALA H H 13.540 -0.249 0.009 1.00 . A A . 10 ALA H 1 1 2 387 1 1 10 ALA HA H 15.843 0.918 -1.020 1.00 . A A . 10 ALA HA 1 1 2 388 1 1 10 ALA HB1 H 15.368 2.786 0.581 1.00 . A A . 10 ALA HB1 1 1 2 389 1 1 10 ALA HB2 H 14.140 1.772 1.335 1.00 . A A . 10 ALA HB2 1 1 2 390 1 1 10 ALA HB3 H 13.963 2.273 -0.345 1.00 . A A . 10 ALA HB3 1 1 2 391 1 1 10 ALA N N 14.502 -0.399 -0.130 1.00 . A A . 10 ALA N 1 1 2 392 1 1 10 ALA O O 17.697 0.828 0.691 1.00 . A A . 10 ALA O 1 1 2 393 1 1 11 LYS C C 18.451 -1.230 2.338 1.00 . A A . 11 LYS C 1 1 2 394 1 1 11 LYS CA C 17.253 -0.574 3.016 1.00 . A A . 11 LYS CA 1 1 2 395 1 1 11 LYS CB C 16.673 -1.517 4.072 1.00 . A A . 11 LYS CB 1 1 2 396 1 1 11 LYS CD C 18.355 -1.149 5.895 1.00 . A A . 11 LYS CD 1 1 2 397 1 1 11 LYS CE C 18.729 -0.145 6.987 1.00 . A A . 11 LYS CE 1 1 2 398 1 1 11 LYS CG C 16.902 -0.923 5.469 1.00 . A A . 11 LYS CG 1 1 2 399 1 1 11 LYS H H 15.312 -0.534 2.164 1.00 . A A . 11 LYS H 1 1 2 400 1 1 11 LYS HA H 17.577 0.333 3.497 1.00 . A A . 11 LYS HA 1 1 2 401 1 1 11 LYS HB2 H 15.613 -1.638 3.901 1.00 . A A . 11 LYS HB2 1 1 2 402 1 1 11 LYS HB3 H 17.159 -2.481 4.005 1.00 . A A . 11 LYS HB3 1 1 2 403 1 1 11 LYS HD2 H 18.472 -2.155 6.273 1.00 . A A . 11 LYS HD2 1 1 2 404 1 1 11 LYS HD3 H 19.008 -1.009 5.047 1.00 . A A . 11 LYS HD3 1 1 2 405 1 1 11 LYS HE2 H 19.783 -0.230 7.207 1.00 . A A . 11 LYS HE2 1 1 2 406 1 1 11 LYS HE3 H 18.512 0.855 6.639 1.00 . A A . 11 LYS HE3 1 1 2 407 1 1 11 LYS HG2 H 16.700 0.139 5.450 1.00 . A A . 11 LYS HG2 1 1 2 408 1 1 11 LYS HG3 H 16.242 -1.401 6.178 1.00 . A A . 11 LYS HG3 1 1 2 409 1 1 11 LYS HZ1 H 18.113 0.330 8.910 1.00 . A A . 11 LYS HZ1 1 1 2 410 1 1 11 LYS HZ2 H 18.241 -1.335 8.626 1.00 . A A . 11 LYS HZ2 1 1 2 411 1 1 11 LYS HZ3 H 16.929 -0.456 7.989 1.00 . A A . 11 LYS HZ3 1 1 2 412 1 1 11 LYS N N 16.239 -0.244 2.024 1.00 . A A . 11 LYS N 1 1 2 413 1 1 11 LYS NZ N 17.942 -0.425 8.218 1.00 . A A . 11 LYS NZ 1 1 2 414 1 1 11 LYS O O 19.598 -1.019 2.735 1.00 . A A . 11 LYS O 1 1 2 415 1 1 12 LYS C C 19.906 -1.752 -0.398 1.00 . A A . 12 LYS C 1 1 2 416 1 1 12 LYS CA C 19.226 -2.702 0.582 1.00 . A A . 12 LYS CA 1 1 2 417 1 1 12 LYS CB C 18.661 -3.912 -0.166 1.00 . A A . 12 LYS CB 1 1 2 418 1 1 12 LYS CD C 17.100 -4.855 1.552 1.00 . A A . 12 LYS CD 1 1 2 419 1 1 12 LYS CE C 16.032 -5.743 0.906 1.00 . A A . 12 LYS CE 1 1 2 420 1 1 12 LYS CG C 18.435 -5.054 0.825 1.00 . A A . 12 LYS CG 1 1 2 421 1 1 12 LYS H H 17.243 -2.150 1.040 1.00 . A A . 12 LYS H 1 1 2 422 1 1 12 LYS HA H 19.959 -3.047 1.291 1.00 . A A . 12 LYS HA 1 1 2 423 1 1 12 LYS HB2 H 17.722 -3.645 -0.636 1.00 . A A . 12 LYS HB2 1 1 2 424 1 1 12 LYS HB3 H 19.363 -4.229 -0.921 1.00 . A A . 12 LYS HB3 1 1 2 425 1 1 12 LYS HD2 H 17.213 -5.119 2.591 1.00 . A A . 12 LYS HD2 1 1 2 426 1 1 12 LYS HD3 H 16.796 -3.823 1.478 1.00 . A A . 12 LYS HD3 1 1 2 427 1 1 12 LYS HE2 H 15.818 -5.379 -0.086 1.00 . A A . 12 LYS HE2 1 1 2 428 1 1 12 LYS HE3 H 16.396 -6.755 0.842 1.00 . A A . 12 LYS HE3 1 1 2 429 1 1 12 LYS HG2 H 18.421 -5.993 0.289 1.00 . A A . 12 LYS HG2 1 1 2 430 1 1 12 LYS HG3 H 19.237 -5.067 1.549 1.00 . A A . 12 LYS HG3 1 1 2 431 1 1 12 LYS HZ1 H 14.905 -6.334 2.551 1.00 . A A . 12 LYS HZ1 1 1 2 432 1 1 12 LYS HZ2 H 13.997 -6.064 1.135 1.00 . A A . 12 LYS HZ2 1 1 2 433 1 1 12 LYS HZ3 H 14.596 -4.746 2.032 1.00 . A A . 12 LYS HZ3 1 1 2 434 1 1 12 LYS N N 18.172 -2.024 1.312 1.00 . A A . 12 LYS N 1 1 2 435 1 1 12 LYS NZ N 14.790 -5.718 1.717 1.00 . A A . 12 LYS NZ 1 1 2 436 1 1 12 LYS O O 21.118 -1.831 -0.610 1.00 . A A . 12 LYS O 1 1 2 437 1 1 13 ILE C C 20.377 1.232 -1.249 1.00 . A A . 13 ILE C 1 1 2 438 1 1 13 ILE CA C 19.665 0.090 -1.960 1.00 . A A . 13 ILE CA 1 1 2 439 1 1 13 ILE CB C 18.546 0.646 -2.837 1.00 . A A . 13 ILE CB 1 1 2 440 1 1 13 ILE CD1 C 18.329 -1.520 -4.102 1.00 . A A . 13 ILE CD1 1 1 2 441 1 1 13 ILE CG1 C 17.590 -0.485 -3.244 1.00 . A A . 13 ILE CG1 1 1 2 442 1 1 13 ILE CG2 C 19.142 1.286 -4.098 1.00 . A A . 13 ILE CG2 1 1 2 443 1 1 13 ILE H H 18.166 -0.843 -0.791 1.00 . A A . 13 ILE H 1 1 2 444 1 1 13 ILE HA H 20.367 -0.418 -2.588 1.00 . A A . 13 ILE HA 1 1 2 445 1 1 13 ILE HB H 18.010 1.389 -2.279 1.00 . A A . 13 ILE HB 1 1 2 446 1 1 13 ILE HD11 H 19.020 -2.076 -3.483 1.00 . A A . 13 ILE HD11 1 1 2 447 1 1 13 ILE HD12 H 18.873 -1.018 -4.888 1.00 . A A . 13 ILE HD12 1 1 2 448 1 1 13 ILE HD13 H 17.613 -2.202 -4.541 1.00 . A A . 13 ILE HD13 1 1 2 449 1 1 13 ILE HG12 H 17.204 -0.965 -2.357 1.00 . A A . 13 ILE HG12 1 1 2 450 1 1 13 ILE HG13 H 16.770 -0.074 -3.815 1.00 . A A . 13 ILE HG13 1 1 2 451 1 1 13 ILE HG21 H 19.947 0.668 -4.470 1.00 . A A . 13 ILE HG21 1 1 2 452 1 1 13 ILE HG22 H 19.524 2.268 -3.861 1.00 . A A . 13 ILE HG22 1 1 2 453 1 1 13 ILE HG23 H 18.377 1.372 -4.856 1.00 . A A . 13 ILE HG23 1 1 2 454 1 1 13 ILE N N 19.123 -0.861 -0.997 1.00 . A A . 13 ILE N 1 1 2 455 1 1 13 ILE O O 21.433 1.683 -1.687 1.00 . A A . 13 ILE O 1 1 2 456 1 1 14 LEU C C 21.679 2.326 1.278 1.00 . A A . 14 LEU C 1 1 2 457 1 1 14 LEU CA C 20.391 2.792 0.605 1.00 . A A . 14 LEU CA 1 1 2 458 1 1 14 LEU CB C 19.394 3.293 1.660 1.00 . A A . 14 LEU CB 1 1 2 459 1 1 14 LEU CD1 C 17.888 4.049 -0.205 1.00 . A A . 14 LEU CD1 1 1 2 460 1 1 14 LEU CD2 C 17.521 4.887 2.115 1.00 . A A . 14 LEU CD2 1 1 2 461 1 1 14 LEU CG C 18.582 4.466 1.097 1.00 . A A . 14 LEU CG 1 1 2 462 1 1 14 LEU H H 18.952 1.302 0.153 1.00 . A A . 14 LEU H 1 1 2 463 1 1 14 LEU HA H 20.622 3.601 -0.072 1.00 . A A . 14 LEU HA 1 1 2 464 1 1 14 LEU HB2 H 18.725 2.491 1.926 1.00 . A A . 14 LEU HB2 1 1 2 465 1 1 14 LEU HB3 H 19.931 3.621 2.539 1.00 . A A . 14 LEU HB3 1 1 2 466 1 1 14 LEU HD11 H 17.348 3.126 -0.048 1.00 . A A . 14 LEU HD11 1 1 2 467 1 1 14 LEU HD12 H 18.626 3.906 -0.981 1.00 . A A . 14 LEU HD12 1 1 2 468 1 1 14 LEU HD13 H 17.196 4.821 -0.506 1.00 . A A . 14 LEU HD13 1 1 2 469 1 1 14 LEU HD21 H 16.746 4.136 2.158 1.00 . A A . 14 LEU HD21 1 1 2 470 1 1 14 LEU HD22 H 17.093 5.829 1.813 1.00 . A A . 14 LEU HD22 1 1 2 471 1 1 14 LEU HD23 H 17.973 4.993 3.091 1.00 . A A . 14 LEU HD23 1 1 2 472 1 1 14 LEU HG H 19.243 5.298 0.904 1.00 . A A . 14 LEU HG 1 1 2 473 1 1 14 LEU N N 19.797 1.700 -0.153 1.00 . A A . 14 LEU N 1 1 2 474 1 1 14 LEU O O 21.901 2.597 2.459 1.00 . A A . 14 LEU O 1 1 2 475 1 1 15 NH2 HN1 H 22.377 1.410 -0.341 1.00 . A A . 15 NH2 HN1 1 1 2 476 1 1 15 NH2 N N 22.546 1.627 0.602 1.00 . A A . 15 NH2 N 1 1 3 477 1 1 1 ILE C C 2.210 0.164 -0.351 1.00 . A A . 1 ILE C 1 1 3 478 1 1 1 ILE CA C 1.716 -1.236 -0.706 1.00 . A A . 1 ILE CA 1 1 3 479 1 1 1 ILE CB C 0.799 -1.784 0.407 1.00 . A A . 1 ILE CB 1 1 3 480 1 1 1 ILE CD1 C 1.573 -4.109 1.029 1.00 . A A . 1 ILE CD1 1 1 3 481 1 1 1 ILE CG1 C 1.619 -2.621 1.402 1.00 . A A . 1 ILE CG1 1 1 3 482 1 1 1 ILE CG2 C -0.306 -2.651 -0.211 1.00 . A A . 1 ILE CG2 1 1 3 483 1 1 1 ILE H1 H 3.635 -1.880 -0.224 1.00 . A A . 1 ILE H1 1 1 3 484 1 1 1 ILE H2 H 3.250 -2.030 -1.865 1.00 . A A . 1 ILE H2 1 1 3 485 1 1 1 ILE H3 H 2.604 -3.121 -0.745 1.00 . A A . 1 ILE H3 1 1 3 486 1 1 1 ILE HA H 1.157 -1.184 -1.626 1.00 . A A . 1 ILE HA 1 1 3 487 1 1 1 ILE HB H 0.342 -0.953 0.932 1.00 . A A . 1 ILE HB 1 1 3 488 1 1 1 ILE HD11 H 0.766 -4.593 1.563 1.00 . A A . 1 ILE HD11 1 1 3 489 1 1 1 ILE HD12 H 2.510 -4.569 1.302 1.00 . A A . 1 ILE HD12 1 1 3 490 1 1 1 ILE HD13 H 1.419 -4.217 -0.035 1.00 . A A . 1 ILE HD13 1 1 3 491 1 1 1 ILE HG12 H 2.644 -2.288 1.392 1.00 . A A . 1 ILE HG12 1 1 3 492 1 1 1 ILE HG13 H 1.214 -2.492 2.393 1.00 . A A . 1 ILE HG13 1 1 3 493 1 1 1 ILE HG21 H 0.135 -3.377 -0.880 1.00 . A A . 1 ILE HG21 1 1 3 494 1 1 1 ILE HG22 H -0.990 -2.024 -0.764 1.00 . A A . 1 ILE HG22 1 1 3 495 1 1 1 ILE HG23 H -0.845 -3.165 0.572 1.00 . A A . 1 ILE HG23 1 1 3 496 1 1 1 ILE N N 2.888 -2.136 -0.897 1.00 . A A . 1 ILE N 1 1 3 497 1 1 1 ILE O O 2.200 1.067 -1.190 1.00 . A A . 1 ILE O 1 1 3 498 1 1 2 ASN C C 4.633 1.767 1.072 1.00 . A A . 2 ASN C 1 1 3 499 1 1 2 ASN CA C 3.146 1.640 1.345 1.00 . A A . 2 ASN CA 1 1 3 500 1 1 2 ASN CB C 2.871 1.834 2.849 1.00 . A A . 2 ASN CB 1 1 3 501 1 1 2 ASN CG C 2.375 0.540 3.480 1.00 . A A . 2 ASN CG 1 1 3 502 1 1 2 ASN H H 2.643 -0.410 1.514 1.00 . A A . 2 ASN H 1 1 3 503 1 1 2 ASN HA H 2.643 2.425 0.801 1.00 . A A . 2 ASN HA 1 1 3 504 1 1 2 ASN HB2 H 3.778 2.139 3.343 1.00 . A A . 2 ASN HB2 1 1 3 505 1 1 2 ASN HB3 H 2.123 2.600 2.976 1.00 . A A . 2 ASN HB3 1 1 3 506 1 1 2 ASN HD21 H 0.779 0.408 2.314 1.00 . A A . 2 ASN HD21 1 1 3 507 1 1 2 ASN HD22 H 0.963 -0.852 3.430 1.00 . A A . 2 ASN HD22 1 1 3 508 1 1 2 ASN N N 2.649 0.343 0.891 1.00 . A A . 2 ASN N 1 1 3 509 1 1 2 ASN ND2 N 1.281 -0.012 3.040 1.00 . A A . 2 ASN ND2 1 1 3 510 1 1 2 ASN O O 5.239 0.915 0.414 1.00 . A A . 2 ASN O 1 1 3 511 1 1 2 ASN OD1 O 2.998 0.022 4.406 1.00 . A A . 2 ASN OD1 1 1 3 512 1 1 3 LEU C C 7.454 2.044 2.121 1.00 . A A . 3 LEU C 1 1 3 513 1 1 3 LEU CA C 6.636 3.099 1.408 1.00 . A A . 3 LEU CA 1 1 3 514 1 1 3 LEU CB C 6.967 4.450 1.993 1.00 . A A . 3 LEU CB 1 1 3 515 1 1 3 LEU CD1 C 6.281 6.825 2.157 1.00 . A A . 3 LEU CD1 1 1 3 516 1 1 3 LEU CD2 C 6.129 5.633 -0.032 1.00 . A A . 3 LEU CD2 1 1 3 517 1 1 3 LEU CG C 5.983 5.495 1.480 1.00 . A A . 3 LEU CG 1 1 3 518 1 1 3 LEU H H 4.679 3.468 2.104 1.00 . A A . 3 LEU H 1 1 3 519 1 1 3 LEU HA H 6.880 3.103 0.371 1.00 . A A . 3 LEU HA 1 1 3 520 1 1 3 LEU HB2 H 6.883 4.378 3.051 1.00 . A A . 3 LEU HB2 1 1 3 521 1 1 3 LEU HB3 H 7.975 4.733 1.722 1.00 . A A . 3 LEU HB3 1 1 3 522 1 1 3 LEU HD11 H 5.615 7.583 1.775 1.00 . A A . 3 LEU HD11 1 1 3 523 1 1 3 LEU HD12 H 7.306 7.107 1.957 1.00 . A A . 3 LEU HD12 1 1 3 524 1 1 3 LEU HD13 H 6.137 6.720 3.224 1.00 . A A . 3 LEU HD13 1 1 3 525 1 1 3 LEU HD21 H 7.177 5.702 -0.287 1.00 . A A . 3 LEU HD21 1 1 3 526 1 1 3 LEU HD22 H 5.617 6.522 -0.361 1.00 . A A . 3 LEU HD22 1 1 3 527 1 1 3 LEU HD23 H 5.697 4.768 -0.514 1.00 . A A . 3 LEU HD23 1 1 3 528 1 1 3 LEU HG H 4.976 5.191 1.719 1.00 . A A . 3 LEU HG 1 1 3 529 1 1 3 LEU N N 5.216 2.836 1.585 1.00 . A A . 3 LEU N 1 1 3 530 1 1 3 LEU O O 8.536 1.661 1.676 1.00 . A A . 3 LEU O 1 1 3 531 1 1 4 LYS C C 7.974 -0.606 3.203 1.00 . A A . 4 LYS C 1 1 3 532 1 1 4 LYS CA C 7.569 0.592 4.054 1.00 . A A . 4 LYS CA 1 1 3 533 1 1 4 LYS CB C 6.587 0.143 5.122 1.00 . A A . 4 LYS CB 1 1 3 534 1 1 4 LYS CD C 6.867 1.312 7.323 1.00 . A A . 4 LYS CD 1 1 3 535 1 1 4 LYS CE C 6.497 2.573 8.106 1.00 . A A . 4 LYS CE 1 1 3 536 1 1 4 LYS CG C 6.158 1.344 5.969 1.00 . A A . 4 LYS CG 1 1 3 537 1 1 4 LYS H H 6.057 1.958 3.537 1.00 . A A . 4 LYS H 1 1 3 538 1 1 4 LYS HA H 8.439 1.019 4.522 1.00 . A A . 4 LYS HA 1 1 3 539 1 1 4 LYS HB2 H 5.717 -0.281 4.639 1.00 . A A . 4 LYS HB2 1 1 3 540 1 1 4 LYS HB3 H 7.051 -0.598 5.748 1.00 . A A . 4 LYS HB3 1 1 3 541 1 1 4 LYS HD2 H 6.555 0.436 7.875 1.00 . A A . 4 LYS HD2 1 1 3 542 1 1 4 LYS HD3 H 7.936 1.282 7.171 1.00 . A A . 4 LYS HD3 1 1 3 543 1 1 4 LYS HE2 H 5.443 2.778 7.982 1.00 . A A . 4 LYS HE2 1 1 3 544 1 1 4 LYS HE3 H 6.709 2.421 9.150 1.00 . A A . 4 LYS HE3 1 1 3 545 1 1 4 LYS HG2 H 6.414 2.255 5.453 1.00 . A A . 4 LYS HG2 1 1 3 546 1 1 4 LYS HG3 H 5.087 1.309 6.128 1.00 . A A . 4 LYS HG3 1 1 3 547 1 1 4 LYS HZ1 H 6.673 4.356 7.047 1.00 . A A . 4 LYS HZ1 1 1 3 548 1 1 4 LYS HZ2 H 8.068 3.388 7.006 1.00 . A A . 4 LYS HZ2 1 1 3 549 1 1 4 LYS HZ3 H 7.674 4.262 8.408 1.00 . A A . 4 LYS HZ3 1 1 3 550 1 1 4 LYS N N 6.917 1.594 3.241 1.00 . A A . 4 LYS N 1 1 3 551 1 1 4 LYS NZ N 7.287 3.728 7.603 1.00 . A A . 4 LYS NZ 1 1 3 552 1 1 4 LYS O O 9.103 -1.100 3.293 1.00 . A A . 4 LYS O 1 1 3 553 1 1 5 ALA C C 8.504 -1.860 0.592 1.00 . A A . 5 ALA C 1 1 3 554 1 1 5 ALA CA C 7.327 -2.195 1.494 1.00 . A A . 5 ALA CA 1 1 3 555 1 1 5 ALA CB C 6.100 -2.518 0.634 1.00 . A A . 5 ALA CB 1 1 3 556 1 1 5 ALA H H 6.176 -0.630 2.337 1.00 . A A . 5 ALA H 1 1 3 557 1 1 5 ALA HA H 7.574 -3.057 2.099 1.00 . A A . 5 ALA HA 1 1 3 558 1 1 5 ALA HB1 H 5.570 -1.607 0.409 1.00 . A A . 5 ALA HB1 1 1 3 559 1 1 5 ALA HB2 H 5.450 -3.190 1.172 1.00 . A A . 5 ALA HB2 1 1 3 560 1 1 5 ALA HB3 H 6.416 -2.987 -0.287 1.00 . A A . 5 ALA HB3 1 1 3 561 1 1 5 ALA N N 7.051 -1.064 2.368 1.00 . A A . 5 ALA N 1 1 3 562 1 1 5 ALA O O 9.393 -2.685 0.383 1.00 . A A . 5 ALA O 1 1 3 563 1 1 6 LEU C C 10.850 -0.022 0.025 1.00 . A A . 6 LEU C 1 1 3 564 1 1 6 LEU CA C 9.575 -0.167 -0.780 1.00 . A A . 6 LEU CA 1 1 3 565 1 1 6 LEU CB C 9.198 1.190 -1.361 1.00 . A A . 6 LEU CB 1 1 3 566 1 1 6 LEU CD1 C 7.381 2.491 -2.483 1.00 . A A . 6 LEU CD1 1 1 3 567 1 1 6 LEU CD2 C 7.850 0.129 -3.180 1.00 . A A . 6 LEU CD2 1 1 3 568 1 1 6 LEU CG C 7.813 1.106 -2.002 1.00 . A A . 6 LEU CG 1 1 3 569 1 1 6 LEU H H 7.779 -0.020 0.302 1.00 . A A . 6 LEU H 1 1 3 570 1 1 6 LEU HA H 9.724 -0.871 -1.580 1.00 . A A . 6 LEU HA 1 1 3 571 1 1 6 LEU HB2 H 9.181 1.922 -0.565 1.00 . A A . 6 LEU HB2 1 1 3 572 1 1 6 LEU HB3 H 9.922 1.475 -2.102 1.00 . A A . 6 LEU HB3 1 1 3 573 1 1 6 LEU HD11 H 7.997 3.244 -2.013 1.00 . A A . 6 LEU HD11 1 1 3 574 1 1 6 LEU HD12 H 6.347 2.653 -2.214 1.00 . A A . 6 LEU HD12 1 1 3 575 1 1 6 LEU HD13 H 7.489 2.553 -3.556 1.00 . A A . 6 LEU HD13 1 1 3 576 1 1 6 LEU HD21 H 8.793 0.222 -3.701 1.00 . A A . 6 LEU HD21 1 1 3 577 1 1 6 LEU HD22 H 7.038 0.351 -3.857 1.00 . A A . 6 LEU HD22 1 1 3 578 1 1 6 LEU HD23 H 7.746 -0.878 -2.810 1.00 . A A . 6 LEU HD23 1 1 3 579 1 1 6 LEU HG H 7.104 0.757 -1.269 1.00 . A A . 6 LEU HG 1 1 3 580 1 1 6 LEU N N 8.507 -0.633 0.083 1.00 . A A . 6 LEU N 1 1 3 581 1 1 6 LEU O O 11.946 -0.325 -0.450 1.00 . A A . 6 LEU O 1 1 3 582 1 1 7 ALA C C 12.601 -0.663 2.271 1.00 . A A . 7 ALA C 1 1 3 583 1 1 7 ALA CA C 11.830 0.641 2.136 1.00 . A A . 7 ALA CA 1 1 3 584 1 1 7 ALA CB C 11.360 1.111 3.518 1.00 . A A . 7 ALA CB 1 1 3 585 1 1 7 ALA H H 9.785 0.680 1.562 1.00 . A A . 7 ALA H 1 1 3 586 1 1 7 ALA HA H 12.479 1.389 1.712 1.00 . A A . 7 ALA HA 1 1 3 587 1 1 7 ALA HB1 H 10.324 1.409 3.463 1.00 . A A . 7 ALA HB1 1 1 3 588 1 1 7 ALA HB2 H 11.959 1.952 3.838 1.00 . A A . 7 ALA HB2 1 1 3 589 1 1 7 ALA HB3 H 11.466 0.304 4.229 1.00 . A A . 7 ALA HB3 1 1 3 590 1 1 7 ALA N N 10.691 0.449 1.252 1.00 . A A . 7 ALA N 1 1 3 591 1 1 7 ALA O O 13.823 -0.660 2.410 1.00 . A A . 7 ALA O 1 1 3 592 1 1 8 ALA C C 13.541 -3.213 1.187 1.00 . A A . 8 ALA C 1 1 3 593 1 1 8 ALA CA C 12.522 -3.078 2.304 1.00 . A A . 8 ALA CA 1 1 3 594 1 1 8 ALA CB C 11.477 -4.186 2.191 1.00 . A A . 8 ALA CB 1 1 3 595 1 1 8 ALA H H 10.917 -1.711 2.076 1.00 . A A . 8 ALA H 1 1 3 596 1 1 8 ALA HA H 13.023 -3.154 3.252 1.00 . A A . 8 ALA HA 1 1 3 597 1 1 8 ALA HB1 H 11.727 -4.984 2.875 1.00 . A A . 8 ALA HB1 1 1 3 598 1 1 8 ALA HB2 H 11.465 -4.570 1.180 1.00 . A A . 8 ALA HB2 1 1 3 599 1 1 8 ALA HB3 H 10.503 -3.791 2.437 1.00 . A A . 8 ALA HB3 1 1 3 600 1 1 8 ALA N N 11.884 -1.773 2.205 1.00 . A A . 8 ALA N 1 1 3 601 1 1 8 ALA O O 14.664 -3.678 1.392 1.00 . A A . 8 ALA O 1 1 3 602 1 1 9 LEU C C 15.082 -1.743 -1.005 1.00 . A A . 9 LEU C 1 1 3 603 1 1 9 LEU CA C 14.005 -2.808 -1.159 1.00 . A A . 9 LEU CA 1 1 3 604 1 1 9 LEU CB C 13.200 -2.546 -2.439 1.00 . A A . 9 LEU CB 1 1 3 605 1 1 9 LEU CD1 C 10.970 -2.745 -3.551 1.00 . A A . 9 LEU CD1 1 1 3 606 1 1 9 LEU CD2 C 11.711 -4.498 -1.943 1.00 . A A . 9 LEU CD2 1 1 3 607 1 1 9 LEU CG C 11.746 -3.004 -2.262 1.00 . A A . 9 LEU CG 1 1 3 608 1 1 9 LEU H H 12.238 -2.402 -0.068 1.00 . A A . 9 LEU H 1 1 3 609 1 1 9 LEU HA H 14.472 -3.780 -1.227 1.00 . A A . 9 LEU HA 1 1 3 610 1 1 9 LEU HB2 H 13.217 -1.488 -2.659 1.00 . A A . 9 LEU HB2 1 1 3 611 1 1 9 LEU HB3 H 13.650 -3.089 -3.257 1.00 . A A . 9 LEU HB3 1 1 3 612 1 1 9 LEU HD11 H 11.500 -3.177 -4.384 1.00 . A A . 9 LEU HD11 1 1 3 613 1 1 9 LEU HD12 H 10.865 -1.681 -3.702 1.00 . A A . 9 LEU HD12 1 1 3 614 1 1 9 LEU HD13 H 9.990 -3.194 -3.477 1.00 . A A . 9 LEU HD13 1 1 3 615 1 1 9 LEU HD21 H 12.134 -5.051 -2.767 1.00 . A A . 9 LEU HD21 1 1 3 616 1 1 9 LEU HD22 H 10.688 -4.806 -1.789 1.00 . A A . 9 LEU HD22 1 1 3 617 1 1 9 LEU HD23 H 12.285 -4.688 -1.049 1.00 . A A . 9 LEU HD23 1 1 3 618 1 1 9 LEU HG H 11.289 -2.451 -1.455 1.00 . A A . 9 LEU HG 1 1 3 619 1 1 9 LEU N N 13.137 -2.778 0.010 1.00 . A A . 9 LEU N 1 1 3 620 1 1 9 LEU O O 16.266 -1.985 -1.245 1.00 . A A . 9 LEU O 1 1 3 621 1 1 10 ALA C C 16.572 0.284 0.684 1.00 . A A . 10 ALA C 1 1 3 622 1 1 10 ALA CA C 15.538 0.582 -0.399 1.00 . A A . 10 ALA CA 1 1 3 623 1 1 10 ALA CB C 14.726 1.815 0.008 1.00 . A A . 10 ALA CB 1 1 3 624 1 1 10 ALA H H 13.679 -0.440 -0.427 1.00 . A A . 10 ALA H 1 1 3 625 1 1 10 ALA HA H 16.050 0.795 -1.326 1.00 . A A . 10 ALA HA 1 1 3 626 1 1 10 ALA HB1 H 13.792 1.828 -0.539 1.00 . A A . 10 ALA HB1 1 1 3 627 1 1 10 ALA HB2 H 15.289 2.710 -0.223 1.00 . A A . 10 ALA HB2 1 1 3 628 1 1 10 ALA HB3 H 14.525 1.779 1.067 1.00 . A A . 10 ALA HB3 1 1 3 629 1 1 10 ALA N N 14.642 -0.555 -0.598 1.00 . A A . 10 ALA N 1 1 3 630 1 1 10 ALA O O 17.699 0.772 0.621 1.00 . A A . 10 ALA O 1 1 3 631 1 1 11 LYS C C 18.427 -1.296 2.285 1.00 . A A . 11 LYS C 1 1 3 632 1 1 11 LYS CA C 17.075 -0.811 2.793 1.00 . A A . 11 LYS CA 1 1 3 633 1 1 11 LYS CB C 16.454 -1.891 3.673 1.00 . A A . 11 LYS CB 1 1 3 634 1 1 11 LYS CD C 15.492 -2.271 5.959 1.00 . A A . 11 LYS CD 1 1 3 635 1 1 11 LYS CE C 15.615 -1.554 7.305 1.00 . A A . 11 LYS CE 1 1 3 636 1 1 11 LYS CG C 15.690 -1.247 4.838 1.00 . A A . 11 LYS CG 1 1 3 637 1 1 11 LYS H H 15.257 -0.835 1.696 1.00 . A A . 11 LYS H 1 1 3 638 1 1 11 LYS HA H 17.220 0.063 3.382 1.00 . A A . 11 LYS HA 1 1 3 639 1 1 11 LYS HB2 H 15.780 -2.470 3.080 1.00 . A A . 11 LYS HB2 1 1 3 640 1 1 11 LYS HB3 H 17.234 -2.531 4.066 1.00 . A A . 11 LYS HB3 1 1 3 641 1 1 11 LYS HD2 H 14.509 -2.717 5.873 1.00 . A A . 11 LYS HD2 1 1 3 642 1 1 11 LYS HD3 H 16.246 -3.042 5.894 1.00 . A A . 11 LYS HD3 1 1 3 643 1 1 11 LYS HE2 H 14.895 -0.746 7.349 1.00 . A A . 11 LYS HE2 1 1 3 644 1 1 11 LYS HE3 H 15.425 -2.249 8.103 1.00 . A A . 11 LYS HE3 1 1 3 645 1 1 11 LYS HG2 H 16.247 -0.407 5.223 1.00 . A A . 11 LYS HG2 1 1 3 646 1 1 11 LYS HG3 H 14.723 -0.908 4.493 1.00 . A A . 11 LYS HG3 1 1 3 647 1 1 11 LYS HZ1 H 17.456 -1.425 8.262 1.00 . A A . 11 LYS HZ1 1 1 3 648 1 1 11 LYS HZ2 H 16.927 0.034 7.578 1.00 . A A . 11 LYS HZ2 1 1 3 649 1 1 11 LYS HZ3 H 17.535 -1.205 6.589 1.00 . A A . 11 LYS HZ3 1 1 3 650 1 1 11 LYS N N 16.177 -0.493 1.685 1.00 . A A . 11 LYS N 1 1 3 651 1 1 11 LYS NZ N 16.987 -0.997 7.443 1.00 . A A . 11 LYS NZ 1 1 3 652 1 1 11 LYS O O 19.462 -1.003 2.883 1.00 . A A . 11 LYS O 1 1 3 653 1 1 12 LYS C C 20.461 -1.392 0.006 1.00 . A A . 12 LYS C 1 1 3 654 1 1 12 LYS CA C 19.656 -2.534 0.607 1.00 . A A . 12 LYS CA 1 1 3 655 1 1 12 LYS CB C 19.346 -3.592 -0.453 1.00 . A A . 12 LYS CB 1 1 3 656 1 1 12 LYS CD C 17.539 -4.855 0.736 1.00 . A A . 12 LYS CD 1 1 3 657 1 1 12 LYS CE C 16.661 -5.660 -0.222 1.00 . A A . 12 LYS CE 1 1 3 658 1 1 12 LYS CG C 18.993 -4.904 0.251 1.00 . A A . 12 LYS CG 1 1 3 659 1 1 12 LYS H H 17.567 -2.220 0.742 1.00 . A A . 12 LYS H 1 1 3 660 1 1 12 LYS HA H 20.237 -2.989 1.396 1.00 . A A . 12 LYS HA 1 1 3 661 1 1 12 LYS HB2 H 18.513 -3.266 -1.061 1.00 . A A . 12 LYS HB2 1 1 3 662 1 1 12 LYS HB3 H 20.213 -3.743 -1.079 1.00 . A A . 12 LYS HB3 1 1 3 663 1 1 12 LYS HD2 H 17.476 -5.274 1.731 1.00 . A A . 12 LYS HD2 1 1 3 664 1 1 12 LYS HD3 H 17.200 -3.831 0.761 1.00 . A A . 12 LYS HD3 1 1 3 665 1 1 12 LYS HE2 H 16.628 -5.166 -1.181 1.00 . A A . 12 LYS HE2 1 1 3 666 1 1 12 LYS HE3 H 17.084 -6.645 -0.342 1.00 . A A . 12 LYS HE3 1 1 3 667 1 1 12 LYS HG2 H 19.118 -5.730 -0.439 1.00 . A A . 12 LYS HG2 1 1 3 668 1 1 12 LYS HG3 H 19.648 -5.045 1.099 1.00 . A A . 12 LYS HG3 1 1 3 669 1 1 12 LYS HZ1 H 15.027 -4.896 0.829 1.00 . A A . 12 LYS HZ1 1 1 3 670 1 1 12 LYS HZ2 H 15.234 -6.579 0.984 1.00 . A A . 12 LYS HZ2 1 1 3 671 1 1 12 LYS HZ3 H 14.609 -5.932 -0.449 1.00 . A A . 12 LYS HZ3 1 1 3 672 1 1 12 LYS N N 18.417 -2.026 1.181 1.00 . A A . 12 LYS N 1 1 3 673 1 1 12 LYS NZ N 15.281 -5.775 0.326 1.00 . A A . 12 LYS NZ 1 1 3 674 1 1 12 LYS O O 21.690 -1.409 0.021 1.00 . A A . 12 LYS O 1 1 3 675 1 1 13 ILE C C 20.781 1.750 0.028 1.00 . A A . 13 ILE C 1 1 3 676 1 1 13 ILE CA C 20.404 0.778 -1.080 1.00 . A A . 13 ILE CA 1 1 3 677 1 1 13 ILE CB C 19.476 1.463 -2.082 1.00 . A A . 13 ILE CB 1 1 3 678 1 1 13 ILE CD1 C 19.853 -0.296 -3.834 1.00 . A A . 13 ILE CD1 1 1 3 679 1 1 13 ILE CG1 C 18.801 0.410 -2.974 1.00 . A A . 13 ILE CG1 1 1 3 680 1 1 13 ILE CG2 C 20.279 2.430 -2.956 1.00 . A A . 13 ILE CG2 1 1 3 681 1 1 13 ILE H H 18.776 -0.424 -0.464 1.00 . A A . 13 ILE H 1 1 3 682 1 1 13 ILE HA H 21.290 0.466 -1.587 1.00 . A A . 13 ILE HA 1 1 3 683 1 1 13 ILE HB H 18.726 2.014 -1.546 1.00 . A A . 13 ILE HB 1 1 3 684 1 1 13 ILE HD11 H 20.438 0.442 -4.366 1.00 . A A . 13 ILE HD11 1 1 3 685 1 1 13 ILE HD12 H 19.358 -0.942 -4.545 1.00 . A A . 13 ILE HD12 1 1 3 686 1 1 13 ILE HD13 H 20.504 -0.886 -3.204 1.00 . A A . 13 ILE HD13 1 1 3 687 1 1 13 ILE HG12 H 18.296 -0.314 -2.355 1.00 . A A . 13 ILE HG12 1 1 3 688 1 1 13 ILE HG13 H 18.082 0.896 -3.618 1.00 . A A . 13 ILE HG13 1 1 3 689 1 1 13 ILE HG21 H 20.653 3.239 -2.346 1.00 . A A . 13 ILE HG21 1 1 3 690 1 1 13 ILE HG22 H 19.642 2.829 -3.731 1.00 . A A . 13 ILE HG22 1 1 3 691 1 1 13 ILE HG23 H 21.109 1.907 -3.409 1.00 . A A . 13 ILE HG23 1 1 3 692 1 1 13 ILE N N 19.755 -0.389 -0.499 1.00 . A A . 13 ILE N 1 1 3 693 1 1 13 ILE O O 21.861 2.346 0.012 1.00 . A A . 13 ILE O 1 1 3 694 1 1 14 LEU C C 21.179 2.213 3.034 1.00 . A A . 14 LEU C 1 1 3 695 1 1 14 LEU CA C 20.107 2.786 2.122 1.00 . A A . 14 LEU CA 1 1 3 696 1 1 14 LEU CB C 18.808 2.975 2.911 1.00 . A A . 14 LEU CB 1 1 3 697 1 1 14 LEU CD1 C 18.338 5.272 2.030 1.00 . A A . 14 LEU CD1 1 1 3 698 1 1 14 LEU CD2 C 17.458 4.589 4.261 1.00 . A A . 14 LEU CD2 1 1 3 699 1 1 14 LEU CG C 18.630 4.449 3.286 1.00 . A A . 14 LEU CG 1 1 3 700 1 1 14 LEU H H 19.041 1.384 0.948 1.00 . A A . 14 LEU H 1 1 3 701 1 1 14 LEU HA H 20.437 3.743 1.746 1.00 . A A . 14 LEU HA 1 1 3 702 1 1 14 LEU HB2 H 17.974 2.658 2.303 1.00 . A A . 14 LEU HB2 1 1 3 703 1 1 14 LEU HB3 H 18.845 2.378 3.809 1.00 . A A . 14 LEU HB3 1 1 3 704 1 1 14 LEU HD11 H 17.820 4.657 1.308 1.00 . A A . 14 LEU HD11 1 1 3 705 1 1 14 LEU HD12 H 19.270 5.620 1.606 1.00 . A A . 14 LEU HD12 1 1 3 706 1 1 14 LEU HD13 H 17.720 6.121 2.288 1.00 . A A . 14 LEU HD13 1 1 3 707 1 1 14 LEU HD21 H 17.727 4.156 5.215 1.00 . A A . 14 LEU HD21 1 1 3 708 1 1 14 LEU HD22 H 16.594 4.079 3.864 1.00 . A A . 14 LEU HD22 1 1 3 709 1 1 14 LEU HD23 H 17.225 5.633 4.396 1.00 . A A . 14 LEU HD23 1 1 3 710 1 1 14 LEU HG H 19.534 4.815 3.756 1.00 . A A . 14 LEU HG 1 1 3 711 1 1 14 LEU N N 19.877 1.896 0.994 1.00 . A A . 14 LEU N 1 1 3 712 1 1 14 LEU O O 21.998 2.953 3.579 1.00 . A A . 14 LEU O 1 1 3 713 1 1 15 NH2 HN1 H 20.573 0.338 2.799 1.00 . A A . 15 NH2 HN1 1 1 3 714 1 1 15 NH2 N N 21.228 0.927 3.232 1.00 . A A . 15 NH2 N 1 1 4 715 1 1 1 ILE C C 1.778 -1.705 1.152 1.00 . A A . 1 ILE C 1 1 4 716 1 1 1 ILE CA C 1.409 -3.179 1.293 1.00 . A A . 1 ILE CA 1 1 4 717 1 1 1 ILE CB C 2.601 -3.999 1.822 1.00 . A A . 1 ILE CB 1 1 4 718 1 1 1 ILE CD1 C 4.403 -4.111 3.556 1.00 . A A . 1 ILE CD1 1 1 4 719 1 1 1 ILE CG1 C 3.329 -3.227 2.924 1.00 . A A . 1 ILE CG1 1 1 4 720 1 1 1 ILE CG2 C 3.586 -4.309 0.691 1.00 . A A . 1 ILE CG2 1 1 4 721 1 1 1 ILE H1 H 1.434 -4.617 -0.210 1.00 . A A . 1 ILE H1 1 1 4 722 1 1 1 ILE H2 H 1.292 -3.026 -0.775 1.00 . A A . 1 ILE H2 1 1 4 723 1 1 1 ILE H3 H -0.043 -3.800 -0.061 1.00 . A A . 1 ILE H3 1 1 4 724 1 1 1 ILE HA H 0.579 -3.275 1.979 1.00 . A A . 1 ILE HA 1 1 4 725 1 1 1 ILE HB H 2.237 -4.919 2.233 1.00 . A A . 1 ILE HB 1 1 4 726 1 1 1 ILE HD11 H 4.487 -5.035 3.001 1.00 . A A . 1 ILE HD11 1 1 4 727 1 1 1 ILE HD12 H 4.132 -4.330 4.578 1.00 . A A . 1 ILE HD12 1 1 4 728 1 1 1 ILE HD13 H 5.349 -3.593 3.535 1.00 . A A . 1 ILE HD13 1 1 4 729 1 1 1 ILE HG12 H 3.791 -2.357 2.501 1.00 . A A . 1 ILE HG12 1 1 4 730 1 1 1 ILE HG13 H 2.622 -2.933 3.681 1.00 . A A . 1 ILE HG13 1 1 4 731 1 1 1 ILE HG21 H 3.203 -5.118 0.088 1.00 . A A . 1 ILE HG21 1 1 4 732 1 1 1 ILE HG22 H 4.538 -4.598 1.113 1.00 . A A . 1 ILE HG22 1 1 4 733 1 1 1 ILE HG23 H 3.716 -3.431 0.073 1.00 . A A . 1 ILE HG23 1 1 4 734 1 1 1 ILE N N 0.993 -3.697 -0.037 1.00 . A A . 1 ILE N 1 1 4 735 1 1 1 ILE O O 1.961 -1.204 0.038 1.00 . A A . 1 ILE O 1 1 4 736 1 1 2 ASN C C 3.646 0.660 1.928 1.00 . A A . 2 ASN C 1 1 4 737 1 1 2 ASN CA C 2.195 0.398 2.315 1.00 . A A . 2 ASN CA 1 1 4 738 1 1 2 ASN CB C 1.922 0.963 3.709 1.00 . A A . 2 ASN CB 1 1 4 739 1 1 2 ASN CG C 2.835 0.294 4.723 1.00 . A A . 2 ASN CG 1 1 4 740 1 1 2 ASN H H 1.696 -1.487 3.129 1.00 . A A . 2 ASN H 1 1 4 741 1 1 2 ASN HA H 1.566 0.914 1.613 1.00 . A A . 2 ASN HA 1 1 4 742 1 1 2 ASN HB2 H 2.106 2.029 3.706 1.00 . A A . 2 ASN HB2 1 1 4 743 1 1 2 ASN HB3 H 0.892 0.780 3.978 1.00 . A A . 2 ASN HB3 1 1 4 744 1 1 2 ASN HD21 H 1.801 -1.399 4.748 1.00 . A A . 2 ASN HD21 1 1 4 745 1 1 2 ASN HD22 H 3.172 -1.375 5.745 1.00 . A A . 2 ASN HD22 1 1 4 746 1 1 2 ASN N N 1.868 -1.024 2.287 1.00 . A A . 2 ASN N 1 1 4 747 1 1 2 ASN ND2 N 2.581 -0.925 5.107 1.00 . A A . 2 ASN ND2 1 1 4 748 1 1 2 ASN O O 4.369 -0.227 1.474 1.00 . A A . 2 ASN O 1 1 4 749 1 1 2 ASN OD1 O 3.810 0.895 5.174 1.00 . A A . 2 ASN OD1 1 1 4 750 1 1 3 LEU C C 6.439 1.572 2.537 1.00 . A A . 3 LEU C 1 1 4 751 1 1 3 LEU CA C 5.381 2.366 1.796 1.00 . A A . 3 LEU CA 1 1 4 752 1 1 3 LEU CB C 5.497 3.829 2.174 1.00 . A A . 3 LEU CB 1 1 4 753 1 1 3 LEU CD1 C 3.173 4.683 2.598 1.00 . A A . 3 LEU CD1 1 1 4 754 1 1 3 LEU CD2 C 4.781 6.032 1.233 1.00 . A A . 3 LEU CD2 1 1 4 755 1 1 3 LEU CG C 4.321 4.614 1.581 1.00 . A A . 3 LEU CG 1 1 4 756 1 1 3 LEU H H 3.409 2.548 2.487 1.00 . A A . 3 LEU H 1 1 4 757 1 1 3 LEU HA H 5.543 2.278 0.750 1.00 . A A . 3 LEU HA 1 1 4 758 1 1 3 LEU HB2 H 5.474 3.897 3.236 1.00 . A A . 3 LEU HB2 1 1 4 759 1 1 3 LEU HB3 H 6.428 4.230 1.801 1.00 . A A . 3 LEU HB3 1 1 4 760 1 1 3 LEU HD11 H 2.312 4.167 2.201 1.00 . A A . 3 LEU HD11 1 1 4 761 1 1 3 LEU HD12 H 2.915 5.716 2.784 1.00 . A A . 3 LEU HD12 1 1 4 762 1 1 3 LEU HD13 H 3.477 4.217 3.525 1.00 . A A . 3 LEU HD13 1 1 4 763 1 1 3 LEU HD21 H 5.150 6.520 2.122 1.00 . A A . 3 LEU HD21 1 1 4 764 1 1 3 LEU HD22 H 3.948 6.590 0.833 1.00 . A A . 3 LEU HD22 1 1 4 765 1 1 3 LEU HD23 H 5.569 5.981 0.497 1.00 . A A . 3 LEU HD23 1 1 4 766 1 1 3 LEU HG H 3.971 4.115 0.684 1.00 . A A . 3 LEU HG 1 1 4 767 1 1 3 LEU N N 4.043 1.906 2.117 1.00 . A A . 3 LEU N 1 1 4 768 1 1 3 LEU O O 7.595 1.530 2.121 1.00 . A A . 3 LEU O 1 1 4 769 1 1 4 LYS C C 7.738 -0.796 3.547 1.00 . A A . 4 LYS C 1 1 4 770 1 1 4 LYS CA C 7.007 0.196 4.434 1.00 . A A . 4 LYS CA 1 1 4 771 1 1 4 LYS CB C 6.301 -0.566 5.554 1.00 . A A . 4 LYS CB 1 1 4 772 1 1 4 LYS CD C 6.253 1.662 6.735 1.00 . A A . 4 LYS CD 1 1 4 773 1 1 4 LYS CE C 5.252 2.136 7.788 1.00 . A A . 4 LYS CE 1 1 4 774 1 1 4 LYS CG C 6.503 0.155 6.896 1.00 . A A . 4 LYS CG 1 1 4 775 1 1 4 LYS H H 5.119 1.041 3.943 1.00 . A A . 4 LYS H 1 1 4 776 1 1 4 LYS HA H 7.714 0.882 4.861 1.00 . A A . 4 LYS HA 1 1 4 777 1 1 4 LYS HB2 H 5.249 -0.637 5.330 1.00 . A A . 4 LYS HB2 1 1 4 778 1 1 4 LYS HB3 H 6.716 -1.560 5.618 1.00 . A A . 4 LYS HB3 1 1 4 779 1 1 4 LYS HD2 H 7.184 2.196 6.862 1.00 . A A . 4 LYS HD2 1 1 4 780 1 1 4 LYS HD3 H 5.856 1.863 5.752 1.00 . A A . 4 LYS HD3 1 1 4 781 1 1 4 LYS HE2 H 5.655 1.958 8.775 1.00 . A A . 4 LYS HE2 1 1 4 782 1 1 4 LYS HE3 H 5.068 3.192 7.660 1.00 . A A . 4 LYS HE3 1 1 4 783 1 1 4 LYS HG2 H 5.817 -0.251 7.624 1.00 . A A . 4 LYS HG2 1 1 4 784 1 1 4 LYS HG3 H 7.516 -0.002 7.237 1.00 . A A . 4 LYS HG3 1 1 4 785 1 1 4 LYS HZ1 H 4.054 0.462 8.097 1.00 . A A . 4 LYS HZ1 1 1 4 786 1 1 4 LYS HZ2 H 3.776 1.252 6.613 1.00 . A A . 4 LYS HZ2 1 1 4 787 1 1 4 LYS HZ3 H 3.205 1.929 8.066 1.00 . A A . 4 LYS HZ3 1 1 4 788 1 1 4 LYS N N 6.053 0.960 3.643 1.00 . A A . 4 LYS N 1 1 4 789 1 1 4 LYS NZ N 3.978 1.388 7.630 1.00 . A A . 4 LYS NZ 1 1 4 790 1 1 4 LYS O O 8.936 -1.026 3.705 1.00 . A A . 4 LYS O 1 1 4 791 1 1 5 ALA C C 8.744 -1.678 0.936 1.00 . A A . 5 ALA C 1 1 4 792 1 1 5 ALA CA C 7.590 -2.326 1.684 1.00 . A A . 5 ALA CA 1 1 4 793 1 1 5 ALA CB C 6.539 -2.807 0.680 1.00 . A A . 5 ALA CB 1 1 4 794 1 1 5 ALA H H 6.054 -1.131 2.534 1.00 . A A . 5 ALA H 1 1 4 795 1 1 5 ALA HA H 7.959 -3.173 2.242 1.00 . A A . 5 ALA HA 1 1 4 796 1 1 5 ALA HB1 H 6.769 -2.410 -0.298 1.00 . A A . 5 ALA HB1 1 1 4 797 1 1 5 ALA HB2 H 5.563 -2.464 0.988 1.00 . A A . 5 ALA HB2 1 1 4 798 1 1 5 ALA HB3 H 6.548 -3.888 0.639 1.00 . A A . 5 ALA HB3 1 1 4 799 1 1 5 ALA N N 7.004 -1.365 2.608 1.00 . A A . 5 ALA N 1 1 4 800 1 1 5 ALA O O 9.806 -2.279 0.780 1.00 . A A . 5 ALA O 1 1 4 801 1 1 6 LEU C C 10.800 0.428 0.662 1.00 . A A . 6 LEU C 1 1 4 802 1 1 6 LEU CA C 9.573 0.290 -0.220 1.00 . A A . 6 LEU CA 1 1 4 803 1 1 6 LEU CB C 9.057 1.683 -0.576 1.00 . A A . 6 LEU CB 1 1 4 804 1 1 6 LEU CD1 C 7.136 2.957 -1.541 1.00 . A A . 6 LEU CD1 1 1 4 805 1 1 6 LEU CD2 C 7.980 0.911 -2.694 1.00 . A A . 6 LEU CD2 1 1 4 806 1 1 6 LEU CG C 7.733 1.567 -1.334 1.00 . A A . 6 LEU CG 1 1 4 807 1 1 6 LEU H H 7.679 0.000 0.664 1.00 . A A . 6 LEU H 1 1 4 808 1 1 6 LEU HA H 9.834 -0.236 -1.124 1.00 . A A . 6 LEU HA 1 1 4 809 1 1 6 LEU HB2 H 8.901 2.247 0.336 1.00 . A A . 6 LEU HB2 1 1 4 810 1 1 6 LEU HB3 H 9.782 2.185 -1.194 1.00 . A A . 6 LEU HB3 1 1 4 811 1 1 6 LEU HD11 H 7.026 3.449 -0.584 1.00 . A A . 6 LEU HD11 1 1 4 812 1 1 6 LEU HD12 H 6.166 2.867 -2.010 1.00 . A A . 6 LEU HD12 1 1 4 813 1 1 6 LEU HD13 H 7.789 3.542 -2.173 1.00 . A A . 6 LEU HD13 1 1 4 814 1 1 6 LEU HD21 H 8.938 1.222 -3.077 1.00 . A A . 6 LEU HD21 1 1 4 815 1 1 6 LEU HD22 H 7.200 1.207 -3.382 1.00 . A A . 6 LEU HD22 1 1 4 816 1 1 6 LEU HD23 H 7.973 -0.162 -2.581 1.00 . A A . 6 LEU HD23 1 1 4 817 1 1 6 LEU HG H 7.042 0.963 -0.766 1.00 . A A . 6 LEU HG 1 1 4 818 1 1 6 LEU N N 8.537 -0.439 0.493 1.00 . A A . 6 LEU N 1 1 4 819 1 1 6 LEU O O 11.933 0.202 0.230 1.00 . A A . 6 LEU O 1 1 4 820 1 1 7 ALA C C 12.409 -0.350 3.012 1.00 . A A . 7 ALA C 1 1 4 821 1 1 7 ALA CA C 11.644 0.955 2.871 1.00 . A A . 7 ALA CA 1 1 4 822 1 1 7 ALA CB C 11.091 1.380 4.234 1.00 . A A . 7 ALA CB 1 1 4 823 1 1 7 ALA H H 9.631 0.947 2.198 1.00 . A A . 7 ALA H 1 1 4 824 1 1 7 ALA HA H 12.317 1.716 2.511 1.00 . A A . 7 ALA HA 1 1 4 825 1 1 7 ALA HB1 H 10.865 2.435 4.213 1.00 . A A . 7 ALA HB1 1 1 4 826 1 1 7 ALA HB2 H 11.826 1.184 5.002 1.00 . A A . 7 ALA HB2 1 1 4 827 1 1 7 ALA HB3 H 10.192 0.824 4.448 1.00 . A A . 7 ALA HB3 1 1 4 828 1 1 7 ALA N N 10.559 0.791 1.914 1.00 . A A . 7 ALA N 1 1 4 829 1 1 7 ALA O O 13.600 -0.355 3.330 1.00 . A A . 7 ALA O 1 1 4 830 1 1 8 ALA C C 13.349 -2.945 1.741 1.00 . A A . 8 ALA C 1 1 4 831 1 1 8 ALA CA C 12.337 -2.772 2.862 1.00 . A A . 8 ALA CA 1 1 4 832 1 1 8 ALA CB C 11.276 -3.879 2.780 1.00 . A A . 8 ALA CB 1 1 4 833 1 1 8 ALA H H 10.771 -1.383 2.519 1.00 . A A . 8 ALA H 1 1 4 834 1 1 8 ALA HA H 12.847 -2.849 3.802 1.00 . A A . 8 ALA HA 1 1 4 835 1 1 8 ALA HB1 H 11.247 -4.280 1.778 1.00 . A A . 8 ALA HB1 1 1 4 836 1 1 8 ALA HB2 H 10.306 -3.473 3.033 1.00 . A A . 8 ALA HB2 1 1 4 837 1 1 8 ALA HB3 H 11.527 -4.669 3.473 1.00 . A A . 8 ALA HB3 1 1 4 838 1 1 8 ALA N N 11.715 -1.457 2.770 1.00 . A A . 8 ALA N 1 1 4 839 1 1 8 ALA O O 14.478 -3.386 1.962 1.00 . A A . 8 ALA O 1 1 4 840 1 1 9 LEU C C 14.885 -1.628 -0.571 1.00 . A A . 9 LEU C 1 1 4 841 1 1 9 LEU CA C 13.792 -2.686 -0.635 1.00 . A A . 9 LEU CA 1 1 4 842 1 1 9 LEU CB C 12.973 -2.498 -1.920 1.00 . A A . 9 LEU CB 1 1 4 843 1 1 9 LEU CD1 C 10.719 -2.677 -2.978 1.00 . A A . 9 LEU CD1 1 1 4 844 1 1 9 LEU CD2 C 11.394 -4.326 -1.228 1.00 . A A . 9 LEU CD2 1 1 4 845 1 1 9 LEU CG C 11.504 -2.866 -1.681 1.00 . A A . 9 LEU CG 1 1 4 846 1 1 9 LEU H H 12.023 -2.244 0.442 1.00 . A A . 9 LEU H 1 1 4 847 1 1 9 LEU HA H 14.252 -3.662 -0.654 1.00 . A A . 9 LEU HA 1 1 4 848 1 1 9 LEU HB2 H 13.038 -1.467 -2.235 1.00 . A A . 9 LEU HB2 1 1 4 849 1 1 9 LEU HB3 H 13.377 -3.132 -2.693 1.00 . A A . 9 LEU HB3 1 1 4 850 1 1 9 LEU HD11 H 9.802 -2.147 -2.766 1.00 . A A . 9 LEU HD11 1 1 4 851 1 1 9 LEU HD12 H 10.485 -3.642 -3.406 1.00 . A A . 9 LEU HD12 1 1 4 852 1 1 9 LEU HD13 H 11.312 -2.109 -3.679 1.00 . A A . 9 LEU HD13 1 1 4 853 1 1 9 LEU HD21 H 12.354 -4.668 -0.874 1.00 . A A . 9 LEU HD21 1 1 4 854 1 1 9 LEU HD22 H 11.080 -4.938 -2.060 1.00 . A A . 9 LEU HD22 1 1 4 855 1 1 9 LEU HD23 H 10.667 -4.400 -0.432 1.00 . A A . 9 LEU HD23 1 1 4 856 1 1 9 LEU HG H 11.087 -2.220 -0.920 1.00 . A A . 9 LEU HG 1 1 4 857 1 1 9 LEU N N 12.929 -2.588 0.538 1.00 . A A . 9 LEU N 1 1 4 858 1 1 9 LEU O O 16.065 -1.913 -0.803 1.00 . A A . 9 LEU O 1 1 4 859 1 1 10 ALA C C 16.558 0.378 0.799 1.00 . A A . 10 ALA C 1 1 4 860 1 1 10 ALA CA C 15.419 0.711 -0.154 1.00 . A A . 10 ALA CA 1 1 4 861 1 1 10 ALA CB C 14.689 1.963 0.349 1.00 . A A . 10 ALA CB 1 1 4 862 1 1 10 ALA H H 13.525 -0.248 -0.076 1.00 . A A . 10 ALA H 1 1 4 863 1 1 10 ALA HA H 15.827 0.914 -1.133 1.00 . A A . 10 ALA HA 1 1 4 864 1 1 10 ALA HB1 H 15.343 2.821 0.267 1.00 . A A . 10 ALA HB1 1 1 4 865 1 1 10 ALA HB2 H 14.408 1.826 1.384 1.00 . A A . 10 ALA HB2 1 1 4 866 1 1 10 ALA HB3 H 13.802 2.132 -0.245 1.00 . A A . 10 ALA HB3 1 1 4 867 1 1 10 ALA N N 14.481 -0.405 -0.248 1.00 . A A . 10 ALA N 1 1 4 868 1 1 10 ALA O O 17.698 0.797 0.583 1.00 . A A . 10 ALA O 1 1 4 869 1 1 11 LYS C C 18.481 -1.347 2.163 1.00 . A A . 11 LYS C 1 1 4 870 1 1 11 LYS CA C 17.261 -0.731 2.841 1.00 . A A . 11 LYS CA 1 1 4 871 1 1 11 LYS CB C 16.673 -1.731 3.847 1.00 . A A . 11 LYS CB 1 1 4 872 1 1 11 LYS CD C 17.457 -0.364 5.790 1.00 . A A . 11 LYS CD 1 1 4 873 1 1 11 LYS CE C 17.648 -0.529 7.298 1.00 . A A . 11 LYS CE 1 1 4 874 1 1 11 LYS CG C 17.510 -1.737 5.128 1.00 . A A . 11 LYS CG 1 1 4 875 1 1 11 LYS H H 15.329 -0.670 1.974 1.00 . A A . 11 LYS H 1 1 4 876 1 1 11 LYS HA H 17.568 0.157 3.366 1.00 . A A . 11 LYS HA 1 1 4 877 1 1 11 LYS HB2 H 15.656 -1.444 4.083 1.00 . A A . 11 LYS HB2 1 1 4 878 1 1 11 LYS HB3 H 16.669 -2.724 3.415 1.00 . A A . 11 LYS HB3 1 1 4 879 1 1 11 LYS HD2 H 18.239 0.262 5.388 1.00 . A A . 11 LYS HD2 1 1 4 880 1 1 11 LYS HD3 H 16.495 0.094 5.597 1.00 . A A . 11 LYS HD3 1 1 4 881 1 1 11 LYS HE2 H 17.690 0.442 7.761 1.00 . A A . 11 LYS HE2 1 1 4 882 1 1 11 LYS HE3 H 16.816 -1.084 7.704 1.00 . A A . 11 LYS HE3 1 1 4 883 1 1 11 LYS HG2 H 17.113 -2.472 5.812 1.00 . A A . 11 LYS HG2 1 1 4 884 1 1 11 LYS HG3 H 18.534 -1.981 4.892 1.00 . A A . 11 LYS HG3 1 1 4 885 1 1 11 LYS HZ1 H 19.276 -0.995 8.512 1.00 . A A . 11 LYS HZ1 1 1 4 886 1 1 11 LYS HZ2 H 19.626 -1.025 6.851 1.00 . A A . 11 LYS HZ2 1 1 4 887 1 1 11 LYS HZ3 H 18.739 -2.287 7.560 1.00 . A A . 11 LYS HZ3 1 1 4 888 1 1 11 LYS N N 16.252 -0.367 1.853 1.00 . A A . 11 LYS N 1 1 4 889 1 1 11 LYS NZ N 18.917 -1.264 7.575 1.00 . A A . 11 LYS NZ 1 1 4 890 1 1 11 LYS O O 19.612 -1.178 2.621 1.00 . A A . 11 LYS O 1 1 4 891 1 1 12 LYS C C 20.060 -1.722 -0.533 1.00 . A A . 12 LYS C 1 1 4 892 1 1 12 LYS CA C 19.320 -2.720 0.350 1.00 . A A . 12 LYS CA 1 1 4 893 1 1 12 LYS CB C 18.753 -3.863 -0.507 1.00 . A A . 12 LYS CB 1 1 4 894 1 1 12 LYS CD C 17.242 -4.885 1.211 1.00 . A A . 12 LYS CD 1 1 4 895 1 1 12 LYS CE C 16.090 -5.640 0.552 1.00 . A A . 12 LYS CE 1 1 4 896 1 1 12 LYS CG C 18.512 -5.089 0.383 1.00 . A A . 12 LYS CG 1 1 4 897 1 1 12 LYS H H 17.323 -2.173 0.773 1.00 . A A . 12 LYS H 1 1 4 898 1 1 12 LYS HA H 20.015 -3.133 1.061 1.00 . A A . 12 LYS HA 1 1 4 899 1 1 12 LYS HB2 H 17.820 -3.549 -0.955 1.00 . A A . 12 LYS HB2 1 1 4 900 1 1 12 LYS HB3 H 19.455 -4.116 -1.286 1.00 . A A . 12 LYS HB3 1 1 4 901 1 1 12 LYS HD2 H 17.399 -5.261 2.211 1.00 . A A . 12 LYS HD2 1 1 4 902 1 1 12 LYS HD3 H 17.000 -3.839 1.254 1.00 . A A . 12 LYS HD3 1 1 4 903 1 1 12 LYS HE2 H 15.783 -5.117 -0.343 1.00 . A A . 12 LYS HE2 1 1 4 904 1 1 12 LYS HE3 H 16.412 -6.634 0.292 1.00 . A A . 12 LYS HE3 1 1 4 905 1 1 12 LYS HG2 H 18.401 -5.968 -0.237 1.00 . A A . 12 LYS HG2 1 1 4 906 1 1 12 LYS HG3 H 19.353 -5.225 1.044 1.00 . A A . 12 LYS HG3 1 1 4 907 1 1 12 LYS HZ1 H 15.197 -6.354 2.286 1.00 . A A . 12 LYS HZ1 1 1 4 908 1 1 12 LYS HZ2 H 14.117 -6.098 1.001 1.00 . A A . 12 LYS HZ2 1 1 4 909 1 1 12 LYS HZ3 H 14.736 -4.770 1.872 1.00 . A A . 12 LYS HZ3 1 1 4 910 1 1 12 LYS N N 18.242 -2.068 1.080 1.00 . A A . 12 LYS N 1 1 4 911 1 1 12 LYS NZ N 14.950 -5.721 1.497 1.00 . A A . 12 LYS NZ 1 1 4 912 1 1 12 LYS O O 21.248 -1.898 -0.825 1.00 . A A . 12 LYS O 1 1 4 913 1 1 13 ILE C C 20.607 1.429 -0.954 1.00 . A A . 13 ILE C 1 1 4 914 1 1 13 ILE CA C 19.974 0.332 -1.801 1.00 . A A . 13 ILE CA 1 1 4 915 1 1 13 ILE CB C 18.927 0.944 -2.731 1.00 . A A . 13 ILE CB 1 1 4 916 1 1 13 ILE CD1 C 18.796 -1.129 -4.154 1.00 . A A . 13 ILE CD1 1 1 4 917 1 1 13 ILE CG1 C 18.000 -0.152 -3.285 1.00 . A A . 13 ILE CG1 1 1 4 918 1 1 13 ILE CG2 C 19.616 1.659 -3.895 1.00 . A A . 13 ILE CG2 1 1 4 919 1 1 13 ILE H H 18.428 -0.583 -0.695 1.00 . A A . 13 ILE H 1 1 4 920 1 1 13 ILE HA H 20.730 -0.132 -2.395 1.00 . A A . 13 ILE HA 1 1 4 921 1 1 13 ILE HB H 18.346 1.656 -2.177 1.00 . A A . 13 ILE HB 1 1 4 922 1 1 13 ILE HD11 H 18.998 -2.028 -3.590 1.00 . A A . 13 ILE HD11 1 1 4 923 1 1 13 ILE HD12 H 19.727 -0.674 -4.453 1.00 . A A . 13 ILE HD12 1 1 4 924 1 1 13 ILE HD13 H 18.220 -1.378 -5.032 1.00 . A A . 13 ILE HD13 1 1 4 925 1 1 13 ILE HG12 H 17.547 -0.691 -2.468 1.00 . A A . 13 ILE HG12 1 1 4 926 1 1 13 ILE HG13 H 17.225 0.303 -3.886 1.00 . A A . 13 ILE HG13 1 1 4 927 1 1 13 ILE HG21 H 19.794 2.690 -3.629 1.00 . A A . 13 ILE HG21 1 1 4 928 1 1 13 ILE HG22 H 18.985 1.618 -4.769 1.00 . A A . 13 ILE HG22 1 1 4 929 1 1 13 ILE HG23 H 20.558 1.177 -4.111 1.00 . A A . 13 ILE HG23 1 1 4 930 1 1 13 ILE N N 19.364 -0.677 -0.954 1.00 . A A . 13 ILE N 1 1 4 931 1 1 13 ILE O O 21.704 1.905 -1.253 1.00 . A A . 13 ILE O 1 1 4 932 1 1 14 LEU C C 21.349 2.270 2.020 1.00 . A A . 14 LEU C 1 1 4 933 1 1 14 LEU CA C 20.405 2.865 0.985 1.00 . A A . 14 LEU CA 1 1 4 934 1 1 14 LEU CB C 19.225 3.564 1.678 1.00 . A A . 14 LEU CB 1 1 4 935 1 1 14 LEU CD1 C 18.208 4.055 -0.558 1.00 . A A . 14 LEU CD1 1 1 4 936 1 1 14 LEU CD2 C 17.457 5.320 1.455 1.00 . A A . 14 LEU CD2 1 1 4 937 1 1 14 LEU CG C 18.657 4.664 0.770 1.00 . A A . 14 LEU CG 1 1 4 938 1 1 14 LEU H H 19.040 1.401 0.290 1.00 . A A . 14 LEU H 1 1 4 939 1 1 14 LEU HA H 20.943 3.592 0.395 1.00 . A A . 14 LEU HA 1 1 4 940 1 1 14 LEU HB2 H 18.453 2.841 1.888 1.00 . A A . 14 LEU HB2 1 1 4 941 1 1 14 LEU HB3 H 19.562 4.008 2.602 1.00 . A A . 14 LEU HB3 1 1 4 942 1 1 14 LEU HD11 H 17.425 4.661 -0.985 1.00 . A A . 14 LEU HD11 1 1 4 943 1 1 14 LEU HD12 H 17.839 3.055 -0.387 1.00 . A A . 14 LEU HD12 1 1 4 944 1 1 14 LEU HD13 H 19.047 4.019 -1.236 1.00 . A A . 14 LEU HD13 1 1 4 945 1 1 14 LEU HD21 H 17.278 4.839 2.405 1.00 . A A . 14 LEU HD21 1 1 4 946 1 1 14 LEU HD22 H 16.584 5.221 0.830 1.00 . A A . 14 LEU HD22 1 1 4 947 1 1 14 LEU HD23 H 17.664 6.367 1.618 1.00 . A A . 14 LEU HD23 1 1 4 948 1 1 14 LEU HG H 19.418 5.408 0.585 1.00 . A A . 14 LEU HG 1 1 4 949 1 1 14 LEU N N 19.911 1.821 0.102 1.00 . A A . 14 LEU N 1 1 4 950 1 1 14 LEU O O 21.102 2.368 3.225 1.00 . A A . 14 LEU O 1 1 4 951 1 1 15 NH2 HN1 H 22.623 1.575 0.668 1.00 . A A . 15 NH2 HN1 1 1 4 952 1 1 15 NH2 N N 22.427 1.655 1.625 1.00 . A A . 15 NH2 N 1 1 5 953 1 1 1 ILE C C 2.211 0.554 0.103 1.00 . A A . 1 ILE C 1 1 5 954 1 1 1 ILE CA C 1.662 -0.812 -0.314 1.00 . A A . 1 ILE CA 1 1 5 955 1 1 1 ILE CB C 0.266 -1.042 0.291 1.00 . A A . 1 ILE CB 1 1 5 956 1 1 1 ILE CD1 C 0.017 -2.757 2.135 1.00 . A A . 1 ILE CD1 1 1 5 957 1 1 1 ILE CG1 C 0.376 -1.303 1.808 1.00 . A A . 1 ILE CG1 1 1 5 958 1 1 1 ILE CG2 C -0.400 -2.239 -0.400 1.00 . A A . 1 ILE CG2 1 1 5 959 1 1 1 ILE H1 H 2.270 -2.282 1.032 1.00 . A A . 1 ILE H1 1 1 5 960 1 1 1 ILE H2 H 3.546 -1.470 0.263 1.00 . A A . 1 ILE H2 1 1 5 961 1 1 1 ILE H3 H 2.639 -2.627 -0.581 1.00 . A A . 1 ILE H3 1 1 5 962 1 1 1 ILE HA H 1.591 -0.845 -1.390 1.00 . A A . 1 ILE HA 1 1 5 963 1 1 1 ILE HB H -0.338 -0.161 0.123 1.00 . A A . 1 ILE HB 1 1 5 964 1 1 1 ILE HD11 H 0.241 -2.956 3.172 1.00 . A A . 1 ILE HD11 1 1 5 965 1 1 1 ILE HD12 H 0.589 -3.423 1.507 1.00 . A A . 1 ILE HD12 1 1 5 966 1 1 1 ILE HD13 H -1.038 -2.917 1.962 1.00 . A A . 1 ILE HD13 1 1 5 967 1 1 1 ILE HG12 H 1.381 -1.104 2.134 1.00 . A A . 1 ILE HG12 1 1 5 968 1 1 1 ILE HG13 H -0.305 -0.648 2.332 1.00 . A A . 1 ILE HG13 1 1 5 969 1 1 1 ILE HG21 H 0.187 -3.129 -0.229 1.00 . A A . 1 ILE HG21 1 1 5 970 1 1 1 ILE HG22 H -0.464 -2.054 -1.463 1.00 . A A . 1 ILE HG22 1 1 5 971 1 1 1 ILE HG23 H -1.395 -2.379 0.000 1.00 . A A . 1 ILE HG23 1 1 5 972 1 1 1 ILE N N 2.597 -1.878 0.135 1.00 . A A . 1 ILE N 1 1 5 973 1 1 1 ILE O O 2.095 1.529 -0.639 1.00 . A A . 1 ILE O 1 1 5 974 1 1 2 ASN C C 4.865 1.901 1.615 1.00 . A A . 2 ASN C 1 1 5 975 1 1 2 ASN CA C 3.358 1.878 1.781 1.00 . A A . 2 ASN CA 1 1 5 976 1 1 2 ASN CB C 3.016 2.054 3.263 1.00 . A A . 2 ASN CB 1 1 5 977 1 1 2 ASN CG C 1.664 1.427 3.575 1.00 . A A . 2 ASN CG 1 1 5 978 1 1 2 ASN H H 2.873 -0.185 1.837 1.00 . A A . 2 ASN H 1 1 5 979 1 1 2 ASN HA H 2.935 2.701 1.230 1.00 . A A . 2 ASN HA 1 1 5 980 1 1 2 ASN HB2 H 3.778 1.579 3.864 1.00 . A A . 2 ASN HB2 1 1 5 981 1 1 2 ASN HB3 H 2.982 3.107 3.500 1.00 . A A . 2 ASN HB3 1 1 5 982 1 1 2 ASN HD21 H 0.815 2.055 1.893 1.00 . A A . 2 ASN HD21 1 1 5 983 1 1 2 ASN HD22 H -0.187 1.146 2.917 1.00 . A A . 2 ASN HD22 1 1 5 984 1 1 2 ASN N N 2.805 0.622 1.287 1.00 . A A . 2 ASN N 1 1 5 985 1 1 2 ASN ND2 N 0.684 1.553 2.727 1.00 . A A . 2 ASN ND2 1 1 5 986 1 1 2 ASN O O 5.454 0.996 1.026 1.00 . A A . 2 ASN O 1 1 5 987 1 1 2 ASN OD1 O 1.502 0.797 4.621 1.00 . A A . 2 ASN OD1 1 1 5 988 1 1 3 LEU C C 7.584 1.875 2.746 1.00 . A A . 3 LEU C 1 1 5 989 1 1 3 LEU CA C 6.919 3.075 2.106 1.00 . A A . 3 LEU CA 1 1 5 990 1 1 3 LEU CB C 7.319 4.325 2.861 1.00 . A A . 3 LEU CB 1 1 5 991 1 1 3 LEU CD1 C 5.575 5.967 3.576 1.00 . A A . 3 LEU CD1 1 1 5 992 1 1 3 LEU CD2 C 7.372 6.669 1.983 1.00 . A A . 3 LEU CD2 1 1 5 993 1 1 3 LEU CG C 6.462 5.514 2.413 1.00 . A A . 3 LEU CG 1 1 5 994 1 1 3 LEU H H 4.955 3.604 2.642 1.00 . A A . 3 LEU H 1 1 5 995 1 1 3 LEU HA H 7.235 3.164 1.095 1.00 . A A . 3 LEU HA 1 1 5 996 1 1 3 LEU HB2 H 7.158 4.141 3.896 1.00 . A A . 3 LEU HB2 1 1 5 997 1 1 3 LEU HB3 H 8.362 4.538 2.683 1.00 . A A . 3 LEU HB3 1 1 5 998 1 1 3 LEU HD11 H 4.917 5.161 3.862 1.00 . A A . 3 LEU HD11 1 1 5 999 1 1 3 LEU HD12 H 4.987 6.819 3.273 1.00 . A A . 3 LEU HD12 1 1 5 1000 1 1 3 LEU HD13 H 6.197 6.237 4.420 1.00 . A A . 3 LEU HD13 1 1 5 1001 1 1 3 LEU HD21 H 8.055 6.909 2.786 1.00 . A A . 3 LEU HD21 1 1 5 1002 1 1 3 LEU HD22 H 6.772 7.535 1.750 1.00 . A A . 3 LEU HD22 1 1 5 1003 1 1 3 LEU HD23 H 7.933 6.377 1.108 1.00 . A A . 3 LEU HD23 1 1 5 1004 1 1 3 LEU HG H 5.838 5.218 1.580 1.00 . A A . 3 LEU HG 1 1 5 1005 1 1 3 LEU N N 5.479 2.931 2.165 1.00 . A A . 3 LEU N 1 1 5 1006 1 1 3 LEU O O 8.697 1.499 2.385 1.00 . A A . 3 LEU O 1 1 5 1007 1 1 4 LYS C C 7.830 -0.968 3.452 1.00 . A A . 4 LYS C 1 1 5 1008 1 1 4 LYS CA C 7.419 0.138 4.420 1.00 . A A . 4 LYS CA 1 1 5 1009 1 1 4 LYS CB C 6.356 -0.385 5.383 1.00 . A A . 4 LYS CB 1 1 5 1010 1 1 4 LYS CD C 4.811 0.726 7.028 1.00 . A A . 4 LYS CD 1 1 5 1011 1 1 4 LYS CE C 4.750 1.093 8.517 1.00 . A A . 4 LYS CE 1 1 5 1012 1 1 4 LYS CG C 6.275 0.530 6.613 1.00 . A A . 4 LYS CG 1 1 5 1013 1 1 4 LYS H H 6.020 1.637 3.957 1.00 . A A . 4 LYS H 1 1 5 1014 1 1 4 LYS HA H 8.280 0.452 4.985 1.00 . A A . 4 LYS HA 1 1 5 1015 1 1 4 LYS HB2 H 5.399 -0.401 4.880 1.00 . A A . 4 LYS HB2 1 1 5 1016 1 1 4 LYS HB3 H 6.617 -1.383 5.694 1.00 . A A . 4 LYS HB3 1 1 5 1017 1 1 4 LYS HD2 H 4.372 1.522 6.441 1.00 . A A . 4 LYS HD2 1 1 5 1018 1 1 4 LYS HD3 H 4.260 -0.187 6.863 1.00 . A A . 4 LYS HD3 1 1 5 1019 1 1 4 LYS HE2 H 5.363 1.966 8.694 1.00 . A A . 4 LYS HE2 1 1 5 1020 1 1 4 LYS HE3 H 3.728 1.306 8.798 1.00 . A A . 4 LYS HE3 1 1 5 1021 1 1 4 LYS HG2 H 6.822 0.078 7.428 1.00 . A A . 4 LYS HG2 1 1 5 1022 1 1 4 LYS HG3 H 6.712 1.490 6.379 1.00 . A A . 4 LYS HG3 1 1 5 1023 1 1 4 LYS HZ1 H 6.214 0.187 9.689 1.00 . A A . 4 LYS HZ1 1 1 5 1024 1 1 4 LYS HZ2 H 5.305 -0.904 8.751 1.00 . A A . 4 LYS HZ2 1 1 5 1025 1 1 4 LYS HZ3 H 4.631 -0.208 10.137 1.00 . A A . 4 LYS HZ3 1 1 5 1026 1 1 4 LYS N N 6.897 1.287 3.711 1.00 . A A . 4 LYS N 1 1 5 1027 1 1 4 LYS NZ N 5.263 -0.042 9.333 1.00 . A A . 4 LYS NZ 1 1 5 1028 1 1 4 LYS O O 8.924 -1.523 3.557 1.00 . A A . 4 LYS O 1 1 5 1029 1 1 5 ALA C C 8.432 -1.933 0.691 1.00 . A A . 5 ALA C 1 1 5 1030 1 1 5 ALA CA C 7.231 -2.328 1.536 1.00 . A A . 5 ALA CA 1 1 5 1031 1 1 5 ALA CB C 6.021 -2.548 0.628 1.00 . A A . 5 ALA CB 1 1 5 1032 1 1 5 ALA H H 6.089 -0.807 2.476 1.00 . A A . 5 ALA H 1 1 5 1033 1 1 5 ALA HA H 7.447 -3.247 2.057 1.00 . A A . 5 ALA HA 1 1 5 1034 1 1 5 ALA HB1 H 5.385 -3.306 1.059 1.00 . A A . 5 ALA HB1 1 1 5 1035 1 1 5 ALA HB2 H 6.358 -2.875 -0.347 1.00 . A A . 5 ALA HB2 1 1 5 1036 1 1 5 ALA HB3 H 5.470 -1.625 0.529 1.00 . A A . 5 ALA HB3 1 1 5 1037 1 1 5 ALA N N 6.946 -1.283 2.513 1.00 . A A . 5 ALA N 1 1 5 1038 1 1 5 ALA O O 9.327 -2.739 0.442 1.00 . A A . 5 ALA O 1 1 5 1039 1 1 6 LEU C C 10.793 -0.054 0.261 1.00 . A A . 6 LEU C 1 1 5 1040 1 1 6 LEU CA C 9.518 -0.153 -0.556 1.00 . A A . 6 LEU CA 1 1 5 1041 1 1 6 LEU CB C 9.133 1.233 -1.050 1.00 . A A . 6 LEU CB 1 1 5 1042 1 1 6 LEU CD1 C 7.226 2.536 -1.987 1.00 . A A . 6 LEU CD1 1 1 5 1043 1 1 6 LEU CD2 C 8.096 0.544 -3.206 1.00 . A A . 6 LEU CD2 1 1 5 1044 1 1 6 LEU CG C 7.822 1.142 -1.829 1.00 . A A . 6 LEU CG 1 1 5 1045 1 1 6 LEU H H 7.697 -0.092 0.495 1.00 . A A . 6 LEU H 1 1 5 1046 1 1 6 LEU HA H 9.679 -0.797 -1.407 1.00 . A A . 6 LEU HA 1 1 5 1047 1 1 6 LEU HB2 H 9.002 1.893 -0.201 1.00 . A A . 6 LEU HB2 1 1 5 1048 1 1 6 LEU HB3 H 9.912 1.614 -1.691 1.00 . A A . 6 LEU HB3 1 1 5 1049 1 1 6 LEU HD11 H 6.455 2.511 -2.740 1.00 . A A . 6 LEU HD11 1 1 5 1050 1 1 6 LEU HD12 H 8.003 3.225 -2.286 1.00 . A A . 6 LEU HD12 1 1 5 1051 1 1 6 LEU HD13 H 6.801 2.854 -1.045 1.00 . A A . 6 LEU HD13 1 1 5 1052 1 1 6 LEU HD21 H 9.066 0.870 -3.555 1.00 . A A . 6 LEU HD21 1 1 5 1053 1 1 6 LEU HD22 H 7.336 0.870 -3.897 1.00 . A A . 6 LEU HD22 1 1 5 1054 1 1 6 LEU HD23 H 8.084 -0.535 -3.139 1.00 . A A . 6 LEU HD23 1 1 5 1055 1 1 6 LEU HG H 7.126 0.513 -1.295 1.00 . A A . 6 LEU HG 1 1 5 1056 1 1 6 LEU N N 8.437 -0.681 0.260 1.00 . A A . 6 LEU N 1 1 5 1057 1 1 6 LEU O O 11.880 -0.400 -0.204 1.00 . A A . 6 LEU O 1 1 5 1058 1 1 7 ALA C C 12.508 -0.726 2.549 1.00 . A A . 7 ALA C 1 1 5 1059 1 1 7 ALA CA C 11.783 0.594 2.378 1.00 . A A . 7 ALA CA 1 1 5 1060 1 1 7 ALA CB C 11.317 1.099 3.743 1.00 . A A . 7 ALA CB 1 1 5 1061 1 1 7 ALA H H 9.745 0.699 1.784 1.00 . A A . 7 ALA H 1 1 5 1062 1 1 7 ALA HA H 12.463 1.310 1.954 1.00 . A A . 7 ALA HA 1 1 5 1063 1 1 7 ALA HB1 H 10.911 2.092 3.638 1.00 . A A . 7 ALA HB1 1 1 5 1064 1 1 7 ALA HB2 H 12.158 1.123 4.422 1.00 . A A . 7 ALA HB2 1 1 5 1065 1 1 7 ALA HB3 H 10.559 0.436 4.133 1.00 . A A . 7 ALA HB3 1 1 5 1066 1 1 7 ALA N N 10.644 0.431 1.483 1.00 . A A . 7 ALA N 1 1 5 1067 1 1 7 ALA O O 13.725 -0.757 2.709 1.00 . A A . 7 ALA O 1 1 5 1068 1 1 8 ALA C C 13.401 -3.316 1.531 1.00 . A A . 8 ALA C 1 1 5 1069 1 1 8 ALA CA C 12.365 -3.134 2.630 1.00 . A A . 8 ALA CA 1 1 5 1070 1 1 8 ALA CB C 11.298 -4.231 2.518 1.00 . A A . 8 ALA CB 1 1 5 1071 1 1 8 ALA H H 10.795 -1.731 2.354 1.00 . A A . 8 ALA H 1 1 5 1072 1 1 8 ALA HA H 12.849 -3.207 3.588 1.00 . A A . 8 ALA HA 1 1 5 1073 1 1 8 ALA HB1 H 11.051 -4.386 1.477 1.00 . A A . 8 ALA HB1 1 1 5 1074 1 1 8 ALA HB2 H 10.413 -3.933 3.059 1.00 . A A . 8 ALA HB2 1 1 5 1075 1 1 8 ALA HB3 H 11.680 -5.151 2.936 1.00 . A A . 8 ALA HB3 1 1 5 1076 1 1 8 ALA N N 11.761 -1.816 2.497 1.00 . A A . 8 ALA N 1 1 5 1077 1 1 8 ALA O O 14.533 -3.735 1.777 1.00 . A A . 8 ALA O 1 1 5 1078 1 1 9 LEU C C 14.915 -1.957 -0.787 1.00 . A A . 9 LEU C 1 1 5 1079 1 1 9 LEU CA C 13.889 -3.082 -0.832 1.00 . A A . 9 LEU CA 1 1 5 1080 1 1 9 LEU CB C 13.081 -2.984 -2.133 1.00 . A A . 9 LEU CB 1 1 5 1081 1 1 9 LEU CD1 C 10.894 -3.480 -3.246 1.00 . A A . 9 LEU CD1 1 1 5 1082 1 1 9 LEU CD2 C 11.773 -5.039 -1.503 1.00 . A A . 9 LEU CD2 1 1 5 1083 1 1 9 LEU CG C 11.672 -3.570 -1.932 1.00 . A A . 9 LEU CG 1 1 5 1084 1 1 9 LEU H H 12.096 -2.643 0.194 1.00 . A A . 9 LEU H 1 1 5 1085 1 1 9 LEU HA H 14.401 -4.032 -0.803 1.00 . A A . 9 LEU HA 1 1 5 1086 1 1 9 LEU HB2 H 12.998 -1.943 -2.422 1.00 . A A . 9 LEU HB2 1 1 5 1087 1 1 9 LEU HB3 H 13.590 -3.531 -2.910 1.00 . A A . 9 LEU HB3 1 1 5 1088 1 1 9 LEU HD11 H 11.279 -4.206 -3.945 1.00 . A A . 9 LEU HD11 1 1 5 1089 1 1 9 LEU HD12 H 11.003 -2.488 -3.660 1.00 . A A . 9 LEU HD12 1 1 5 1090 1 1 9 LEU HD13 H 9.849 -3.679 -3.057 1.00 . A A . 9 LEU HD13 1 1 5 1091 1 1 9 LEU HD21 H 12.192 -5.628 -2.308 1.00 . A A . 9 LEU HD21 1 1 5 1092 1 1 9 LEU HD22 H 10.789 -5.410 -1.264 1.00 . A A . 9 LEU HD22 1 1 5 1093 1 1 9 LEU HD23 H 12.406 -5.116 -0.633 1.00 . A A . 9 LEU HD23 1 1 5 1094 1 1 9 LEU HG H 11.150 -3.005 -1.171 1.00 . A A . 9 LEU HG 1 1 5 1095 1 1 9 LEU N N 13.001 -2.984 0.318 1.00 . A A . 9 LEU N 1 1 5 1096 1 1 9 LEU O O 16.113 -2.166 -0.980 1.00 . A A . 9 LEU O 1 1 5 1097 1 1 10 ALA C C 16.304 0.338 0.617 1.00 . A A . 10 ALA C 1 1 5 1098 1 1 10 ALA CA C 15.242 0.441 -0.477 1.00 . A A . 10 ALA CA 1 1 5 1099 1 1 10 ALA CB C 14.360 1.672 -0.214 1.00 . A A . 10 ALA CB 1 1 5 1100 1 1 10 ALA H H 13.440 -0.675 -0.403 1.00 . A A . 10 ALA H 1 1 5 1101 1 1 10 ALA HA H 15.734 0.566 -1.431 1.00 . A A . 10 ALA HA 1 1 5 1102 1 1 10 ALA HB1 H 13.378 1.510 -0.637 1.00 . A A . 10 ALA HB1 1 1 5 1103 1 1 10 ALA HB2 H 14.807 2.544 -0.669 1.00 . A A . 10 ALA HB2 1 1 5 1104 1 1 10 ALA HB3 H 14.269 1.831 0.850 1.00 . A A . 10 ALA HB3 1 1 5 1105 1 1 10 ALA N N 14.411 -0.758 -0.537 1.00 . A A . 10 ALA N 1 1 5 1106 1 1 10 ALA O O 17.410 0.854 0.460 1.00 . A A . 10 ALA O 1 1 5 1107 1 1 11 LYS C C 18.259 -0.905 2.368 1.00 . A A . 11 LYS C 1 1 5 1108 1 1 11 LYS CA C 16.901 -0.422 2.845 1.00 . A A . 11 LYS CA 1 1 5 1109 1 1 11 LYS CB C 16.363 -1.394 3.899 1.00 . A A . 11 LYS CB 1 1 5 1110 1 1 11 LYS CD C 15.725 -1.608 6.327 1.00 . A A . 11 LYS CD 1 1 5 1111 1 1 11 LYS CE C 16.820 -1.455 7.389 1.00 . A A . 11 LYS CE 1 1 5 1112 1 1 11 LYS CG C 15.993 -0.625 5.175 1.00 . A A . 11 LYS CG 1 1 5 1113 1 1 11 LYS H H 15.059 -0.684 1.815 1.00 . A A . 11 LYS H 1 1 5 1114 1 1 11 LYS HA H 17.015 0.538 3.295 1.00 . A A . 11 LYS HA 1 1 5 1115 1 1 11 LYS HB2 H 15.490 -1.884 3.508 1.00 . A A . 11 LYS HB2 1 1 5 1116 1 1 11 LYS HB3 H 17.116 -2.134 4.131 1.00 . A A . 11 LYS HB3 1 1 5 1117 1 1 11 LYS HD2 H 14.764 -1.390 6.771 1.00 . A A . 11 LYS HD2 1 1 5 1118 1 1 11 LYS HD3 H 15.726 -2.623 5.953 1.00 . A A . 11 LYS HD3 1 1 5 1119 1 1 11 LYS HE2 H 17.168 -0.430 7.407 1.00 . A A . 11 LYS HE2 1 1 5 1120 1 1 11 LYS HE3 H 16.419 -1.711 8.359 1.00 . A A . 11 LYS HE3 1 1 5 1121 1 1 11 LYS HG2 H 16.806 0.031 5.445 1.00 . A A . 11 LYS HG2 1 1 5 1122 1 1 11 LYS HG3 H 15.103 -0.036 4.995 1.00 . A A . 11 LYS HG3 1 1 5 1123 1 1 11 LYS HZ1 H 18.731 -2.190 7.740 1.00 . A A . 11 LYS HZ1 1 1 5 1124 1 1 11 LYS HZ2 H 18.297 -2.165 6.101 1.00 . A A . 11 LYS HZ2 1 1 5 1125 1 1 11 LYS HZ3 H 17.651 -3.351 7.139 1.00 . A A . 11 LYS HZ3 1 1 5 1126 1 1 11 LYS N N 15.964 -0.305 1.730 1.00 . A A . 11 LYS N 1 1 5 1127 1 1 11 LYS NZ N 17.959 -2.357 7.066 1.00 . A A . 11 LYS NZ 1 1 5 1128 1 1 11 LYS O O 19.295 -0.433 2.842 1.00 . A A . 11 LYS O 1 1 5 1129 1 1 12 LYS C C 20.208 -1.335 0.064 1.00 . A A . 12 LYS C 1 1 5 1130 1 1 12 LYS CA C 19.496 -2.375 0.917 1.00 . A A . 12 LYS CA 1 1 5 1131 1 1 12 LYS CB C 19.220 -3.628 0.096 1.00 . A A . 12 LYS CB 1 1 5 1132 1 1 12 LYS CD C 17.304 -4.708 1.273 1.00 . A A . 12 LYS CD 1 1 5 1133 1 1 12 LYS CE C 16.647 -5.820 0.456 1.00 . A A . 12 LYS CE 1 1 5 1134 1 1 12 LYS CG C 18.813 -4.755 1.042 1.00 . A A . 12 LYS CG 1 1 5 1135 1 1 12 LYS H H 17.402 -2.176 1.100 1.00 . A A . 12 LYS H 1 1 5 1136 1 1 12 LYS HA H 20.129 -2.640 1.746 1.00 . A A . 12 LYS HA 1 1 5 1137 1 1 12 LYS HB2 H 18.422 -3.435 -0.607 1.00 . A A . 12 LYS HB2 1 1 5 1138 1 1 12 LYS HB3 H 20.112 -3.915 -0.439 1.00 . A A . 12 LYS HB3 1 1 5 1139 1 1 12 LYS HD2 H 17.094 -4.849 2.324 1.00 . A A . 12 LYS HD2 1 1 5 1140 1 1 12 LYS HD3 H 16.920 -3.754 0.954 1.00 . A A . 12 LYS HD3 1 1 5 1141 1 1 12 LYS HE2 H 16.793 -5.622 -0.597 1.00 . A A . 12 LYS HE2 1 1 5 1142 1 1 12 LYS HE3 H 17.105 -6.763 0.708 1.00 . A A . 12 LYS HE3 1 1 5 1143 1 1 12 LYS HG2 H 19.085 -5.707 0.607 1.00 . A A . 12 LYS HG2 1 1 5 1144 1 1 12 LYS HG3 H 19.321 -4.635 1.985 1.00 . A A . 12 LYS HG3 1 1 5 1145 1 1 12 LYS HZ1 H 14.993 -6.674 1.398 1.00 . A A . 12 LYS HZ1 1 1 5 1146 1 1 12 LYS HZ2 H 14.658 -6.007 -0.132 1.00 . A A . 12 LYS HZ2 1 1 5 1147 1 1 12 LYS HZ3 H 14.888 -4.988 1.214 1.00 . A A . 12 LYS HZ3 1 1 5 1148 1 1 12 LYS N N 18.252 -1.840 1.439 1.00 . A A . 12 LYS N 1 1 5 1149 1 1 12 LYS NZ N 15.189 -5.875 0.757 1.00 . A A . 12 LYS NZ 1 1 5 1150 1 1 12 LYS O O 21.439 -1.248 0.075 1.00 . A A . 12 LYS O 1 1 5 1151 1 1 13 ILE C C 20.446 1.665 -0.657 1.00 . A A . 13 ILE C 1 1 5 1152 1 1 13 ILE CA C 19.992 0.496 -1.512 1.00 . A A . 13 ILE CA 1 1 5 1153 1 1 13 ILE CB C 18.948 0.965 -2.529 1.00 . A A . 13 ILE CB 1 1 5 1154 1 1 13 ILE CD1 C 19.141 -1.163 -3.843 1.00 . A A . 13 ILE CD1 1 1 5 1155 1 1 13 ILE CG1 C 18.184 -0.245 -3.080 1.00 . A A . 13 ILE CG1 1 1 5 1156 1 1 13 ILE CG2 C 19.637 1.701 -3.680 1.00 . A A . 13 ILE CG2 1 1 5 1157 1 1 13 ILE H H 18.462 -0.651 -0.618 1.00 . A A . 13 ILE H 1 1 5 1158 1 1 13 ILE HA H 20.831 0.098 -2.043 1.00 . A A . 13 ILE HA 1 1 5 1159 1 1 13 ILE HB H 18.263 1.632 -2.040 1.00 . A A . 13 ILE HB 1 1 5 1160 1 1 13 ILE HD11 H 18.570 -1.852 -4.446 1.00 . A A . 13 ILE HD11 1 1 5 1161 1 1 13 ILE HD12 H 19.747 -1.717 -3.142 1.00 . A A . 13 ILE HD12 1 1 5 1162 1 1 13 ILE HD13 H 19.780 -0.574 -4.482 1.00 . A A . 13 ILE HD13 1 1 5 1163 1 1 13 ILE HG12 H 17.736 -0.791 -2.264 1.00 . A A . 13 ILE HG12 1 1 5 1164 1 1 13 ILE HG13 H 17.410 0.097 -3.751 1.00 . A A . 13 ILE HG13 1 1 5 1165 1 1 13 ILE HG21 H 20.336 1.036 -4.165 1.00 . A A . 13 ILE HG21 1 1 5 1166 1 1 13 ILE HG22 H 20.167 2.559 -3.295 1.00 . A A . 13 ILE HG22 1 1 5 1167 1 1 13 ILE HG23 H 18.897 2.028 -4.394 1.00 . A A . 13 ILE HG23 1 1 5 1168 1 1 13 ILE N N 19.432 -0.544 -0.663 1.00 . A A . 13 ILE N 1 1 5 1169 1 1 13 ILE O O 21.501 2.256 -0.898 1.00 . A A . 13 ILE O 1 1 5 1170 1 1 14 LEU C C 21.052 2.656 2.227 1.00 . A A . 14 LEU C 1 1 5 1171 1 1 14 LEU CA C 19.968 3.086 1.242 1.00 . A A . 14 LEU CA 1 1 5 1172 1 1 14 LEU CB C 18.708 3.510 2.003 1.00 . A A . 14 LEU CB 1 1 5 1173 1 1 14 LEU CD1 C 17.475 4.044 -0.124 1.00 . A A . 14 LEU CD1 1 1 5 1174 1 1 14 LEU CD2 C 16.765 5.092 2.033 1.00 . A A . 14 LEU CD2 1 1 5 1175 1 1 14 LEU CG C 17.965 4.599 1.218 1.00 . A A . 14 LEU CG 1 1 5 1176 1 1 14 LEU H H 18.814 1.484 0.485 1.00 . A A . 14 LEU H 1 1 5 1177 1 1 14 LEU HA H 20.327 3.925 0.658 1.00 . A A . 14 LEU HA 1 1 5 1178 1 1 14 LEU HB2 H 18.063 2.651 2.132 1.00 . A A . 14 LEU HB2 1 1 5 1179 1 1 14 LEU HB3 H 18.991 3.896 2.971 1.00 . A A . 14 LEU HB3 1 1 5 1180 1 1 14 LEU HD11 H 17.005 3.084 0.028 1.00 . A A . 14 LEU HD11 1 1 5 1181 1 1 14 LEU HD12 H 18.319 3.931 -0.791 1.00 . A A . 14 LEU HD12 1 1 5 1182 1 1 14 LEU HD13 H 16.759 4.729 -0.558 1.00 . A A . 14 LEU HD13 1 1 5 1183 1 1 14 LEU HD21 H 15.992 5.434 1.363 1.00 . A A . 14 LEU HD21 1 1 5 1184 1 1 14 LEU HD22 H 17.076 5.909 2.668 1.00 . A A . 14 LEU HD22 1 1 5 1185 1 1 14 LEU HD23 H 16.384 4.288 2.644 1.00 . A A . 14 LEU HD23 1 1 5 1186 1 1 14 LEU HG H 18.636 5.427 1.034 1.00 . A A . 14 LEU HG 1 1 5 1187 1 1 14 LEU N N 19.643 1.992 0.345 1.00 . A A . 14 LEU N 1 1 5 1188 1 1 14 LEU O O 21.995 3.402 2.494 1.00 . A A . 14 LEU O 1 1 5 1189 1 1 15 NH2 HN1 H 20.221 0.887 2.584 1.00 . A A . 15 NH2 HN1 1 1 5 1190 1 1 15 NH2 N N 20.974 1.485 2.790 1.00 . A A . 15 NH2 N 1 1 6 1191 1 1 1 ILE C C 2.365 -0.639 -0.970 1.00 . A A . 1 ILE C 1 1 6 1192 1 1 1 ILE CA C 2.407 -2.008 -1.652 1.00 . A A . 1 ILE CA 1 1 6 1193 1 1 1 ILE CB C 1.452 -2.977 -0.933 1.00 . A A . 1 ILE CB 1 1 6 1194 1 1 1 ILE CD1 C 1.347 -4.581 0.989 1.00 . A A . 1 ILE CD1 1 1 6 1195 1 1 1 ILE CG1 C 1.971 -3.281 0.472 1.00 . A A . 1 ILE CG1 1 1 6 1196 1 1 1 ILE CG2 C 1.336 -4.276 -1.729 1.00 . A A . 1 ILE CG2 1 1 6 1197 1 1 1 ILE H1 H 4.405 -1.939 -2.224 1.00 . A A . 1 ILE H1 1 1 6 1198 1 1 1 ILE H2 H 3.802 -3.513 -2.005 1.00 . A A . 1 ILE H2 1 1 6 1199 1 1 1 ILE H3 H 4.158 -2.549 -0.663 1.00 . A A . 1 ILE H3 1 1 6 1200 1 1 1 ILE HA H 2.090 -1.899 -2.681 1.00 . A A . 1 ILE HA 1 1 6 1201 1 1 1 ILE HB H 0.481 -2.525 -0.855 1.00 . A A . 1 ILE HB 1 1 6 1202 1 1 1 ILE HD11 H 0.333 -4.663 0.629 1.00 . A A . 1 ILE HD11 1 1 6 1203 1 1 1 ILE HD12 H 1.346 -4.577 2.069 1.00 . A A . 1 ILE HD12 1 1 6 1204 1 1 1 ILE HD13 H 1.924 -5.421 0.633 1.00 . A A . 1 ILE HD13 1 1 6 1205 1 1 1 ILE HG12 H 3.035 -3.384 0.436 1.00 . A A . 1 ILE HG12 1 1 6 1206 1 1 1 ILE HG13 H 1.706 -2.472 1.134 1.00 . A A . 1 ILE HG13 1 1 6 1207 1 1 1 ILE HG21 H 0.346 -4.684 -1.605 1.00 . A A . 1 ILE HG21 1 1 6 1208 1 1 1 ILE HG22 H 2.066 -4.985 -1.367 1.00 . A A . 1 ILE HG22 1 1 6 1209 1 1 1 ILE HG23 H 1.517 -4.074 -2.773 1.00 . A A . 1 ILE HG23 1 1 6 1210 1 1 1 ILE N N 3.798 -2.543 -1.631 1.00 . A A . 1 ILE N 1 1 6 1211 1 1 1 ILE O O 1.843 0.324 -1.533 1.00 . A A . 1 ILE O 1 1 6 1212 1 1 2 ASN C C 4.291 1.287 1.067 1.00 . A A . 2 ASN C 1 1 6 1213 1 1 2 ASN CA C 2.894 0.690 1.003 1.00 . A A . 2 ASN CA 1 1 6 1214 1 1 2 ASN CB C 2.377 0.450 2.424 1.00 . A A . 2 ASN CB 1 1 6 1215 1 1 2 ASN CG C 1.025 -0.259 2.392 1.00 . A A . 2 ASN CG 1 1 6 1216 1 1 2 ASN H H 3.284 -1.364 0.662 1.00 . A A . 2 ASN H 1 1 6 1217 1 1 2 ASN HA H 2.243 1.397 0.512 1.00 . A A . 2 ASN HA 1 1 6 1218 1 1 2 ASN HB2 H 3.086 -0.163 2.963 1.00 . A A . 2 ASN HB2 1 1 6 1219 1 1 2 ASN HB3 H 2.273 1.394 2.931 1.00 . A A . 2 ASN HB3 1 1 6 1220 1 1 2 ASN HD21 H 0.542 0.384 0.573 1.00 . A A . 2 ASN HD21 1 1 6 1221 1 1 2 ASN HD22 H -0.615 -0.608 1.324 1.00 . A A . 2 ASN HD22 1 1 6 1222 1 1 2 ASN N N 2.897 -0.561 0.252 1.00 . A A . 2 ASN N 1 1 6 1223 1 1 2 ASN ND2 N 0.254 -0.153 1.343 1.00 . A A . 2 ASN ND2 1 1 6 1224 1 1 2 ASN O O 5.218 0.810 0.407 1.00 . A A . 2 ASN O 1 1 6 1225 1 1 2 ASN OD1 O 0.658 -0.929 3.356 1.00 . A A . 2 ASN OD1 1 1 6 1226 1 1 3 LEU C C 6.699 2.038 2.687 1.00 . A A . 3 LEU C 1 1 6 1227 1 1 3 LEU CA C 5.719 2.987 2.031 1.00 . A A . 3 LEU CA 1 1 6 1228 1 1 3 LEU CB C 5.566 4.234 2.887 1.00 . A A . 3 LEU CB 1 1 6 1229 1 1 3 LEU CD1 C 3.271 4.946 2.175 1.00 . A A . 3 LEU CD1 1 1 6 1230 1 1 3 LEU CD2 C 4.963 6.661 2.808 1.00 . A A . 3 LEU CD2 1 1 6 1231 1 1 3 LEU CG C 4.758 5.300 2.134 1.00 . A A . 3 LEU CG 1 1 6 1232 1 1 3 LEU H H 3.667 2.657 2.379 1.00 . A A . 3 LEU H 1 1 6 1233 1 1 3 LEU HA H 6.087 3.273 1.075 1.00 . A A . 3 LEU HA 1 1 6 1234 1 1 3 LEU HB2 H 5.054 3.967 3.783 1.00 . A A . 3 LEU HB2 1 1 6 1235 1 1 3 LEU HB3 H 6.541 4.626 3.131 1.00 . A A . 3 LEU HB3 1 1 6 1236 1 1 3 LEU HD11 H 3.026 4.321 1.330 1.00 . A A . 3 LEU HD11 1 1 6 1237 1 1 3 LEU HD12 H 2.684 5.851 2.137 1.00 . A A . 3 LEU HD12 1 1 6 1238 1 1 3 LEU HD13 H 3.052 4.416 3.092 1.00 . A A . 3 LEU HD13 1 1 6 1239 1 1 3 LEU HD21 H 4.139 6.857 3.482 1.00 . A A . 3 LEU HD21 1 1 6 1240 1 1 3 LEU HD22 H 5.004 7.434 2.056 1.00 . A A . 3 LEU HD22 1 1 6 1241 1 1 3 LEU HD23 H 5.888 6.654 3.365 1.00 . A A . 3 LEU HD23 1 1 6 1242 1 1 3 LEU HG H 5.092 5.350 1.106 1.00 . A A . 3 LEU HG 1 1 6 1243 1 1 3 LEU N N 4.436 2.330 1.876 1.00 . A A . 3 LEU N 1 1 6 1244 1 1 3 LEU O O 7.896 2.051 2.395 1.00 . A A . 3 LEU O 1 1 6 1245 1 1 4 LYS C C 7.766 -0.618 3.267 1.00 . A A . 4 LYS C 1 1 6 1246 1 1 4 LYS CA C 6.993 0.231 4.263 1.00 . A A . 4 LYS CA 1 1 6 1247 1 1 4 LYS CB C 6.083 -0.652 5.103 1.00 . A A . 4 LYS CB 1 1 6 1248 1 1 4 LYS CD C 6.369 1.146 6.847 1.00 . A A . 4 LYS CD 1 1 6 1249 1 1 4 LYS CE C 5.684 1.862 8.016 1.00 . A A . 4 LYS CE 1 1 6 1250 1 1 4 LYS CG C 5.375 0.186 6.177 1.00 . A A . 4 LYS CG 1 1 6 1251 1 1 4 LYS H H 5.219 1.221 3.753 1.00 . A A . 4 LYS H 1 1 6 1252 1 1 4 LYS HA H 7.686 0.744 4.905 1.00 . A A . 4 LYS HA 1 1 6 1253 1 1 4 LYS HB2 H 5.340 -1.096 4.456 1.00 . A A . 4 LYS HB2 1 1 6 1254 1 1 4 LYS HB3 H 6.663 -1.426 5.569 1.00 . A A . 4 LYS HB3 1 1 6 1255 1 1 4 LYS HD2 H 7.220 0.588 7.212 1.00 . A A . 4 LYS HD2 1 1 6 1256 1 1 4 LYS HD3 H 6.704 1.880 6.129 1.00 . A A . 4 LYS HD3 1 1 6 1257 1 1 4 LYS HE2 H 4.805 2.382 7.658 1.00 . A A . 4 LYS HE2 1 1 6 1258 1 1 4 LYS HE3 H 5.393 1.140 8.763 1.00 . A A . 4 LYS HE3 1 1 6 1259 1 1 4 LYS HG2 H 4.580 0.754 5.716 1.00 . A A . 4 LYS HG2 1 1 6 1260 1 1 4 LYS HG3 H 4.957 -0.473 6.922 1.00 . A A . 4 LYS HG3 1 1 6 1261 1 1 4 LYS HZ1 H 6.145 3.377 9.353 1.00 . A A . 4 LYS HZ1 1 1 6 1262 1 1 4 LYS HZ2 H 6.971 3.492 7.875 1.00 . A A . 4 LYS HZ2 1 1 6 1263 1 1 4 LYS HZ3 H 7.441 2.335 9.031 1.00 . A A . 4 LYS HZ3 1 1 6 1264 1 1 4 LYS N N 6.177 1.196 3.569 1.00 . A A . 4 LYS N 1 1 6 1265 1 1 4 LYS NZ N 6.632 2.839 8.614 1.00 . A A . 4 LYS NZ 1 1 6 1266 1 1 4 LYS O O 8.965 -0.854 3.429 1.00 . A A . 4 LYS O 1 1 6 1267 1 1 5 ALA C C 8.865 -1.130 0.582 1.00 . A A . 5 ALA C 1 1 6 1268 1 1 5 ALA CA C 7.701 -1.887 1.205 1.00 . A A . 5 ALA CA 1 1 6 1269 1 1 5 ALA CB C 6.688 -2.256 0.119 1.00 . A A . 5 ALA CB 1 1 6 1270 1 1 5 ALA H H 6.122 -0.843 2.161 1.00 . A A . 5 ALA H 1 1 6 1271 1 1 5 ALA HA H 8.073 -2.794 1.661 1.00 . A A . 5 ALA HA 1 1 6 1272 1 1 5 ALA HB1 H 6.366 -3.276 0.261 1.00 . A A . 5 ALA HB1 1 1 6 1273 1 1 5 ALA HB2 H 7.149 -2.157 -0.855 1.00 . A A . 5 ALA HB2 1 1 6 1274 1 1 5 ALA HB3 H 5.835 -1.597 0.180 1.00 . A A . 5 ALA HB3 1 1 6 1275 1 1 5 ALA N N 7.072 -1.067 2.232 1.00 . A A . 5 ALA N 1 1 6 1276 1 1 5 ALA O O 9.942 -1.685 0.387 1.00 . A A . 5 ALA O 1 1 6 1277 1 1 6 LEU C C 10.883 1.018 0.627 1.00 . A A . 6 LEU C 1 1 6 1278 1 1 6 LEU CA C 9.682 0.973 -0.303 1.00 . A A . 6 LEU CA 1 1 6 1279 1 1 6 LEU CB C 9.141 2.386 -0.501 1.00 . A A . 6 LEU CB 1 1 6 1280 1 1 6 LEU CD1 C 7.368 3.764 -1.593 1.00 . A A . 6 LEU CD1 1 1 6 1281 1 1 6 LEU CD2 C 7.918 1.505 -2.502 1.00 . A A . 6 LEU CD2 1 1 6 1282 1 1 6 LEU CG C 7.794 2.339 -1.225 1.00 . A A . 6 LEU CG 1 1 6 1283 1 1 6 LEU H H 7.772 0.546 0.471 1.00 . A A . 6 LEU H 1 1 6 1284 1 1 6 LEU HA H 9.977 0.564 -1.257 1.00 . A A . 6 LEU HA 1 1 6 1285 1 1 6 LEU HB2 H 9.008 2.853 0.466 1.00 . A A . 6 LEU HB2 1 1 6 1286 1 1 6 LEU HB3 H 9.840 2.960 -1.086 1.00 . A A . 6 LEU HB3 1 1 6 1287 1 1 6 LEU HD11 H 6.749 3.739 -2.477 1.00 . A A . 6 LEU HD11 1 1 6 1288 1 1 6 LEU HD12 H 8.245 4.366 -1.789 1.00 . A A . 6 LEU HD12 1 1 6 1289 1 1 6 LEU HD13 H 6.810 4.198 -0.778 1.00 . A A . 6 LEU HD13 1 1 6 1290 1 1 6 LEU HD21 H 7.866 0.454 -2.253 1.00 . A A . 6 LEU HD21 1 1 6 1291 1 1 6 LEU HD22 H 8.864 1.715 -2.982 1.00 . A A . 6 LEU HD22 1 1 6 1292 1 1 6 LEU HD23 H 7.111 1.756 -3.171 1.00 . A A . 6 LEU HD23 1 1 6 1293 1 1 6 LEU HG H 7.053 1.898 -0.573 1.00 . A A . 6 LEU HG 1 1 6 1294 1 1 6 LEU N N 8.643 0.147 0.283 1.00 . A A . 6 LEU N 1 1 6 1295 1 1 6 LEU O O 12.029 0.866 0.202 1.00 . A A . 6 LEU O 1 1 6 1296 1 1 7 ALA C C 12.461 -0.040 2.851 1.00 . A A . 7 ALA C 1 1 6 1297 1 1 7 ALA CA C 11.667 1.254 2.898 1.00 . A A . 7 ALA CA 1 1 6 1298 1 1 7 ALA CB C 11.087 1.453 4.298 1.00 . A A . 7 ALA CB 1 1 6 1299 1 1 7 ALA H H 9.667 1.312 2.186 1.00 . A A . 7 ALA H 1 1 6 1300 1 1 7 ALA HA H 12.321 2.075 2.668 1.00 . A A . 7 ALA HA 1 1 6 1301 1 1 7 ALA HB1 H 10.791 2.481 4.415 1.00 . A A . 7 ALA HB1 1 1 6 1302 1 1 7 ALA HB2 H 11.835 1.205 5.036 1.00 . A A . 7 ALA HB2 1 1 6 1303 1 1 7 ALA HB3 H 10.226 0.812 4.429 1.00 . A A . 7 ALA HB3 1 1 6 1304 1 1 7 ALA N N 10.605 1.207 1.907 1.00 . A A . 7 ALA N 1 1 6 1305 1 1 7 ALA O O 13.680 -0.048 3.046 1.00 . A A . 7 ALA O 1 1 6 1306 1 1 8 ALA C C 13.441 -2.430 1.382 1.00 . A A . 8 ALA C 1 1 6 1307 1 1 8 ALA CA C 12.407 -2.430 2.497 1.00 . A A . 8 ALA CA 1 1 6 1308 1 1 8 ALA CB C 11.368 -3.520 2.243 1.00 . A A . 8 ALA CB 1 1 6 1309 1 1 8 ALA H H 10.796 -1.054 2.430 1.00 . A A . 8 ALA H 1 1 6 1310 1 1 8 ALA HA H 12.903 -2.627 3.426 1.00 . A A . 8 ALA HA 1 1 6 1311 1 1 8 ALA HB1 H 11.665 -4.426 2.750 1.00 . A A . 8 ALA HB1 1 1 6 1312 1 1 8 ALA HB2 H 11.298 -3.707 1.184 1.00 . A A . 8 ALA HB2 1 1 6 1313 1 1 8 ALA HB3 H 10.404 -3.197 2.614 1.00 . A A . 8 ALA HB3 1 1 6 1314 1 1 8 ALA N N 11.763 -1.131 2.581 1.00 . A A . 8 ALA N 1 1 6 1315 1 1 8 ALA O O 14.561 -2.908 1.558 1.00 . A A . 8 ALA O 1 1 6 1316 1 1 9 LEU C C 15.130 -0.899 -0.562 1.00 . A A . 9 LEU C 1 1 6 1317 1 1 9 LEU CA C 13.958 -1.804 -0.900 1.00 . A A . 9 LEU CA 1 1 6 1318 1 1 9 LEU CB C 13.227 -1.238 -2.132 1.00 . A A . 9 LEU CB 1 1 6 1319 1 1 9 LEU CD1 C 11.024 -0.936 -3.280 1.00 . A A . 9 LEU CD1 1 1 6 1320 1 1 9 LEU CD2 C 11.487 -3.039 -2.011 1.00 . A A . 9 LEU CD2 1 1 6 1321 1 1 9 LEU CG C 11.723 -1.529 -2.053 1.00 . A A . 9 LEU CG 1 1 6 1322 1 1 9 LEU H H 12.161 -1.509 0.182 1.00 . A A . 9 LEU H 1 1 6 1323 1 1 9 LEU HA H 14.326 -2.791 -1.131 1.00 . A A . 9 LEU HA 1 1 6 1324 1 1 9 LEU HB2 H 13.377 -0.168 -2.174 1.00 . A A . 9 LEU HB2 1 1 6 1325 1 1 9 LEU HB3 H 13.631 -1.689 -3.028 1.00 . A A . 9 LEU HB3 1 1 6 1326 1 1 9 LEU HD11 H 11.540 -1.250 -4.175 1.00 . A A . 9 LEU HD11 1 1 6 1327 1 1 9 LEU HD12 H 11.037 0.143 -3.215 1.00 . A A . 9 LEU HD12 1 1 6 1328 1 1 9 LEU HD13 H 10.003 -1.281 -3.314 1.00 . A A . 9 LEU HD13 1 1 6 1329 1 1 9 LEU HD21 H 11.663 -3.403 -1.009 1.00 . A A . 9 LEU HD21 1 1 6 1330 1 1 9 LEU HD22 H 12.163 -3.527 -2.697 1.00 . A A . 9 LEU HD22 1 1 6 1331 1 1 9 LEU HD23 H 10.468 -3.250 -2.296 1.00 . A A . 9 LEU HD23 1 1 6 1332 1 1 9 LEU HG H 11.317 -1.078 -1.160 1.00 . A A . 9 LEU HG 1 1 6 1333 1 1 9 LEU N N 13.059 -1.880 0.246 1.00 . A A . 9 LEU N 1 1 6 1334 1 1 9 LEU O O 16.284 -1.216 -0.841 1.00 . A A . 9 LEU O 1 1 6 1335 1 1 10 ALA C C 16.935 0.549 1.236 1.00 . A A . 10 ALA C 1 1 6 1336 1 1 10 ALA CA C 15.841 1.205 0.408 1.00 . A A . 10 ALA CA 1 1 6 1337 1 1 10 ALA CB C 15.219 2.351 1.205 1.00 . A A . 10 ALA CB 1 1 6 1338 1 1 10 ALA H H 13.872 0.429 0.234 1.00 . A A . 10 ALA H 1 1 6 1339 1 1 10 ALA HA H 16.283 1.606 -0.493 1.00 . A A . 10 ALA HA 1 1 6 1340 1 1 10 ALA HB1 H 14.488 2.861 0.594 1.00 . A A . 10 ALA HB1 1 1 6 1341 1 1 10 ALA HB2 H 15.991 3.048 1.499 1.00 . A A . 10 ALA HB2 1 1 6 1342 1 1 10 ALA HB3 H 14.736 1.956 2.087 1.00 . A A . 10 ALA HB3 1 1 6 1343 1 1 10 ALA N N 14.816 0.236 0.041 1.00 . A A . 10 ALA N 1 1 6 1344 1 1 10 ALA O O 18.116 0.835 1.049 1.00 . A A . 10 ALA O 1 1 6 1345 1 1 11 LYS C C 18.587 -1.675 2.125 1.00 . A A . 11 LYS C 1 1 6 1346 1 1 11 LYS CA C 17.515 -1.023 2.986 1.00 . A A . 11 LYS CA 1 1 6 1347 1 1 11 LYS CB C 16.824 -2.095 3.842 1.00 . A A . 11 LYS CB 1 1 6 1348 1 1 11 LYS CD C 16.673 -3.076 6.145 1.00 . A A . 11 LYS CD 1 1 6 1349 1 1 11 LYS CE C 17.822 -3.888 6.746 1.00 . A A . 11 LYS CE 1 1 6 1350 1 1 11 LYS CG C 17.244 -1.927 5.309 1.00 . A A . 11 LYS CG 1 1 6 1351 1 1 11 LYS H H 15.587 -0.530 2.247 1.00 . A A . 11 LYS H 1 1 6 1352 1 1 11 LYS HA H 17.984 -0.302 3.638 1.00 . A A . 11 LYS HA 1 1 6 1353 1 1 11 LYS HB2 H 15.753 -1.991 3.757 1.00 . A A . 11 LYS HB2 1 1 6 1354 1 1 11 LYS HB3 H 17.120 -3.077 3.495 1.00 . A A . 11 LYS HB3 1 1 6 1355 1 1 11 LYS HD2 H 16.061 -2.671 6.942 1.00 . A A . 11 LYS HD2 1 1 6 1356 1 1 11 LYS HD3 H 16.068 -3.716 5.519 1.00 . A A . 11 LYS HD3 1 1 6 1357 1 1 11 LYS HE2 H 18.422 -3.253 7.381 1.00 . A A . 11 LYS HE2 1 1 6 1358 1 1 11 LYS HE3 H 17.418 -4.702 7.329 1.00 . A A . 11 LYS HE3 1 1 6 1359 1 1 11 LYS HG2 H 18.325 -1.937 5.380 1.00 . A A . 11 LYS HG2 1 1 6 1360 1 1 11 LYS HG3 H 16.868 -0.985 5.687 1.00 . A A . 11 LYS HG3 1 1 6 1361 1 1 11 LYS HZ1 H 19.069 -5.351 5.943 1.00 . A A . 11 LYS HZ1 1 1 6 1362 1 1 11 LYS HZ2 H 19.439 -3.775 5.442 1.00 . A A . 11 LYS HZ2 1 1 6 1363 1 1 11 LYS HZ3 H 18.087 -4.572 4.792 1.00 . A A . 11 LYS HZ3 1 1 6 1364 1 1 11 LYS N N 16.543 -0.334 2.145 1.00 . A A . 11 LYS N 1 1 6 1365 1 1 11 LYS NZ N 18.667 -4.437 5.650 1.00 . A A . 11 LYS NZ 1 1 6 1366 1 1 11 LYS O O 19.773 -1.635 2.453 1.00 . A A . 11 LYS O 1 1 6 1367 1 1 12 LYS C C 19.873 -1.907 -0.677 1.00 . A A . 12 LYS C 1 1 6 1368 1 1 12 LYS CA C 19.091 -2.938 0.125 1.00 . A A . 12 LYS CA 1 1 6 1369 1 1 12 LYS CB C 18.321 -3.878 -0.815 1.00 . A A . 12 LYS CB 1 1 6 1370 1 1 12 LYS CD C 16.705 -4.898 0.799 1.00 . A A . 12 LYS CD 1 1 6 1371 1 1 12 LYS CE C 15.469 -5.412 0.063 1.00 . A A . 12 LYS CE 1 1 6 1372 1 1 12 LYS CG C 17.951 -5.157 -0.055 1.00 . A A . 12 LYS CG 1 1 6 1373 1 1 12 LYS H H 17.206 -2.271 0.810 1.00 . A A . 12 LYS H 1 1 6 1374 1 1 12 LYS HA H 19.780 -3.522 0.712 1.00 . A A . 12 LYS HA 1 1 6 1375 1 1 12 LYS HB2 H 17.419 -3.388 -1.158 1.00 . A A . 12 LYS HB2 1 1 6 1376 1 1 12 LYS HB3 H 18.939 -4.132 -1.662 1.00 . A A . 12 LYS HB3 1 1 6 1377 1 1 12 LYS HD2 H 16.804 -5.403 1.748 1.00 . A A . 12 LYS HD2 1 1 6 1378 1 1 12 LYS HD3 H 16.597 -3.840 0.970 1.00 . A A . 12 LYS HD3 1 1 6 1379 1 1 12 LYS HE2 H 14.603 -4.851 0.378 1.00 . A A . 12 LYS HE2 1 1 6 1380 1 1 12 LYS HE3 H 15.610 -5.286 -1.001 1.00 . A A . 12 LYS HE3 1 1 6 1381 1 1 12 LYS HG2 H 17.749 -5.948 -0.764 1.00 . A A . 12 LYS HG2 1 1 6 1382 1 1 12 LYS HG3 H 18.771 -5.449 0.585 1.00 . A A . 12 LYS HG3 1 1 6 1383 1 1 12 LYS HZ1 H 15.102 -6.971 1.391 1.00 . A A . 12 LYS HZ1 1 1 6 1384 1 1 12 LYS HZ2 H 16.124 -7.384 0.107 1.00 . A A . 12 LYS HZ2 1 1 6 1385 1 1 12 LYS HZ3 H 14.454 -7.214 -0.155 1.00 . A A . 12 LYS HZ3 1 1 6 1386 1 1 12 LYS N N 18.160 -2.275 1.024 1.00 . A A . 12 LYS N 1 1 6 1387 1 1 12 LYS NZ N 15.273 -6.854 0.377 1.00 . A A . 12 LYS NZ 1 1 6 1388 1 1 12 LYS O O 21.055 -2.094 -0.973 1.00 . A A . 12 LYS O 1 1 6 1389 1 1 13 ILE C C 20.868 0.960 -0.876 1.00 . A A . 13 ILE C 1 1 6 1390 1 1 13 ILE CA C 19.855 0.253 -1.765 1.00 . A A . 13 ILE CA 1 1 6 1391 1 1 13 ILE CB C 18.801 1.239 -2.264 1.00 . A A . 13 ILE CB 1 1 6 1392 1 1 13 ILE CD1 C 18.198 0.074 -4.406 1.00 . A A . 13 ILE CD1 1 1 6 1393 1 1 13 ILE CG1 C 17.697 0.484 -3.018 1.00 . A A . 13 ILE CG1 1 1 6 1394 1 1 13 ILE CG2 C 19.447 2.269 -3.195 1.00 . A A . 13 ILE CG2 1 1 6 1395 1 1 13 ILE H H 18.280 -0.711 -0.741 1.00 . A A . 13 ILE H 1 1 6 1396 1 1 13 ILE HA H 20.360 -0.171 -2.607 1.00 . A A . 13 ILE HA 1 1 6 1397 1 1 13 ILE HB H 18.372 1.746 -1.421 1.00 . A A . 13 ILE HB 1 1 6 1398 1 1 13 ILE HD11 H 19.251 -0.156 -4.356 1.00 . A A . 13 ILE HD11 1 1 6 1399 1 1 13 ILE HD12 H 18.040 0.887 -5.099 1.00 . A A . 13 ILE HD12 1 1 6 1400 1 1 13 ILE HD13 H 17.654 -0.795 -4.740 1.00 . A A . 13 ILE HD13 1 1 6 1401 1 1 13 ILE HG12 H 17.419 -0.399 -2.464 1.00 . A A . 13 ILE HG12 1 1 6 1402 1 1 13 ILE HG13 H 16.834 1.126 -3.127 1.00 . A A . 13 ILE HG13 1 1 6 1403 1 1 13 ILE HG21 H 20.379 2.609 -2.767 1.00 . A A . 13 ILE HG21 1 1 6 1404 1 1 13 ILE HG22 H 18.780 3.109 -3.319 1.00 . A A . 13 ILE HG22 1 1 6 1405 1 1 13 ILE HG23 H 19.638 1.819 -4.157 1.00 . A A . 13 ILE HG23 1 1 6 1406 1 1 13 ILE N N 19.214 -0.810 -1.011 1.00 . A A . 13 ILE N 1 1 6 1407 1 1 13 ILE O O 21.960 1.329 -1.317 1.00 . A A . 13 ILE O 1 1 6 1408 1 1 14 LEU C C 22.353 0.772 1.930 1.00 . A A . 14 LEU C 1 1 6 1409 1 1 14 LEU CA C 21.378 1.785 1.344 1.00 . A A . 14 LEU CA 1 1 6 1410 1 1 14 LEU CB C 20.550 2.412 2.472 1.00 . A A . 14 LEU CB 1 1 6 1411 1 1 14 LEU CD1 C 19.704 4.388 1.185 1.00 . A A . 14 LEU CD1 1 1 6 1412 1 1 14 LEU CD2 C 20.068 4.562 3.652 1.00 . A A . 14 LEU CD2 1 1 6 1413 1 1 14 LEU CG C 20.584 3.939 2.356 1.00 . A A . 14 LEU CG 1 1 6 1414 1 1 14 LEU H H 19.617 0.813 0.677 1.00 . A A . 14 LEU H 1 1 6 1415 1 1 14 LEU HA H 21.937 2.562 0.841 1.00 . A A . 14 LEU HA 1 1 6 1416 1 1 14 LEU HB2 H 19.527 2.067 2.406 1.00 . A A . 14 LEU HB2 1 1 6 1417 1 1 14 LEU HB3 H 20.963 2.116 3.424 1.00 . A A . 14 LEU HB3 1 1 6 1418 1 1 14 LEU HD11 H 20.222 4.204 0.256 1.00 . A A . 14 LEU HD11 1 1 6 1419 1 1 14 LEU HD12 H 19.494 5.444 1.277 1.00 . A A . 14 LEU HD12 1 1 6 1420 1 1 14 LEU HD13 H 18.778 3.836 1.198 1.00 . A A . 14 LEU HD13 1 1 6 1421 1 1 14 LEU HD21 H 19.808 5.594 3.473 1.00 . A A . 14 LEU HD21 1 1 6 1422 1 1 14 LEU HD22 H 20.837 4.512 4.410 1.00 . A A . 14 LEU HD22 1 1 6 1423 1 1 14 LEU HD23 H 19.193 4.025 3.989 1.00 . A A . 14 LEU HD23 1 1 6 1424 1 1 14 LEU HG H 21.600 4.264 2.185 1.00 . A A . 14 LEU HG 1 1 6 1425 1 1 14 LEU N N 20.499 1.134 0.384 1.00 . A A . 14 LEU N 1 1 6 1426 1 1 14 LEU O O 23.352 1.150 2.541 1.00 . A A . 14 LEU O 1 1 6 1427 1 1 15 NH2 HN1 H 21.332 -0.809 1.292 1.00 . A A . 15 NH2 HN1 1 1 6 1428 1 1 15 NH2 N N 22.128 -0.504 1.779 1.00 . A A . 15 NH2 N 1 1 7 1429 1 1 1 ILE C C 2.147 0.329 -0.044 1.00 . A A . 1 ILE C 1 1 7 1430 1 1 1 ILE CA C 1.466 -0.981 -0.429 1.00 . A A . 1 ILE CA 1 1 7 1431 1 1 1 ILE CB C 1.495 -1.984 0.743 1.00 . A A . 1 ILE CB 1 1 7 1432 1 1 1 ILE CD1 C 3.285 -3.676 0.184 1.00 . A A . 1 ILE CD1 1 1 7 1433 1 1 1 ILE CG1 C 2.940 -2.446 1.032 1.00 . A A . 1 ILE CG1 1 1 7 1434 1 1 1 ILE CG2 C 0.620 -3.200 0.401 1.00 . A A . 1 ILE CG2 1 1 7 1435 1 1 1 ILE H1 H 1.484 -2.051 -2.206 1.00 . A A . 1 ILE H1 1 1 7 1436 1 1 1 ILE H2 H 2.894 -2.217 -1.275 1.00 . A A . 1 ILE H2 1 1 7 1437 1 1 1 ILE H3 H 2.610 -0.790 -2.141 1.00 . A A . 1 ILE H3 1 1 7 1438 1 1 1 ILE HA H 0.436 -0.779 -0.696 1.00 . A A . 1 ILE HA 1 1 7 1439 1 1 1 ILE HB H 1.090 -1.503 1.624 1.00 . A A . 1 ILE HB 1 1 7 1440 1 1 1 ILE HD11 H 4.236 -3.525 -0.306 1.00 . A A . 1 ILE HD11 1 1 7 1441 1 1 1 ILE HD12 H 2.519 -3.831 -0.559 1.00 . A A . 1 ILE HD12 1 1 7 1442 1 1 1 ILE HD13 H 3.343 -4.545 0.820 1.00 . A A . 1 ILE HD13 1 1 7 1443 1 1 1 ILE HG12 H 3.634 -1.643 0.808 1.00 . A A . 1 ILE HG12 1 1 7 1444 1 1 1 ILE HG13 H 3.026 -2.705 2.078 1.00 . A A . 1 ILE HG13 1 1 7 1445 1 1 1 ILE HG21 H -0.402 -2.879 0.261 1.00 . A A . 1 ILE HG21 1 1 7 1446 1 1 1 ILE HG22 H 0.665 -3.914 1.208 1.00 . A A . 1 ILE HG22 1 1 7 1447 1 1 1 ILE HG23 H 0.980 -3.663 -0.508 1.00 . A A . 1 ILE HG23 1 1 7 1448 1 1 1 ILE N N 2.166 -1.556 -1.600 1.00 . A A . 1 ILE N 1 1 7 1449 1 1 1 ILE O O 2.419 1.170 -0.901 1.00 . A A . 1 ILE O 1 1 7 1450 1 1 2 ASN C C 4.553 1.743 1.487 1.00 . A A . 2 ASN C 1 1 7 1451 1 1 2 ASN CA C 3.045 1.747 1.715 1.00 . A A . 2 ASN CA 1 1 7 1452 1 1 2 ASN CB C 2.755 1.969 3.205 1.00 . A A . 2 ASN CB 1 1 7 1453 1 1 2 ASN CG C 2.340 0.673 3.885 1.00 . A A . 2 ASN CG 1 1 7 1454 1 1 2 ASN H H 2.164 -0.182 1.891 1.00 . A A . 2 ASN H 1 1 7 1455 1 1 2 ASN HA H 2.637 2.574 1.167 1.00 . A A . 2 ASN HA 1 1 7 1456 1 1 2 ASN HB2 H 3.644 2.351 3.688 1.00 . A A . 2 ASN HB2 1 1 7 1457 1 1 2 ASN HB3 H 1.958 2.689 3.303 1.00 . A A . 2 ASN HB3 1 1 7 1458 1 1 2 ASN HD21 H 0.515 0.663 3.104 1.00 . A A . 2 ASN HD21 1 1 7 1459 1 1 2 ASN HD22 H 0.873 -0.642 4.128 1.00 . A A . 2 ASN HD22 1 1 7 1460 1 1 2 ASN N N 2.412 0.512 1.246 1.00 . A A . 2 ASN N 1 1 7 1461 1 1 2 ASN ND2 N 1.144 0.192 3.689 1.00 . A A . 2 ASN ND2 1 1 7 1462 1 1 2 ASN O O 5.111 0.830 0.876 1.00 . A A . 2 ASN O 1 1 7 1463 1 1 2 ASN OD1 O 3.131 0.079 4.613 1.00 . A A . 2 ASN OD1 1 1 7 1464 1 1 3 LEU C C 7.365 1.852 2.624 1.00 . A A . 3 LEU C 1 1 7 1465 1 1 3 LEU CA C 6.633 2.937 1.861 1.00 . A A . 3 LEU CA 1 1 7 1466 1 1 3 LEU CB C 7.042 4.293 2.397 1.00 . A A . 3 LEU CB 1 1 7 1467 1 1 3 LEU CD1 C 5.026 5.751 2.784 1.00 . A A . 3 LEU CD1 1 1 7 1468 1 1 3 LEU CD2 C 6.987 6.644 1.512 1.00 . A A . 3 LEU CD2 1 1 7 1469 1 1 3 LEU CG C 6.148 5.392 1.796 1.00 . A A . 3 LEU CG 1 1 7 1470 1 1 3 LEU H H 4.691 3.472 2.473 1.00 . A A . 3 LEU H 1 1 7 1471 1 1 3 LEU HA H 6.902 2.886 0.829 1.00 . A A . 3 LEU HA 1 1 7 1472 1 1 3 LEU HB2 H 6.926 4.275 3.456 1.00 . A A . 3 LEU HB2 1 1 7 1473 1 1 3 LEU HB3 H 8.078 4.484 2.147 1.00 . A A . 3 LEU HB3 1 1 7 1474 1 1 3 LEU HD11 H 4.889 4.943 3.486 1.00 . A A . 3 LEU HD11 1 1 7 1475 1 1 3 LEU HD12 H 4.105 5.911 2.240 1.00 . A A . 3 LEU HD12 1 1 7 1476 1 1 3 LEU HD13 H 5.289 6.651 3.319 1.00 . A A . 3 LEU HD13 1 1 7 1477 1 1 3 LEU HD21 H 7.814 6.386 0.868 1.00 . A A . 3 LEU HD21 1 1 7 1478 1 1 3 LEU HD22 H 7.367 7.045 2.442 1.00 . A A . 3 LEU HD22 1 1 7 1479 1 1 3 LEU HD23 H 6.372 7.387 1.025 1.00 . A A . 3 LEU HD23 1 1 7 1480 1 1 3 LEU HG H 5.712 5.035 0.876 1.00 . A A . 3 LEU HG 1 1 7 1481 1 1 3 LEU N N 5.197 2.782 1.996 1.00 . A A . 3 LEU N 1 1 7 1482 1 1 3 LEU O O 8.504 1.511 2.307 1.00 . A A . 3 LEU O 1 1 7 1483 1 1 4 LYS C C 7.815 -0.851 3.606 1.00 . A A . 4 LYS C 1 1 7 1484 1 1 4 LYS CA C 7.325 0.297 4.469 1.00 . A A . 4 LYS CA 1 1 7 1485 1 1 4 LYS CB C 6.325 -0.227 5.493 1.00 . A A . 4 LYS CB 1 1 7 1486 1 1 4 LYS CD C 5.127 1.485 6.883 1.00 . A A . 4 LYS CD 1 1 7 1487 1 1 4 LYS CE C 4.026 0.717 7.626 1.00 . A A . 4 LYS CE 1 1 7 1488 1 1 4 LYS CG C 6.386 0.621 6.770 1.00 . A A . 4 LYS CG 1 1 7 1489 1 1 4 LYS H H 5.813 1.649 3.866 1.00 . A A . 4 LYS H 1 1 7 1490 1 1 4 LYS HA H 8.164 0.727 4.988 1.00 . A A . 4 LYS HA 1 1 7 1491 1 1 4 LYS HB2 H 5.331 -0.182 5.076 1.00 . A A . 4 LYS HB2 1 1 7 1492 1 1 4 LYS HB3 H 6.566 -1.249 5.733 1.00 . A A . 4 LYS HB3 1 1 7 1493 1 1 4 LYS HD2 H 5.363 2.388 7.428 1.00 . A A . 4 LYS HD2 1 1 7 1494 1 1 4 LYS HD3 H 4.780 1.744 5.894 1.00 . A A . 4 LYS HD3 1 1 7 1495 1 1 4 LYS HE2 H 4.388 0.431 8.604 1.00 . A A . 4 LYS HE2 1 1 7 1496 1 1 4 LYS HE3 H 3.158 1.353 7.740 1.00 . A A . 4 LYS HE3 1 1 7 1497 1 1 4 LYS HG2 H 6.460 -0.029 7.630 1.00 . A A . 4 LYS HG2 1 1 7 1498 1 1 4 LYS HG3 H 7.254 1.264 6.735 1.00 . A A . 4 LYS HG3 1 1 7 1499 1 1 4 LYS HZ1 H 4.466 -1.149 6.799 1.00 . A A . 4 LYS HZ1 1 1 7 1500 1 1 4 LYS HZ2 H 3.351 -0.233 5.889 1.00 . A A . 4 LYS HZ2 1 1 7 1501 1 1 4 LYS HZ3 H 2.868 -0.988 7.331 1.00 . A A . 4 LYS HZ3 1 1 7 1502 1 1 4 LYS N N 6.714 1.327 3.651 1.00 . A A . 4 LYS N 1 1 7 1503 1 1 4 LYS NZ N 3.652 -0.505 6.855 1.00 . A A . 4 LYS NZ 1 1 7 1504 1 1 4 LYS O O 8.936 -1.329 3.776 1.00 . A A . 4 LYS O 1 1 7 1505 1 1 5 ALA C C 8.470 -1.927 0.853 1.00 . A A . 5 ALA C 1 1 7 1506 1 1 5 ALA CA C 7.361 -2.378 1.792 1.00 . A A . 5 ALA CA 1 1 7 1507 1 1 5 ALA CB C 6.162 -2.847 0.970 1.00 . A A . 5 ALA CB 1 1 7 1508 1 1 5 ALA H H 6.096 -0.869 2.582 1.00 . A A . 5 ALA H 1 1 7 1509 1 1 5 ALA HA H 7.718 -3.199 2.387 1.00 . A A . 5 ALA HA 1 1 7 1510 1 1 5 ALA HB1 H 5.423 -3.279 1.628 1.00 . A A . 5 ALA HB1 1 1 7 1511 1 1 5 ALA HB2 H 6.484 -3.591 0.254 1.00 . A A . 5 ALA HB2 1 1 7 1512 1 1 5 ALA HB3 H 5.733 -2.008 0.447 1.00 . A A . 5 ALA HB3 1 1 7 1513 1 1 5 ALA N N 6.980 -1.286 2.674 1.00 . A A . 5 ALA N 1 1 7 1514 1 1 5 ALA O O 9.399 -2.681 0.560 1.00 . A A . 5 ALA O 1 1 7 1515 1 1 6 LEU C C 10.677 0.046 0.230 1.00 . A A . 6 LEU C 1 1 7 1516 1 1 6 LEU CA C 9.360 -0.127 -0.507 1.00 . A A . 6 LEU CA 1 1 7 1517 1 1 6 LEU CB C 8.871 1.236 -1.001 1.00 . A A . 6 LEU CB 1 1 7 1518 1 1 6 LEU CD1 C 6.924 2.489 -1.923 1.00 . A A . 6 LEU CD1 1 1 7 1519 1 1 6 LEU CD2 C 7.453 0.202 -2.789 1.00 . A A . 6 LEU CD2 1 1 7 1520 1 1 6 LEU CG C 7.448 1.104 -1.551 1.00 . A A . 6 LEU CG 1 1 7 1521 1 1 6 LEU H H 7.612 -0.129 0.661 1.00 . A A . 6 LEU H 1 1 7 1522 1 1 6 LEU HA H 9.496 -0.782 -1.348 1.00 . A A . 6 LEU HA 1 1 7 1523 1 1 6 LEU HB2 H 8.872 1.934 -0.176 1.00 . A A . 6 LEU HB2 1 1 7 1524 1 1 6 LEU HB3 H 9.525 1.595 -1.779 1.00 . A A . 6 LEU HB3 1 1 7 1525 1 1 6 LEU HD11 H 6.499 2.459 -2.912 1.00 . A A . 6 LEU HD11 1 1 7 1526 1 1 6 LEU HD12 H 7.740 3.202 -1.901 1.00 . A A . 6 LEU HD12 1 1 7 1527 1 1 6 LEU HD13 H 6.166 2.786 -1.216 1.00 . A A . 6 LEU HD13 1 1 7 1528 1 1 6 LEU HD21 H 7.599 -0.826 -2.488 1.00 . A A . 6 LEU HD21 1 1 7 1529 1 1 6 LEU HD22 H 8.254 0.500 -3.452 1.00 . A A . 6 LEU HD22 1 1 7 1530 1 1 6 LEU HD23 H 6.508 0.292 -3.307 1.00 . A A . 6 LEU HD23 1 1 7 1531 1 1 6 LEU HG H 6.809 0.676 -0.792 1.00 . A A . 6 LEU HG 1 1 7 1532 1 1 6 LEU N N 8.368 -0.686 0.392 1.00 . A A . 6 LEU N 1 1 7 1533 1 1 6 LEU O O 11.752 -0.280 -0.288 1.00 . A A . 6 LEU O 1 1 7 1534 1 1 7 ALA C C 12.517 -0.522 2.472 1.00 . A A . 7 ALA C 1 1 7 1535 1 1 7 ALA CA C 11.748 0.774 2.283 1.00 . A A . 7 ALA CA 1 1 7 1536 1 1 7 ALA CB C 11.331 1.323 3.648 1.00 . A A . 7 ALA CB 1 1 7 1537 1 1 7 ALA H H 9.684 0.784 1.798 1.00 . A A . 7 ALA H 1 1 7 1538 1 1 7 ALA HA H 12.386 1.490 1.798 1.00 . A A . 7 ALA HA 1 1 7 1539 1 1 7 ALA HB1 H 10.889 0.531 4.235 1.00 . A A . 7 ALA HB1 1 1 7 1540 1 1 7 ALA HB2 H 10.612 2.118 3.514 1.00 . A A . 7 ALA HB2 1 1 7 1541 1 1 7 ALA HB3 H 12.203 1.708 4.161 1.00 . A A . 7 ALA HB3 1 1 7 1542 1 1 7 ALA N N 10.576 0.549 1.450 1.00 . A A . 7 ALA N 1 1 7 1543 1 1 7 ALA O O 13.740 -0.513 2.599 1.00 . A A . 7 ALA O 1 1 7 1544 1 1 8 ALA C C 13.453 -3.130 1.559 1.00 . A A . 8 ALA C 1 1 7 1545 1 1 8 ALA CA C 12.423 -2.931 2.648 1.00 . A A . 8 ALA CA 1 1 7 1546 1 1 8 ALA CB C 11.375 -4.045 2.585 1.00 . A A . 8 ALA CB 1 1 7 1547 1 1 8 ALA H H 10.822 -1.567 2.367 1.00 . A A . 8 ALA H 1 1 7 1548 1 1 8 ALA HA H 12.914 -2.964 3.604 1.00 . A A . 8 ALA HA 1 1 7 1549 1 1 8 ALA HB1 H 11.845 -4.994 2.802 1.00 . A A . 8 ALA HB1 1 1 7 1550 1 1 8 ALA HB2 H 10.939 -4.075 1.597 1.00 . A A . 8 ALA HB2 1 1 7 1551 1 1 8 ALA HB3 H 10.602 -3.854 3.316 1.00 . A A . 8 ALA HB3 1 1 7 1552 1 1 8 ALA N N 11.792 -1.629 2.479 1.00 . A A . 8 ALA N 1 1 7 1553 1 1 8 ALA O O 14.578 -3.563 1.815 1.00 . A A . 8 ALA O 1 1 7 1554 1 1 9 LEU C C 15.020 -1.805 -0.683 1.00 . A A . 9 LEU C 1 1 7 1555 1 1 9 LEU CA C 13.966 -2.892 -0.790 1.00 . A A . 9 LEU CA 1 1 7 1556 1 1 9 LEU CB C 13.190 -2.729 -2.105 1.00 . A A . 9 LEU CB 1 1 7 1557 1 1 9 LEU CD1 C 10.989 -3.069 -3.255 1.00 . A A . 9 LEU CD1 1 1 7 1558 1 1 9 LEU CD2 C 11.764 -4.711 -1.545 1.00 . A A . 9 LEU CD2 1 1 7 1559 1 1 9 LEU CG C 11.747 -3.231 -1.934 1.00 . A A . 9 LEU CG 1 1 7 1560 1 1 9 LEU H H 12.168 -2.430 0.222 1.00 . A A . 9 LEU H 1 1 7 1561 1 1 9 LEU HA H 14.450 -3.858 -0.780 1.00 . A A . 9 LEU HA 1 1 7 1562 1 1 9 LEU HB2 H 13.178 -1.685 -2.383 1.00 . A A . 9 LEU HB2 1 1 7 1563 1 1 9 LEU HB3 H 13.685 -3.301 -2.879 1.00 . A A . 9 LEU HB3 1 1 7 1564 1 1 9 LEU HD11 H 11.525 -3.576 -4.045 1.00 . A A . 9 LEU HD11 1 1 7 1565 1 1 9 LEU HD12 H 10.902 -2.019 -3.496 1.00 . A A . 9 LEU HD12 1 1 7 1566 1 1 9 LEU HD13 H 10.004 -3.498 -3.157 1.00 . A A . 9 LEU HD13 1 1 7 1567 1 1 9 LEU HD21 H 12.031 -5.304 -2.406 1.00 . A A . 9 LEU HD21 1 1 7 1568 1 1 9 LEU HD22 H 10.786 -5.004 -1.195 1.00 . A A . 9 LEU HD22 1 1 7 1569 1 1 9 LEU HD23 H 12.488 -4.869 -0.757 1.00 . A A . 9 LEU HD23 1 1 7 1570 1 1 9 LEU HG H 11.246 -2.657 -1.165 1.00 . A A . 9 LEU HG 1 1 7 1571 1 1 9 LEU N N 13.067 -2.789 0.347 1.00 . A A . 9 LEU N 1 1 7 1572 1 1 9 LEU O O 16.212 -2.046 -0.864 1.00 . A A . 9 LEU O 1 1 7 1573 1 1 10 ALA C C 16.525 0.299 0.782 1.00 . A A . 10 ALA C 1 1 7 1574 1 1 10 ALA CA C 15.430 0.555 -0.246 1.00 . A A . 10 ALA CA 1 1 7 1575 1 1 10 ALA CB C 14.620 1.787 0.172 1.00 . A A . 10 ALA CB 1 1 7 1576 1 1 10 ALA H H 13.578 -0.493 -0.253 1.00 . A A . 10 ALA H 1 1 7 1577 1 1 10 ALA HA H 15.891 0.751 -1.200 1.00 . A A . 10 ALA HA 1 1 7 1578 1 1 10 ALA HB1 H 14.838 2.028 1.203 1.00 . A A . 10 ALA HB1 1 1 7 1579 1 1 10 ALA HB2 H 13.566 1.581 0.065 1.00 . A A . 10 ALA HB2 1 1 7 1580 1 1 10 ALA HB3 H 14.888 2.623 -0.456 1.00 . A A . 10 ALA HB3 1 1 7 1581 1 1 10 ALA N N 14.549 -0.604 -0.381 1.00 . A A . 10 ALA N 1 1 7 1582 1 1 10 ALA O O 17.650 0.764 0.616 1.00 . A A . 10 ALA O 1 1 7 1583 1 1 11 LYS C C 18.472 -1.257 2.282 1.00 . A A . 11 LYS C 1 1 7 1584 1 1 11 LYS CA C 17.182 -0.713 2.887 1.00 . A A . 11 LYS CA 1 1 7 1585 1 1 11 LYS CB C 16.626 -1.735 3.864 1.00 . A A . 11 LYS CB 1 1 7 1586 1 1 11 LYS CD C 15.761 -1.166 6.142 1.00 . A A . 11 LYS CD 1 1 7 1587 1 1 11 LYS CE C 14.939 -0.084 6.834 1.00 . A A . 11 LYS CE 1 1 7 1588 1 1 11 LYS CG C 15.452 -1.133 4.648 1.00 . A A . 11 LYS CG 1 1 7 1589 1 1 11 LYS H H 15.284 -0.776 1.933 1.00 . A A . 11 LYS H 1 1 7 1590 1 1 11 LYS HA H 17.394 0.182 3.419 1.00 . A A . 11 LYS HA 1 1 7 1591 1 1 11 LYS HB2 H 16.288 -2.581 3.310 1.00 . A A . 11 LYS HB2 1 1 7 1592 1 1 11 LYS HB3 H 17.401 -2.036 4.551 1.00 . A A . 11 LYS HB3 1 1 7 1593 1 1 11 LYS HD2 H 15.503 -2.135 6.546 1.00 . A A . 11 LYS HD2 1 1 7 1594 1 1 11 LYS HD3 H 16.813 -0.975 6.302 1.00 . A A . 11 LYS HD3 1 1 7 1595 1 1 11 LYS HE2 H 13.968 -0.017 6.363 1.00 . A A . 11 LYS HE2 1 1 7 1596 1 1 11 LYS HE3 H 14.820 -0.336 7.874 1.00 . A A . 11 LYS HE3 1 1 7 1597 1 1 11 LYS HG2 H 15.290 -0.111 4.342 1.00 . A A . 11 LYS HG2 1 1 7 1598 1 1 11 LYS HG3 H 14.562 -1.709 4.458 1.00 . A A . 11 LYS HG3 1 1 7 1599 1 1 11 LYS HZ1 H 16.378 1.160 5.988 1.00 . A A . 11 LYS HZ1 1 1 7 1600 1 1 11 LYS HZ2 H 16.071 1.466 7.627 1.00 . A A . 11 LYS HZ2 1 1 7 1601 1 1 11 LYS HZ3 H 14.957 1.959 6.443 1.00 . A A . 11 LYS HZ3 1 1 7 1602 1 1 11 LYS N N 16.201 -0.433 1.841 1.00 . A A . 11 LYS N 1 1 7 1603 1 1 11 LYS NZ N 15.637 1.222 6.713 1.00 . A A . 11 LYS NZ 1 1 7 1604 1 1 11 LYS O O 19.562 -1.002 2.797 1.00 . A A . 11 LYS O 1 1 7 1605 1 1 12 LYS C C 20.194 -1.530 -0.331 1.00 . A A . 12 LYS C 1 1 7 1606 1 1 12 LYS CA C 19.493 -2.583 0.521 1.00 . A A . 12 LYS CA 1 1 7 1607 1 1 12 LYS CB C 19.053 -3.767 -0.345 1.00 . A A . 12 LYS CB 1 1 7 1608 1 1 12 LYS CD C 17.516 -4.865 1.302 1.00 . A A . 12 LYS CD 1 1 7 1609 1 1 12 LYS CE C 16.457 -5.729 0.621 1.00 . A A . 12 LYS CE 1 1 7 1610 1 1 12 LYS CG C 18.845 -4.995 0.547 1.00 . A A . 12 LYS CG 1 1 7 1611 1 1 12 LYS H H 17.443 -2.169 0.831 1.00 . A A . 12 LYS H 1 1 7 1612 1 1 12 LYS HA H 20.185 -2.939 1.269 1.00 . A A . 12 LYS HA 1 1 7 1613 1 1 12 LYS HB2 H 18.126 -3.525 -0.848 1.00 . A A . 12 LYS HB2 1 1 7 1614 1 1 12 LYS HB3 H 19.812 -3.983 -1.078 1.00 . A A . 12 LYS HB3 1 1 7 1615 1 1 12 LYS HD2 H 17.652 -5.194 2.320 1.00 . A A . 12 LYS HD2 1 1 7 1616 1 1 12 LYS HD3 H 17.188 -3.840 1.299 1.00 . A A . 12 LYS HD3 1 1 7 1617 1 1 12 LYS HE2 H 16.169 -5.268 -0.310 1.00 . A A . 12 LYS HE2 1 1 7 1618 1 1 12 LYS HE3 H 16.866 -6.709 0.425 1.00 . A A . 12 LYS HE3 1 1 7 1619 1 1 12 LYS HG2 H 18.829 -5.887 -0.065 1.00 . A A . 12 LYS HG2 1 1 7 1620 1 1 12 LYS HG3 H 19.653 -5.063 1.257 1.00 . A A . 12 LYS HG3 1 1 7 1621 1 1 12 LYS HZ1 H 15.531 -6.358 2.375 1.00 . A A . 12 LYS HZ1 1 1 7 1622 1 1 12 LYS HZ2 H 14.524 -6.386 1.004 1.00 . A A . 12 LYS HZ2 1 1 7 1623 1 1 12 LYS HZ3 H 14.911 -4.905 1.754 1.00 . A A . 12 LYS HZ3 1 1 7 1624 1 1 12 LYS N N 18.338 -2.006 1.195 1.00 . A A . 12 LYS N 1 1 7 1625 1 1 12 LYS NZ N 15.268 -5.855 1.506 1.00 . A A . 12 LYS NZ 1 1 7 1626 1 1 12 LYS O O 21.393 -1.633 -0.605 1.00 . A A . 12 LYS O 1 1 7 1627 1 1 13 ILE C C 20.502 1.675 -0.638 1.00 . A A . 13 ILE C 1 1 7 1628 1 1 13 ILE CA C 19.985 0.564 -1.544 1.00 . A A . 13 ILE CA 1 1 7 1629 1 1 13 ILE CB C 18.914 1.115 -2.487 1.00 . A A . 13 ILE CB 1 1 7 1630 1 1 13 ILE CD1 C 19.156 -0.668 -4.247 1.00 . A A . 13 ILE CD1 1 1 7 1631 1 1 13 ILE CG1 C 18.211 -0.043 -3.213 1.00 . A A . 13 ILE CG1 1 1 7 1632 1 1 13 ILE CG2 C 19.557 2.042 -3.523 1.00 . A A . 13 ILE CG2 1 1 7 1633 1 1 13 ILE H H 18.495 -0.490 -0.477 1.00 . A A . 13 ILE H 1 1 7 1634 1 1 13 ILE HA H 20.792 0.186 -2.129 1.00 . A A . 13 ILE HA 1 1 7 1635 1 1 13 ILE HB H 18.197 1.671 -1.911 1.00 . A A . 13 ILE HB 1 1 7 1636 1 1 13 ILE HD11 H 19.283 0.015 -5.076 1.00 . A A . 13 ILE HD11 1 1 7 1637 1 1 13 ILE HD12 H 18.736 -1.596 -4.610 1.00 . A A . 13 ILE HD12 1 1 7 1638 1 1 13 ILE HD13 H 20.115 -0.865 -3.793 1.00 . A A . 13 ILE HD13 1 1 7 1639 1 1 13 ILE HG12 H 17.920 -0.795 -2.497 1.00 . A A . 13 ILE HG12 1 1 7 1640 1 1 13 ILE HG13 H 17.333 0.331 -3.716 1.00 . A A . 13 ILE HG13 1 1 7 1641 1 1 13 ILE HG21 H 18.788 2.463 -4.159 1.00 . A A . 13 ILE HG21 1 1 7 1642 1 1 13 ILE HG22 H 20.253 1.481 -4.129 1.00 . A A . 13 ILE HG22 1 1 7 1643 1 1 13 ILE HG23 H 20.082 2.839 -3.018 1.00 . A A . 13 ILE HG23 1 1 7 1644 1 1 13 ILE N N 19.438 -0.517 -0.738 1.00 . A A . 13 ILE N 1 1 7 1645 1 1 13 ILE O O 21.547 2.274 -0.901 1.00 . A A . 13 ILE O 1 1 7 1646 1 1 14 LEU C C 21.401 2.555 2.133 1.00 . A A . 14 LEU C 1 1 7 1647 1 1 14 LEU CA C 20.130 2.963 1.390 1.00 . A A . 14 LEU CA 1 1 7 1648 1 1 14 LEU CB C 18.985 3.187 2.393 1.00 . A A . 14 LEU CB 1 1 7 1649 1 1 14 LEU CD1 C 17.556 4.042 0.514 1.00 . A A . 14 LEU CD1 1 1 7 1650 1 1 14 LEU CD2 C 16.913 4.493 2.883 1.00 . A A . 14 LEU CD2 1 1 7 1651 1 1 14 LEU CG C 18.091 4.338 1.920 1.00 . A A . 14 LEU CG 1 1 7 1652 1 1 14 LEU H H 18.938 1.413 0.578 1.00 . A A . 14 LEU H 1 1 7 1653 1 1 14 LEU HA H 20.317 3.884 0.862 1.00 . A A . 14 LEU HA 1 1 7 1654 1 1 14 LEU HB2 H 18.396 2.285 2.477 1.00 . A A . 14 LEU HB2 1 1 7 1655 1 1 14 LEU HB3 H 19.398 3.434 3.359 1.00 . A A . 14 LEU HB3 1 1 7 1656 1 1 14 LEU HD11 H 18.351 4.162 -0.206 1.00 . A A . 14 LEU HD11 1 1 7 1657 1 1 14 LEU HD12 H 16.754 4.726 0.283 1.00 . A A . 14 LEU HD12 1 1 7 1658 1 1 14 LEU HD13 H 17.186 3.028 0.473 1.00 . A A . 14 LEU HD13 1 1 7 1659 1 1 14 LEU HD21 H 16.726 3.554 3.381 1.00 . A A . 14 LEU HD21 1 1 7 1660 1 1 14 LEU HD22 H 16.033 4.790 2.331 1.00 . A A . 14 LEU HD22 1 1 7 1661 1 1 14 LEU HD23 H 17.149 5.248 3.618 1.00 . A A . 14 LEU HD23 1 1 7 1662 1 1 14 LEU HG H 18.663 5.253 1.904 1.00 . A A . 14 LEU HG 1 1 7 1663 1 1 14 LEU N N 19.757 1.932 0.430 1.00 . A A . 14 LEU N 1 1 7 1664 1 1 14 LEU O O 21.446 2.596 3.367 1.00 . A A . 14 LEU O 1 1 7 1665 1 1 15 NH2 HN1 H 22.402 2.117 0.474 1.00 . A A . 15 NH2 HN1 1 1 7 1666 1 1 15 NH2 N N 22.437 2.152 1.456 1.00 . A A . 15 NH2 N 1 1 8 1667 1 1 1 ILE C C 2.579 0.300 -0.718 1.00 . A A . 1 ILE C 1 1 8 1668 1 1 1 ILE CA C 2.211 -1.082 -1.256 1.00 . A A . 1 ILE CA 1 1 8 1669 1 1 1 ILE CB C 1.108 -1.720 -0.388 1.00 . A A . 1 ILE CB 1 1 8 1670 1 1 1 ILE CD1 C 1.783 -3.959 0.563 1.00 . A A . 1 ILE CD1 1 1 8 1671 1 1 1 ILE CG1 C 1.732 -2.450 0.818 1.00 . A A . 1 ILE CG1 1 1 8 1672 1 1 1 ILE CG2 C 0.307 -2.711 -1.238 1.00 . A A . 1 ILE CG2 1 1 8 1673 1 1 1 ILE H1 H 3.594 -2.295 -2.231 1.00 . A A . 1 ILE H1 1 1 8 1674 1 1 1 ILE H2 H 3.281 -2.759 -0.632 1.00 . A A . 1 ILE H2 1 1 8 1675 1 1 1 ILE H3 H 4.246 -1.401 -0.952 1.00 . A A . 1 ILE H3 1 1 8 1676 1 1 1 ILE HA H 1.847 -0.974 -2.267 1.00 . A A . 1 ILE HA 1 1 8 1677 1 1 1 ILE HB H 0.443 -0.946 -0.032 1.00 . A A . 1 ILE HB 1 1 8 1678 1 1 1 ILE HD11 H 0.794 -4.381 0.696 1.00 . A A . 1 ILE HD11 1 1 8 1679 1 1 1 ILE HD12 H 2.467 -4.419 1.261 1.00 . A A . 1 ILE HD12 1 1 8 1680 1 1 1 ILE HD13 H 2.120 -4.146 -0.444 1.00 . A A . 1 ILE HD13 1 1 8 1681 1 1 1 ILE HG12 H 2.735 -2.083 0.983 1.00 . A A . 1 ILE HG12 1 1 8 1682 1 1 1 ILE HG13 H 1.135 -2.259 1.699 1.00 . A A . 1 ILE HG13 1 1 8 1683 1 1 1 ILE HG21 H 0.983 -3.410 -1.704 1.00 . A A . 1 ILE HG21 1 1 8 1684 1 1 1 ILE HG22 H -0.239 -2.174 -2.000 1.00 . A A . 1 ILE HG22 1 1 8 1685 1 1 1 ILE HG23 H -0.389 -3.248 -0.609 1.00 . A A . 1 ILE HG23 1 1 8 1686 1 1 1 ILE N N 3.422 -1.951 -1.267 1.00 . A A . 1 ILE N 1 1 8 1687 1 1 1 ILE O O 2.399 1.311 -1.401 1.00 . A A . 1 ILE O 1 1 8 1688 1 1 2 ASN C C 4.966 1.820 1.082 1.00 . A A . 2 ASN C 1 1 8 1689 1 1 2 ASN CA C 3.464 1.616 1.122 1.00 . A A . 2 ASN CA 1 1 8 1690 1 1 2 ASN CB C 2.990 1.675 2.575 1.00 . A A . 2 ASN CB 1 1 8 1691 1 1 2 ASN CG C 1.736 0.825 2.771 1.00 . A A . 2 ASN CG 1 1 8 1692 1 1 2 ASN H H 3.205 -0.488 1.017 1.00 . A A . 2 ASN H 1 1 8 1693 1 1 2 ASN HA H 2.997 2.419 0.579 1.00 . A A . 2 ASN HA 1 1 8 1694 1 1 2 ASN HB2 H 3.770 1.308 3.224 1.00 . A A . 2 ASN HB2 1 1 8 1695 1 1 2 ASN HB3 H 2.771 2.698 2.830 1.00 . A A . 2 ASN HB3 1 1 8 1696 1 1 2 ASN HD21 H 0.719 1.732 1.333 1.00 . A A . 2 ASN HD21 1 1 8 1697 1 1 2 ASN HD22 H -0.111 0.488 2.136 1.00 . A A . 2 ASN HD22 1 1 8 1698 1 1 2 ASN N N 3.087 0.344 0.511 1.00 . A A . 2 ASN N 1 1 8 1699 1 1 2 ASN ND2 N 0.697 1.030 2.016 1.00 . A A . 2 ASN ND2 1 1 8 1700 1 1 2 ASN O O 5.697 1.046 0.460 1.00 . A A . 2 ASN O 1 1 8 1701 1 1 2 ASN OD1 O 1.706 -0.044 3.646 1.00 . A A . 2 ASN OD1 1 1 8 1702 1 1 3 LEU C C 7.565 2.037 2.475 1.00 . A A . 3 LEU C 1 1 8 1703 1 1 3 LEU CA C 6.824 3.181 1.832 1.00 . A A . 3 LEU CA 1 1 8 1704 1 1 3 LEU CB C 7.024 4.431 2.661 1.00 . A A . 3 LEU CB 1 1 8 1705 1 1 3 LEU CD1 C 5.695 6.483 3.205 1.00 . A A . 3 LEU CD1 1 1 8 1706 1 1 3 LEU CD2 C 7.058 6.384 1.114 1.00 . A A . 3 LEU CD2 1 1 8 1707 1 1 3 LEU CG C 6.195 5.574 2.079 1.00 . A A . 3 LEU CG 1 1 8 1708 1 1 3 LEU H H 4.776 3.425 2.250 1.00 . A A . 3 LEU H 1 1 8 1709 1 1 3 LEU HA H 7.204 3.350 0.853 1.00 . A A . 3 LEU HA 1 1 8 1710 1 1 3 LEU HB2 H 6.699 4.222 3.653 1.00 . A A . 3 LEU HB2 1 1 8 1711 1 1 3 LEU HB3 H 8.069 4.704 2.665 1.00 . A A . 3 LEU HB3 1 1 8 1712 1 1 3 LEU HD11 H 4.628 6.618 3.104 1.00 . A A . 3 LEU HD11 1 1 8 1713 1 1 3 LEU HD12 H 6.185 7.443 3.140 1.00 . A A . 3 LEU HD12 1 1 8 1714 1 1 3 LEU HD13 H 5.911 6.034 4.164 1.00 . A A . 3 LEU HD13 1 1 8 1715 1 1 3 LEU HD21 H 7.947 6.723 1.624 1.00 . A A . 3 LEU HD21 1 1 8 1716 1 1 3 LEU HD22 H 6.499 7.237 0.762 1.00 . A A . 3 LEU HD22 1 1 8 1717 1 1 3 LEU HD23 H 7.338 5.765 0.274 1.00 . A A . 3 LEU HD23 1 1 8 1718 1 1 3 LEU HG H 5.347 5.170 1.548 1.00 . A A . 3 LEU HG 1 1 8 1719 1 1 3 LEU N N 5.414 2.863 1.765 1.00 . A A . 3 LEU N 1 1 8 1720 1 1 3 LEU O O 8.657 1.661 2.049 1.00 . A A . 3 LEU O 1 1 8 1721 1 1 4 LYS C C 7.891 -0.750 3.287 1.00 . A A . 4 LYS C 1 1 8 1722 1 1 4 LYS CA C 7.538 0.385 4.239 1.00 . A A . 4 LYS CA 1 1 8 1723 1 1 4 LYS CB C 6.547 -0.109 5.291 1.00 . A A . 4 LYS CB 1 1 8 1724 1 1 4 LYS CD C 7.728 0.418 7.445 1.00 . A A . 4 LYS CD 1 1 8 1725 1 1 4 LYS CE C 8.682 1.605 7.643 1.00 . A A . 4 LYS CE 1 1 8 1726 1 1 4 LYS CG C 6.582 0.821 6.509 1.00 . A A . 4 LYS CG 1 1 8 1727 1 1 4 LYS H H 6.088 1.848 3.807 1.00 . A A . 4 LYS H 1 1 8 1728 1 1 4 LYS HA H 8.429 0.731 4.730 1.00 . A A . 4 LYS HA 1 1 8 1729 1 1 4 LYS HB2 H 5.552 -0.105 4.865 1.00 . A A . 4 LYS HB2 1 1 8 1730 1 1 4 LYS HB3 H 6.803 -1.113 5.591 1.00 . A A . 4 LYS HB3 1 1 8 1731 1 1 4 LYS HD2 H 7.317 0.125 8.398 1.00 . A A . 4 LYS HD2 1 1 8 1732 1 1 4 LYS HD3 H 8.273 -0.412 7.017 1.00 . A A . 4 LYS HD3 1 1 8 1733 1 1 4 LYS HE2 H 9.325 1.700 6.781 1.00 . A A . 4 LYS HE2 1 1 8 1734 1 1 4 LYS HE3 H 8.109 2.514 7.768 1.00 . A A . 4 LYS HE3 1 1 8 1735 1 1 4 LYS HG2 H 6.727 1.840 6.181 1.00 . A A . 4 LYS HG2 1 1 8 1736 1 1 4 LYS HG3 H 5.645 0.745 7.040 1.00 . A A . 4 LYS HG3 1 1 8 1737 1 1 4 LYS HZ1 H 8.904 1.146 9.665 1.00 . A A . 4 LYS HZ1 1 1 8 1738 1 1 4 LYS HZ2 H 10.064 2.227 9.070 1.00 . A A . 4 LYS HZ2 1 1 8 1739 1 1 4 LYS HZ3 H 10.163 0.576 8.688 1.00 . A A . 4 LYS HZ3 1 1 8 1740 1 1 4 LYS N N 6.953 1.490 3.514 1.00 . A A . 4 LYS N 1 1 8 1741 1 1 4 LYS NZ N 9.513 1.370 8.857 1.00 . A A . 4 LYS NZ 1 1 8 1742 1 1 4 LYS O O 8.984 -1.316 3.353 1.00 . A A . 4 LYS O 1 1 8 1743 1 1 5 ALA C C 8.443 -1.795 0.596 1.00 . A A . 5 ALA C 1 1 8 1744 1 1 5 ALA CA C 7.215 -2.138 1.429 1.00 . A A . 5 ALA CA 1 1 8 1745 1 1 5 ALA CB C 6.000 -2.312 0.512 1.00 . A A . 5 ALA CB 1 1 8 1746 1 1 5 ALA H H 6.118 -0.591 2.378 1.00 . A A . 5 ALA H 1 1 8 1747 1 1 5 ALA HA H 7.393 -3.058 1.958 1.00 . A A . 5 ALA HA 1 1 8 1748 1 1 5 ALA HB1 H 5.916 -3.347 0.223 1.00 . A A . 5 ALA HB1 1 1 8 1749 1 1 5 ALA HB2 H 6.122 -1.700 -0.369 1.00 . A A . 5 ALA HB2 1 1 8 1750 1 1 5 ALA HB3 H 5.107 -2.010 1.039 1.00 . A A . 5 ALA HB3 1 1 8 1751 1 1 5 ALA N N 6.971 -1.075 2.393 1.00 . A A . 5 ALA N 1 1 8 1752 1 1 5 ALA O O 9.306 -2.640 0.362 1.00 . A A . 5 ALA O 1 1 8 1753 1 1 6 LEU C C 10.886 -0.002 0.233 1.00 . A A . 6 LEU C 1 1 8 1754 1 1 6 LEU CA C 9.633 -0.067 -0.621 1.00 . A A . 6 LEU CA 1 1 8 1755 1 1 6 LEU CB C 9.318 1.328 -1.144 1.00 . A A . 6 LEU CB 1 1 8 1756 1 1 6 LEU CD1 C 7.578 2.753 -2.223 1.00 . A A . 6 LEU CD1 1 1 8 1757 1 1 6 LEU CD2 C 8.100 0.482 -3.146 1.00 . A A . 6 LEU CD2 1 1 8 1758 1 1 6 LEU CG C 7.977 1.316 -1.869 1.00 . A A . 6 LEU CG 1 1 8 1759 1 1 6 LEU H H 7.801 0.086 0.401 1.00 . A A . 6 LEU H 1 1 8 1760 1 1 6 LEU HA H 9.793 -0.732 -1.453 1.00 . A A . 6 LEU HA 1 1 8 1761 1 1 6 LEU HB2 H 9.267 2.015 -0.310 1.00 . A A . 6 LEU HB2 1 1 8 1762 1 1 6 LEU HB3 H 10.092 1.642 -1.824 1.00 . A A . 6 LEU HB3 1 1 8 1763 1 1 6 LEU HD11 H 6.599 2.753 -2.677 1.00 . A A . 6 LEU HD11 1 1 8 1764 1 1 6 LEU HD12 H 8.297 3.167 -2.915 1.00 . A A . 6 LEU HD12 1 1 8 1765 1 1 6 LEU HD13 H 7.557 3.353 -1.325 1.00 . A A . 6 LEU HD13 1 1 8 1766 1 1 6 LEU HD21 H 9.033 0.715 -3.641 1.00 . A A . 6 LEU HD21 1 1 8 1767 1 1 6 LEU HD22 H 7.277 0.704 -3.803 1.00 . A A . 6 LEU HD22 1 1 8 1768 1 1 6 LEU HD23 H 8.084 -0.569 -2.890 1.00 . A A . 6 LEU HD23 1 1 8 1769 1 1 6 LEU HG H 7.225 0.884 -1.226 1.00 . A A . 6 LEU HG 1 1 8 1770 1 1 6 LEU N N 8.515 -0.543 0.168 1.00 . A A . 6 LEU N 1 1 8 1771 1 1 6 LEU O O 11.989 -0.314 -0.219 1.00 . A A . 6 LEU O 1 1 8 1772 1 1 7 ALA C C 12.556 -0.764 2.511 1.00 . A A . 7 ALA C 1 1 8 1773 1 1 7 ALA CA C 11.805 0.550 2.407 1.00 . A A . 7 ALA CA 1 1 8 1774 1 1 7 ALA CB C 11.291 0.957 3.790 1.00 . A A . 7 ALA CB 1 1 8 1775 1 1 7 ALA H H 9.786 0.661 1.758 1.00 . A A . 7 ALA H 1 1 8 1776 1 1 7 ALA HA H 12.473 1.305 2.045 1.00 . A A . 7 ALA HA 1 1 8 1777 1 1 7 ALA HB1 H 10.816 1.924 3.728 1.00 . A A . 7 ALA HB1 1 1 8 1778 1 1 7 ALA HB2 H 12.119 1.003 4.484 1.00 . A A . 7 ALA HB2 1 1 8 1779 1 1 7 ALA HB3 H 10.574 0.228 4.138 1.00 . A A . 7 ALA HB3 1 1 8 1780 1 1 7 ALA N N 10.695 0.418 1.473 1.00 . A A . 7 ALA N 1 1 8 1781 1 1 7 ALA O O 13.772 -0.784 2.690 1.00 . A A . 7 ALA O 1 1 8 1782 1 1 8 ALA C C 13.511 -3.289 1.356 1.00 . A A . 8 ALA C 1 1 8 1783 1 1 8 ALA CA C 12.453 -3.175 2.440 1.00 . A A . 8 ALA CA 1 1 8 1784 1 1 8 ALA CB C 11.405 -4.272 2.246 1.00 . A A . 8 ALA CB 1 1 8 1785 1 1 8 ALA H H 10.869 -1.786 2.218 1.00 . A A . 8 ALA H 1 1 8 1786 1 1 8 ALA HA H 12.920 -3.297 3.398 1.00 . A A . 8 ALA HA 1 1 8 1787 1 1 8 ALA HB1 H 10.694 -4.244 3.060 1.00 . A A . 8 ALA HB1 1 1 8 1788 1 1 8 ALA HB2 H 11.897 -5.233 2.229 1.00 . A A . 8 ALA HB2 1 1 8 1789 1 1 8 ALA HB3 H 10.893 -4.118 1.311 1.00 . A A . 8 ALA HB3 1 1 8 1790 1 1 8 ALA N N 11.830 -1.862 2.377 1.00 . A A . 8 ALA N 1 1 8 1791 1 1 8 ALA O O 14.642 -3.707 1.605 1.00 . A A . 8 ALA O 1 1 8 1792 1 1 9 LEU C C 15.065 -1.803 -0.827 1.00 . A A . 9 LEU C 1 1 8 1793 1 1 9 LEU CA C 14.033 -2.904 -0.985 1.00 . A A . 9 LEU CA 1 1 8 1794 1 1 9 LEU CB C 13.254 -2.684 -2.288 1.00 . A A . 9 LEU CB 1 1 8 1795 1 1 9 LEU CD1 C 11.064 -3.015 -3.464 1.00 . A A . 9 LEU CD1 1 1 8 1796 1 1 9 LEU CD2 C 11.888 -4.740 -1.859 1.00 . A A . 9 LEU CD2 1 1 8 1797 1 1 9 LEU CG C 11.827 -3.242 -2.159 1.00 . A A . 9 LEU CG 1 1 8 1798 1 1 9 LEU H H 12.222 -2.546 0.044 1.00 . A A . 9 LEU H 1 1 8 1799 1 1 9 LEU HA H 14.534 -3.858 -1.028 1.00 . A A . 9 LEU HA 1 1 8 1800 1 1 9 LEU HB2 H 13.209 -1.624 -2.503 1.00 . A A . 9 LEU HB2 1 1 8 1801 1 1 9 LEU HB3 H 13.765 -3.189 -3.096 1.00 . A A . 9 LEU HB3 1 1 8 1802 1 1 9 LEU HD11 H 10.132 -3.562 -3.438 1.00 . A A . 9 LEU HD11 1 1 8 1803 1 1 9 LEU HD12 H 11.658 -3.361 -4.294 1.00 . A A . 9 LEU HD12 1 1 8 1804 1 1 9 LEU HD13 H 10.858 -1.961 -3.582 1.00 . A A . 9 LEU HD13 1 1 8 1805 1 1 9 LEU HD21 H 11.996 -5.287 -2.786 1.00 . A A . 9 LEU HD21 1 1 8 1806 1 1 9 LEU HD22 H 10.977 -5.043 -1.363 1.00 . A A . 9 LEU HD22 1 1 8 1807 1 1 9 LEU HD23 H 12.732 -4.948 -1.218 1.00 . A A . 9 LEU HD23 1 1 8 1808 1 1 9 LEU HG H 11.309 -2.737 -1.358 1.00 . A A . 9 LEU HG 1 1 8 1809 1 1 9 LEU N N 13.128 -2.889 0.157 1.00 . A A . 9 LEU N 1 1 8 1810 1 1 9 LEU O O 16.263 -2.016 -0.999 1.00 . A A . 9 LEU O 1 1 8 1811 1 1 10 ALA C C 16.469 0.268 0.788 1.00 . A A . 10 ALA C 1 1 8 1812 1 1 10 ALA CA C 15.439 0.539 -0.301 1.00 . A A . 10 ALA CA 1 1 8 1813 1 1 10 ALA CB C 14.606 1.767 0.074 1.00 . A A . 10 ALA CB 1 1 8 1814 1 1 10 ALA H H 13.603 -0.522 -0.368 1.00 . A A . 10 ALA H 1 1 8 1815 1 1 10 ALA HA H 15.956 0.742 -1.229 1.00 . A A . 10 ALA HA 1 1 8 1816 1 1 10 ALA HB1 H 14.498 2.407 -0.791 1.00 . A A . 10 ALA HB1 1 1 8 1817 1 1 10 ALA HB2 H 15.102 2.309 0.866 1.00 . A A . 10 ALA HB2 1 1 8 1818 1 1 10 ALA HB3 H 13.628 1.451 0.410 1.00 . A A . 10 ALA HB3 1 1 8 1819 1 1 10 ALA N N 14.574 -0.618 -0.493 1.00 . A A . 10 ALA N 1 1 8 1820 1 1 10 ALA O O 17.595 0.750 0.717 1.00 . A A . 10 ALA O 1 1 8 1821 1 1 11 LYS C C 18.318 -1.309 2.417 1.00 . A A . 11 LYS C 1 1 8 1822 1 1 11 LYS CA C 16.973 -0.799 2.913 1.00 . A A . 11 LYS CA 1 1 8 1823 1 1 11 LYS CB C 16.337 -1.846 3.826 1.00 . A A . 11 LYS CB 1 1 8 1824 1 1 11 LYS CD C 15.393 -2.245 6.110 1.00 . A A . 11 LYS CD 1 1 8 1825 1 1 11 LYS CE C 15.864 -1.927 7.529 1.00 . A A . 11 LYS CE 1 1 8 1826 1 1 11 LYS CG C 15.949 -1.192 5.153 1.00 . A A . 11 LYS CG 1 1 8 1827 1 1 11 LYS H H 15.156 -0.844 1.816 1.00 . A A . 11 LYS H 1 1 8 1828 1 1 11 LYS HA H 17.130 0.094 3.482 1.00 . A A . 11 LYS HA 1 1 8 1829 1 1 11 LYS HB2 H 15.456 -2.237 3.350 1.00 . A A . 11 LYS HB2 1 1 8 1830 1 1 11 LYS HB3 H 17.038 -2.648 4.011 1.00 . A A . 11 LYS HB3 1 1 8 1831 1 1 11 LYS HD2 H 14.314 -2.234 6.071 1.00 . A A . 11 LYS HD2 1 1 8 1832 1 1 11 LYS HD3 H 15.755 -3.222 5.825 1.00 . A A . 11 LYS HD3 1 1 8 1833 1 1 11 LYS HE2 H 15.369 -2.583 8.225 1.00 . A A . 11 LYS HE2 1 1 8 1834 1 1 11 LYS HE3 H 16.931 -2.074 7.594 1.00 . A A . 11 LYS HE3 1 1 8 1835 1 1 11 LYS HG2 H 16.820 -0.736 5.597 1.00 . A A . 11 LYS HG2 1 1 8 1836 1 1 11 LYS HG3 H 15.196 -0.438 4.973 1.00 . A A . 11 LYS HG3 1 1 8 1837 1 1 11 LYS HZ1 H 14.797 -0.161 7.229 1.00 . A A . 11 LYS HZ1 1 1 8 1838 1 1 11 LYS HZ2 H 16.390 0.074 7.750 1.00 . A A . 11 LYS HZ2 1 1 8 1839 1 1 11 LYS HZ3 H 15.206 -0.454 8.848 1.00 . A A . 11 LYS HZ3 1 1 8 1840 1 1 11 LYS N N 16.075 -0.496 1.801 1.00 . A A . 11 LYS N 1 1 8 1841 1 1 11 LYS NZ N 15.540 -0.512 7.863 1.00 . A A . 11 LYS NZ 1 1 8 1842 1 1 11 LYS O O 19.347 -1.104 3.066 1.00 . A A . 11 LYS O 1 1 8 1843 1 1 12 LYS C C 20.337 -1.423 0.029 1.00 . A A . 12 LYS C 1 1 8 1844 1 1 12 LYS CA C 19.534 -2.516 0.720 1.00 . A A . 12 LYS CA 1 1 8 1845 1 1 12 LYS CB C 19.216 -3.637 -0.266 1.00 . A A . 12 LYS CB 1 1 8 1846 1 1 12 LYS CD C 17.363 -4.864 0.865 1.00 . A A . 12 LYS CD 1 1 8 1847 1 1 12 LYS CE C 16.589 -5.679 -0.168 1.00 . A A . 12 LYS CE 1 1 8 1848 1 1 12 LYS CG C 18.852 -4.901 0.516 1.00 . A A . 12 LYS CG 1 1 8 1849 1 1 12 LYS H H 17.460 -2.114 0.812 1.00 . A A . 12 LYS H 1 1 8 1850 1 1 12 LYS HA H 20.122 -2.923 1.523 1.00 . A A . 12 LYS HA 1 1 8 1851 1 1 12 LYS HB2 H 18.385 -3.342 -0.894 1.00 . A A . 12 LYS HB2 1 1 8 1852 1 1 12 LYS HB3 H 20.084 -3.832 -0.879 1.00 . A A . 12 LYS HB3 1 1 8 1853 1 1 12 LYS HD2 H 17.210 -5.278 1.849 1.00 . A A . 12 LYS HD2 1 1 8 1854 1 1 12 LYS HD3 H 17.010 -3.843 0.852 1.00 . A A . 12 LYS HD3 1 1 8 1855 1 1 12 LYS HE2 H 15.559 -5.368 -0.176 1.00 . A A . 12 LYS HE2 1 1 8 1856 1 1 12 LYS HE3 H 17.022 -5.514 -1.146 1.00 . A A . 12 LYS HE3 1 1 8 1857 1 1 12 LYS HG2 H 19.063 -5.770 -0.092 1.00 . A A . 12 LYS HG2 1 1 8 1858 1 1 12 LYS HG3 H 19.434 -4.950 1.425 1.00 . A A . 12 LYS HG3 1 1 8 1859 1 1 12 LYS HZ1 H 17.481 -7.554 -0.333 1.00 . A A . 12 LYS HZ1 1 1 8 1860 1 1 12 LYS HZ2 H 15.799 -7.609 -0.114 1.00 . A A . 12 LYS HZ2 1 1 8 1861 1 1 12 LYS HZ3 H 16.819 -7.239 1.198 1.00 . A A . 12 LYS HZ3 1 1 8 1862 1 1 12 LYS N N 18.307 -1.978 1.280 1.00 . A A . 12 LYS N 1 1 8 1863 1 1 12 LYS NZ N 16.677 -7.126 0.172 1.00 . A A . 12 LYS NZ 1 1 8 1864 1 1 12 LYS O O 21.568 -1.430 0.067 1.00 . A A . 12 LYS O 1 1 8 1865 1 1 13 ILE C C 20.549 1.761 -0.344 1.00 . A A . 13 ILE C 1 1 8 1866 1 1 13 ILE CA C 20.279 0.610 -1.303 1.00 . A A . 13 ILE CA 1 1 8 1867 1 1 13 ILE CB C 19.394 1.101 -2.447 1.00 . A A . 13 ILE CB 1 1 8 1868 1 1 13 ILE CD1 C 19.887 -0.809 -4.005 1.00 . A A . 13 ILE CD1 1 1 8 1869 1 1 13 ILE CG1 C 18.798 -0.092 -3.200 1.00 . A A . 13 ILE CG1 1 1 8 1870 1 1 13 ILE CG2 C 20.225 1.953 -3.409 1.00 . A A . 13 ILE CG2 1 1 8 1871 1 1 13 ILE H H 18.656 -0.536 -0.589 1.00 . A A . 13 ILE H 1 1 8 1872 1 1 13 ILE HA H 21.203 0.264 -1.710 1.00 . A A . 13 ILE HA 1 1 8 1873 1 1 13 ILE HB H 18.601 1.699 -2.040 1.00 . A A . 13 ILE HB 1 1 8 1874 1 1 13 ILE HD11 H 20.193 -0.183 -4.833 1.00 . A A . 13 ILE HD11 1 1 8 1875 1 1 13 ILE HD12 H 19.498 -1.742 -4.382 1.00 . A A . 13 ILE HD12 1 1 8 1876 1 1 13 ILE HD13 H 20.738 -1.005 -3.368 1.00 . A A . 13 ILE HD13 1 1 8 1877 1 1 13 ILE HG12 H 18.361 -0.783 -2.494 1.00 . A A . 13 ILE HG12 1 1 8 1878 1 1 13 ILE HG13 H 18.033 0.259 -3.877 1.00 . A A . 13 ILE HG13 1 1 8 1879 1 1 13 ILE HG21 H 20.361 2.941 -2.992 1.00 . A A . 13 ILE HG21 1 1 8 1880 1 1 13 ILE HG22 H 19.714 2.029 -4.356 1.00 . A A . 13 ILE HG22 1 1 8 1881 1 1 13 ILE HG23 H 21.191 1.490 -3.556 1.00 . A A . 13 ILE HG23 1 1 8 1882 1 1 13 ILE N N 19.631 -0.488 -0.601 1.00 . A A . 13 ILE N 1 1 8 1883 1 1 13 ILE O O 21.599 2.401 -0.402 1.00 . A A . 13 ILE O 1 1 8 1884 1 1 14 LEU C C 20.108 2.521 2.858 1.00 . A A . 14 LEU C 1 1 8 1885 1 1 14 LEU CA C 19.704 3.088 1.504 1.00 . A A . 14 LEU CA 1 1 8 1886 1 1 14 LEU CB C 18.363 3.813 1.633 1.00 . A A . 14 LEU CB 1 1 8 1887 1 1 14 LEU CD1 C 18.036 4.151 -0.835 1.00 . A A . 14 LEU CD1 1 1 8 1888 1 1 14 LEU CD2 C 17.029 5.750 0.796 1.00 . A A . 14 LEU CD2 1 1 8 1889 1 1 14 LEU CG C 18.230 4.852 0.515 1.00 . A A . 14 LEU CG 1 1 8 1890 1 1 14 LEU H H 18.769 1.477 0.521 1.00 . A A . 14 LEU H 1 1 8 1891 1 1 14 LEU HA H 20.454 3.789 1.170 1.00 . A A . 14 LEU HA 1 1 8 1892 1 1 14 LEU HB2 H 17.560 3.093 1.557 1.00 . A A . 14 LEU HB2 1 1 8 1893 1 1 14 LEU HB3 H 18.314 4.307 2.590 1.00 . A A . 14 LEU HB3 1 1 8 1894 1 1 14 LEU HD11 H 17.514 3.216 -0.687 1.00 . A A . 14 LEU HD11 1 1 8 1895 1 1 14 LEU HD12 H 18.999 3.960 -1.284 1.00 . A A . 14 LEU HD12 1 1 8 1896 1 1 14 LEU HD13 H 17.455 4.786 -1.489 1.00 . A A . 14 LEU HD13 1 1 8 1897 1 1 14 LEU HD21 H 16.156 5.139 0.973 1.00 . A A . 14 LEU HD21 1 1 8 1898 1 1 14 LEU HD22 H 16.856 6.393 -0.057 1.00 . A A . 14 LEU HD22 1 1 8 1899 1 1 14 LEU HD23 H 17.230 6.355 1.668 1.00 . A A . 14 LEU HD23 1 1 8 1900 1 1 14 LEU HG H 19.125 5.454 0.480 1.00 . A A . 14 LEU HG 1 1 8 1901 1 1 14 LEU N N 19.587 2.019 0.532 1.00 . A A . 14 LEU N 1 1 8 1902 1 1 14 LEU O O 21.296 2.407 3.161 1.00 . A A . 14 LEU O 1 1 8 1903 1 1 15 NH2 HN1 H 18.240 2.239 3.454 1.00 . A A . 15 NH2 HN1 1 1 8 1904 1 1 15 NH2 N N 19.184 2.148 3.696 1.00 . A A . 15 NH2 N 1 1 9 1905 1 1 1 ILE C C 3.859 -0.937 -1.453 1.00 . A A . 1 ILE C 1 1 9 1906 1 1 1 ILE CA C 3.998 -2.389 -1.887 1.00 . A A . 1 ILE CA 1 1 9 1907 1 1 1 ILE CB C 3.395 -2.554 -3.283 1.00 . A A . 1 ILE CB 1 1 9 1908 1 1 1 ILE CD1 C 0.967 -3.219 -3.512 1.00 . A A . 1 ILE CD1 1 1 9 1909 1 1 1 ILE CG1 C 1.934 -2.055 -3.273 1.00 . A A . 1 ILE CG1 1 1 9 1910 1 1 1 ILE CG2 C 3.461 -4.028 -3.710 1.00 . A A . 1 ILE CG2 1 1 9 1911 1 1 1 ILE H1 H 2.249 -3.054 -0.981 1.00 . A A . 1 ILE H1 1 1 9 1912 1 1 1 ILE H2 H 3.612 -3.101 0.028 1.00 . A A . 1 ILE H2 1 1 9 1913 1 1 1 ILE H3 H 3.423 -4.259 -1.195 1.00 . A A . 1 ILE H3 1 1 9 1914 1 1 1 ILE HA H 5.039 -2.669 -1.907 1.00 . A A . 1 ILE HA 1 1 9 1915 1 1 1 ILE HB H 3.968 -1.962 -3.982 1.00 . A A . 1 ILE HB 1 1 9 1916 1 1 1 ILE HD11 H 1.146 -3.996 -2.785 1.00 . A A . 1 ILE HD11 1 1 9 1917 1 1 1 ILE HD12 H 1.120 -3.613 -4.508 1.00 . A A . 1 ILE HD12 1 1 9 1918 1 1 1 ILE HD13 H -0.051 -2.866 -3.421 1.00 . A A . 1 ILE HD13 1 1 9 1919 1 1 1 ILE HG12 H 1.713 -1.589 -2.317 1.00 . A A . 1 ILE HG12 1 1 9 1920 1 1 1 ILE HG13 H 1.806 -1.327 -4.063 1.00 . A A . 1 ILE HG13 1 1 9 1921 1 1 1 ILE HG21 H 4.486 -4.372 -3.654 1.00 . A A . 1 ILE HG21 1 1 9 1922 1 1 1 ILE HG22 H 3.106 -4.123 -4.727 1.00 . A A . 1 ILE HG22 1 1 9 1923 1 1 1 ILE HG23 H 2.843 -4.625 -3.056 1.00 . A A . 1 ILE HG23 1 1 9 1924 1 1 1 ILE N N 3.266 -3.264 -0.935 1.00 . A A . 1 ILE N 1 1 9 1925 1 1 1 ILE O O 3.688 -0.044 -2.287 1.00 . A A . 1 ILE O 1 1 9 1926 1 1 2 ASN C C 5.037 1.215 0.890 1.00 . A A . 2 ASN C 1 1 9 1927 1 1 2 ASN CA C 3.726 0.652 0.360 1.00 . A A . 2 ASN CA 1 1 9 1928 1 1 2 ASN CB C 2.653 0.641 1.442 1.00 . A A . 2 ASN CB 1 1 9 1929 1 1 2 ASN CG C 1.565 -0.351 1.063 1.00 . A A . 2 ASN CG 1 1 9 1930 1 1 2 ASN H H 4.007 -1.445 0.474 1.00 . A A . 2 ASN H 1 1 9 1931 1 1 2 ASN HA H 3.388 1.291 -0.445 1.00 . A A . 2 ASN HA 1 1 9 1932 1 1 2 ASN HB2 H 3.093 0.343 2.378 1.00 . A A . 2 ASN HB2 1 1 9 1933 1 1 2 ASN HB3 H 2.224 1.625 1.534 1.00 . A A . 2 ASN HB3 1 1 9 1934 1 1 2 ASN HD21 H 1.584 0.132 -0.864 1.00 . A A . 2 ASN HD21 1 1 9 1935 1 1 2 ASN HD22 H 0.493 -1.097 -0.430 1.00 . A A . 2 ASN HD22 1 1 9 1936 1 1 2 ASN N N 3.893 -0.701 -0.154 1.00 . A A . 2 ASN N 1 1 9 1937 1 1 2 ASN ND2 N 1.178 -0.442 -0.178 1.00 . A A . 2 ASN ND2 1 1 9 1938 1 1 2 ASN O O 6.109 0.679 0.615 1.00 . A A . 2 ASN O 1 1 9 1939 1 1 2 ASN OD1 O 1.056 -1.069 1.922 1.00 . A A . 2 ASN OD1 1 1 9 1940 1 1 3 LEU C C 6.908 1.973 3.043 1.00 . A A . 3 LEU C 1 1 9 1941 1 1 3 LEU CA C 6.121 2.945 2.200 1.00 . A A . 3 LEU CA 1 1 9 1942 1 1 3 LEU CB C 5.671 4.104 3.072 1.00 . A A . 3 LEU CB 1 1 9 1943 1 1 3 LEU CD1 C 5.356 6.572 3.127 1.00 . A A . 3 LEU CD1 1 1 9 1944 1 1 3 LEU CD2 C 7.579 5.603 2.494 1.00 . A A . 3 LEU CD2 1 1 9 1945 1 1 3 LEU CG C 6.059 5.419 2.407 1.00 . A A . 3 LEU CG 1 1 9 1946 1 1 3 LEU H H 4.067 2.677 1.843 1.00 . A A . 3 LEU H 1 1 9 1947 1 1 3 LEU HA H 6.737 3.320 1.407 1.00 . A A . 3 LEU HA 1 1 9 1948 1 1 3 LEU HB2 H 4.603 4.060 3.184 1.00 . A A . 3 LEU HB2 1 1 9 1949 1 1 3 LEU HB3 H 6.141 4.035 4.043 1.00 . A A . 3 LEU HB3 1 1 9 1950 1 1 3 LEU HD11 H 5.270 6.340 4.180 1.00 . A A . 3 LEU HD11 1 1 9 1951 1 1 3 LEU HD12 H 4.370 6.710 2.710 1.00 . A A . 3 LEU HD12 1 1 9 1952 1 1 3 LEU HD13 H 5.931 7.478 3.006 1.00 . A A . 3 LEU HD13 1 1 9 1953 1 1 3 LEU HD21 H 8.005 5.557 1.504 1.00 . A A . 3 LEU HD21 1 1 9 1954 1 1 3 LEU HD22 H 8.006 4.817 3.106 1.00 . A A . 3 LEU HD22 1 1 9 1955 1 1 3 LEU HD23 H 7.799 6.560 2.938 1.00 . A A . 3 LEU HD23 1 1 9 1956 1 1 3 LEU HG H 5.753 5.400 1.370 1.00 . A A . 3 LEU HG 1 1 9 1957 1 1 3 LEU N N 4.943 2.300 1.648 1.00 . A A . 3 LEU N 1 1 9 1958 1 1 3 LEU O O 8.130 1.862 2.932 1.00 . A A . 3 LEU O 1 1 9 1959 1 1 4 LYS C C 7.585 -0.713 3.928 1.00 . A A . 4 LYS C 1 1 9 1960 1 1 4 LYS CA C 6.786 0.291 4.751 1.00 . A A . 4 LYS CA 1 1 9 1961 1 1 4 LYS CB C 5.706 -0.434 5.549 1.00 . A A . 4 LYS CB 1 1 9 1962 1 1 4 LYS CD C 4.054 -0.182 7.413 1.00 . A A . 4 LYS CD 1 1 9 1963 1 1 4 LYS CE C 3.563 0.762 8.514 1.00 . A A . 4 LYS CE 1 1 9 1964 1 1 4 LYS CG C 5.265 0.441 6.725 1.00 . A A . 4 LYS CG 1 1 9 1965 1 1 4 LYS H H 5.218 1.413 3.913 1.00 . A A . 4 LYS H 1 1 9 1966 1 1 4 LYS HA H 7.442 0.803 5.430 1.00 . A A . 4 LYS HA 1 1 9 1967 1 1 4 LYS HB2 H 4.860 -0.628 4.902 1.00 . A A . 4 LYS HB2 1 1 9 1968 1 1 4 LYS HB3 H 6.100 -1.365 5.917 1.00 . A A . 4 LYS HB3 1 1 9 1969 1 1 4 LYS HD2 H 3.266 -0.329 6.685 1.00 . A A . 4 LYS HD2 1 1 9 1970 1 1 4 LYS HD3 H 4.330 -1.136 7.845 1.00 . A A . 4 LYS HD3 1 1 9 1971 1 1 4 LYS HE2 H 3.647 1.778 8.171 1.00 . A A . 4 LYS HE2 1 1 9 1972 1 1 4 LYS HE3 H 2.528 0.546 8.742 1.00 . A A . 4 LYS HE3 1 1 9 1973 1 1 4 LYS HG2 H 6.076 0.522 7.433 1.00 . A A . 4 LYS HG2 1 1 9 1974 1 1 4 LYS HG3 H 5.005 1.423 6.362 1.00 . A A . 4 LYS HG3 1 1 9 1975 1 1 4 LYS HZ1 H 5.159 1.298 9.744 1.00 . A A . 4 LYS HZ1 1 1 9 1976 1 1 4 LYS HZ2 H 4.798 -0.362 9.767 1.00 . A A . 4 LYS HZ2 1 1 9 1977 1 1 4 LYS HZ3 H 3.793 0.741 10.580 1.00 . A A . 4 LYS HZ3 1 1 9 1978 1 1 4 LYS N N 6.181 1.267 3.881 1.00 . A A . 4 LYS N 1 1 9 1979 1 1 4 LYS NZ N 4.392 0.595 9.741 1.00 . A A . 4 LYS NZ 1 1 9 1980 1 1 4 LYS O O 8.719 -1.052 4.271 1.00 . A A . 4 LYS O 1 1 9 1981 1 1 5 ALA C C 8.769 -1.485 1.208 1.00 . A A . 5 ALA C 1 1 9 1982 1 1 5 ALA CA C 7.609 -2.135 1.948 1.00 . A A . 5 ALA CA 1 1 9 1983 1 1 5 ALA CB C 6.605 -2.668 0.926 1.00 . A A . 5 ALA CB 1 1 9 1984 1 1 5 ALA H H 6.069 -0.859 2.636 1.00 . A A . 5 ALA H 1 1 9 1985 1 1 5 ALA HA H 7.983 -2.964 2.532 1.00 . A A . 5 ALA HA 1 1 9 1986 1 1 5 ALA HB1 H 5.743 -3.066 1.439 1.00 . A A . 5 ALA HB1 1 1 9 1987 1 1 5 ALA HB2 H 7.068 -3.449 0.340 1.00 . A A . 5 ALA HB2 1 1 9 1988 1 1 5 ALA HB3 H 6.298 -1.865 0.274 1.00 . A A . 5 ALA HB3 1 1 9 1989 1 1 5 ALA N N 6.970 -1.177 2.841 1.00 . A A . 5 ALA N 1 1 9 1990 1 1 5 ALA O O 9.837 -2.079 1.077 1.00 . A A . 5 ALA O 1 1 9 1991 1 1 6 LEU C C 10.854 0.542 0.822 1.00 . A A . 6 LEU C 1 1 9 1992 1 1 6 LEU CA C 9.592 0.451 -0.014 1.00 . A A . 6 LEU CA 1 1 9 1993 1 1 6 LEU CB C 9.114 1.862 -0.324 1.00 . A A . 6 LEU CB 1 1 9 1994 1 1 6 LEU CD1 C 7.225 3.097 -1.364 1.00 . A A . 6 LEU CD1 1 1 9 1995 1 1 6 LEU CD2 C 8.735 1.684 -2.781 1.00 . A A . 6 LEU CD2 1 1 9 1996 1 1 6 LEU CG C 8.053 1.817 -1.418 1.00 . A A . 6 LEU CG 1 1 9 1997 1 1 6 LEU H H 7.676 0.164 0.850 1.00 . A A . 6 LEU H 1 1 9 1998 1 1 6 LEU HA H 9.804 -0.063 -0.939 1.00 . A A . 6 LEU HA 1 1 9 1999 1 1 6 LEU HB2 H 8.692 2.297 0.571 1.00 . A A . 6 LEU HB2 1 1 9 2000 1 1 6 LEU HB3 H 9.949 2.459 -0.657 1.00 . A A . 6 LEU HB3 1 1 9 2001 1 1 6 LEU HD11 H 6.422 2.968 -0.656 1.00 . A A . 6 LEU HD11 1 1 9 2002 1 1 6 LEU HD12 H 6.815 3.300 -2.340 1.00 . A A . 6 LEU HD12 1 1 9 2003 1 1 6 LEU HD13 H 7.850 3.922 -1.054 1.00 . A A . 6 LEU HD13 1 1 9 2004 1 1 6 LEU HD21 H 7.985 1.524 -3.543 1.00 . A A . 6 LEU HD21 1 1 9 2005 1 1 6 LEU HD22 H 9.410 0.841 -2.760 1.00 . A A . 6 LEU HD22 1 1 9 2006 1 1 6 LEU HD23 H 9.289 2.586 -3.000 1.00 . A A . 6 LEU HD23 1 1 9 2007 1 1 6 LEU HG H 7.402 0.969 -1.254 1.00 . A A . 6 LEU HG 1 1 9 2008 1 1 6 LEU N N 8.553 -0.263 0.722 1.00 . A A . 6 LEU N 1 1 9 2009 1 1 6 LEU O O 11.961 0.318 0.328 1.00 . A A . 6 LEU O 1 1 9 2010 1 1 7 ALA C C 12.604 -0.326 2.995 1.00 . A A . 7 ALA C 1 1 9 2011 1 1 7 ALA CA C 11.815 0.976 2.999 1.00 . A A . 7 ALA CA 1 1 9 2012 1 1 7 ALA CB C 11.331 1.273 4.421 1.00 . A A . 7 ALA CB 1 1 9 2013 1 1 7 ALA H H 9.765 1.035 2.420 1.00 . A A . 7 ALA H 1 1 9 2014 1 1 7 ALA HA H 12.450 1.778 2.670 1.00 . A A . 7 ALA HA 1 1 9 2015 1 1 7 ALA HB1 H 10.564 0.564 4.694 1.00 . A A . 7 ALA HB1 1 1 9 2016 1 1 7 ALA HB2 H 10.928 2.274 4.462 1.00 . A A . 7 ALA HB2 1 1 9 2017 1 1 7 ALA HB3 H 12.160 1.190 5.108 1.00 . A A . 7 ALA HB3 1 1 9 2018 1 1 7 ALA N N 10.678 0.865 2.091 1.00 . A A . 7 ALA N 1 1 9 2019 1 1 7 ALA O O 13.838 -0.322 3.025 1.00 . A A . 7 ALA O 1 1 9 2020 1 1 8 ALA C C 13.417 -2.872 1.701 1.00 . A A . 8 ALA C 1 1 9 2021 1 1 8 ALA CA C 12.513 -2.751 2.917 1.00 . A A . 8 ALA CA 1 1 9 2022 1 1 8 ALA CB C 11.450 -3.849 2.878 1.00 . A A . 8 ALA CB 1 1 9 2023 1 1 8 ALA H H 10.903 -1.368 2.906 1.00 . A A . 8 ALA H 1 1 9 2024 1 1 8 ALA HA H 13.107 -2.871 3.801 1.00 . A A . 8 ALA HA 1 1 9 2025 1 1 8 ALA HB1 H 11.112 -3.991 1.861 1.00 . A A . 8 ALA HB1 1 1 9 2026 1 1 8 ALA HB2 H 10.613 -3.561 3.498 1.00 . A A . 8 ALA HB2 1 1 9 2027 1 1 8 ALA HB3 H 11.873 -4.772 3.248 1.00 . A A . 8 ALA HB3 1 1 9 2028 1 1 8 ALA N N 11.881 -1.438 2.937 1.00 . A A . 8 ALA N 1 1 9 2029 1 1 8 ALA O O 14.561 -3.319 1.794 1.00 . A A . 8 ALA O 1 1 9 2030 1 1 9 LEU C C 14.762 -1.451 -0.618 1.00 . A A . 9 LEU C 1 1 9 2031 1 1 9 LEU CA C 13.657 -2.489 -0.681 1.00 . A A . 9 LEU CA 1 1 9 2032 1 1 9 LEU CB C 12.745 -2.182 -1.876 1.00 . A A . 9 LEU CB 1 1 9 2033 1 1 9 LEU CD1 C 10.453 -2.471 -2.830 1.00 . A A . 9 LEU CD1 1 1 9 2034 1 1 9 LEU CD2 C 11.474 -4.274 -1.441 1.00 . A A . 9 LEU CD2 1 1 9 2035 1 1 9 LEU CG C 11.355 -2.768 -1.631 1.00 . A A . 9 LEU CG 1 1 9 2036 1 1 9 LEU H H 11.985 -2.091 0.564 1.00 . A A . 9 LEU H 1 1 9 2037 1 1 9 LEU HA H 14.090 -3.469 -0.807 1.00 . A A . 9 LEU HA 1 1 9 2038 1 1 9 LEU HB2 H 12.666 -1.112 -2.002 1.00 . A A . 9 LEU HB2 1 1 9 2039 1 1 9 LEU HB3 H 13.166 -2.618 -2.769 1.00 . A A . 9 LEU HB3 1 1 9 2040 1 1 9 LEU HD11 H 10.117 -3.400 -3.269 1.00 . A A . 9 LEU HD11 1 1 9 2041 1 1 9 LEU HD12 H 11.001 -1.902 -3.567 1.00 . A A . 9 LEU HD12 1 1 9 2042 1 1 9 LEU HD13 H 9.597 -1.903 -2.499 1.00 . A A . 9 LEU HD13 1 1 9 2043 1 1 9 LEU HD21 H 12.069 -4.686 -2.241 1.00 . A A . 9 LEU HD21 1 1 9 2044 1 1 9 LEU HD22 H 10.489 -4.717 -1.459 1.00 . A A . 9 LEU HD22 1 1 9 2045 1 1 9 LEU HD23 H 11.948 -4.481 -0.494 1.00 . A A . 9 LEU HD23 1 1 9 2046 1 1 9 LEU HG H 10.926 -2.327 -0.745 1.00 . A A . 9 LEU HG 1 1 9 2047 1 1 9 LEU N N 12.895 -2.449 0.561 1.00 . A A . 9 LEU N 1 1 9 2048 1 1 9 LEU O O 15.922 -1.730 -0.922 1.00 . A A . 9 LEU O 1 1 9 2049 1 1 10 ALA C C 16.517 0.415 0.805 1.00 . A A . 10 ALA C 1 1 9 2050 1 1 10 ALA CA C 15.349 0.837 -0.082 1.00 . A A . 10 ALA CA 1 1 9 2051 1 1 10 ALA CB C 14.669 2.070 0.515 1.00 . A A . 10 ALA CB 1 1 9 2052 1 1 10 ALA H H 13.443 -0.102 0.032 1.00 . A A . 10 ALA H 1 1 9 2053 1 1 10 ALA HA H 15.725 1.084 -1.067 1.00 . A A . 10 ALA HA 1 1 9 2054 1 1 10 ALA HB1 H 15.398 2.857 0.641 1.00 . A A . 10 ALA HB1 1 1 9 2055 1 1 10 ALA HB2 H 14.247 1.815 1.475 1.00 . A A . 10 ALA HB2 1 1 9 2056 1 1 10 ALA HB3 H 13.885 2.407 -0.146 1.00 . A A . 10 ALA HB3 1 1 9 2057 1 1 10 ALA N N 14.390 -0.254 -0.203 1.00 . A A . 10 ALA N 1 1 9 2058 1 1 10 ALA O O 17.665 0.803 0.568 1.00 . A A . 10 ALA O 1 1 9 2059 1 1 11 LYS C C 18.409 -1.463 1.983 1.00 . A A . 11 LYS C 1 1 9 2060 1 1 11 LYS CA C 17.249 -0.845 2.750 1.00 . A A . 11 LYS CA 1 1 9 2061 1 1 11 LYS CB C 16.654 -1.882 3.709 1.00 . A A . 11 LYS CB 1 1 9 2062 1 1 11 LYS CD C 16.938 -2.940 5.964 1.00 . A A . 11 LYS CD 1 1 9 2063 1 1 11 LYS CE C 18.193 -3.430 6.688 1.00 . A A . 11 LYS CE 1 1 9 2064 1 1 11 LYS CG C 17.308 -1.742 5.086 1.00 . A A . 11 LYS CG 1 1 9 2065 1 1 11 LYS H H 15.286 -0.652 1.971 1.00 . A A . 11 LYS H 1 1 9 2066 1 1 11 LYS HA H 17.615 -0.007 3.324 1.00 . A A . 11 LYS HA 1 1 9 2067 1 1 11 LYS HB2 H 15.590 -1.722 3.794 1.00 . A A . 11 LYS HB2 1 1 9 2068 1 1 11 LYS HB3 H 16.838 -2.877 3.326 1.00 . A A . 11 LYS HB3 1 1 9 2069 1 1 11 LYS HD2 H 16.190 -2.645 6.690 1.00 . A A . 11 LYS HD2 1 1 9 2070 1 1 11 LYS HD3 H 16.548 -3.734 5.347 1.00 . A A . 11 LYS HD3 1 1 9 2071 1 1 11 LYS HE2 H 17.908 -4.011 7.549 1.00 . A A . 11 LYS HE2 1 1 9 2072 1 1 11 LYS HE3 H 18.777 -4.044 6.019 1.00 . A A . 11 LYS HE3 1 1 9 2073 1 1 11 LYS HG2 H 18.381 -1.704 4.973 1.00 . A A . 11 LYS HG2 1 1 9 2074 1 1 11 LYS HG3 H 16.965 -0.831 5.558 1.00 . A A . 11 LYS HG3 1 1 9 2075 1 1 11 LYS HZ1 H 19.902 -2.250 6.598 1.00 . A A . 11 LYS HZ1 1 1 9 2076 1 1 11 LYS HZ2 H 19.202 -2.335 8.145 1.00 . A A . 11 LYS HZ2 1 1 9 2077 1 1 11 LYS HZ3 H 18.488 -1.383 6.939 1.00 . A A . 11 LYS HZ3 1 1 9 2078 1 1 11 LYS N N 16.218 -0.375 1.831 1.00 . A A . 11 LYS N 1 1 9 2079 1 1 11 LYS NZ N 19.005 -2.263 7.122 1.00 . A A . 11 LYS NZ 1 1 9 2080 1 1 11 LYS O O 19.568 -1.382 2.398 1.00 . A A . 11 LYS O 1 1 9 2081 1 1 12 LYS C C 19.830 -1.683 -0.809 1.00 . A A . 12 LYS C 1 1 9 2082 1 1 12 LYS CA C 19.098 -2.718 0.035 1.00 . A A . 12 LYS CA 1 1 9 2083 1 1 12 LYS CB C 18.442 -3.773 -0.853 1.00 . A A . 12 LYS CB 1 1 9 2084 1 1 12 LYS CD C 16.897 -4.870 0.767 1.00 . A A . 12 LYS CD 1 1 9 2085 1 1 12 LYS CE C 15.758 -5.476 -0.043 1.00 . A A . 12 LYS CE 1 1 9 2086 1 1 12 LYS CG C 18.194 -5.034 -0.023 1.00 . A A . 12 LYS CG 1 1 9 2087 1 1 12 LYS H H 17.152 -2.115 0.581 1.00 . A A . 12 LYS H 1 1 9 2088 1 1 12 LYS HA H 19.811 -3.204 0.680 1.00 . A A . 12 LYS HA 1 1 9 2089 1 1 12 LYS HB2 H 17.501 -3.397 -1.231 1.00 . A A . 12 LYS HB2 1 1 9 2090 1 1 12 LYS HB3 H 19.091 -4.009 -1.678 1.00 . A A . 12 LYS HB3 1 1 9 2091 1 1 12 LYS HD2 H 16.980 -5.371 1.722 1.00 . A A . 12 LYS HD2 1 1 9 2092 1 1 12 LYS HD3 H 16.703 -3.820 0.930 1.00 . A A . 12 LYS HD3 1 1 9 2093 1 1 12 LYS HE2 H 14.812 -5.222 0.408 1.00 . A A . 12 LYS HE2 1 1 9 2094 1 1 12 LYS HE3 H 15.797 -5.086 -1.051 1.00 . A A . 12 LYS HE3 1 1 9 2095 1 1 12 LYS HG2 H 18.113 -5.882 -0.685 1.00 . A A . 12 LYS HG2 1 1 9 2096 1 1 12 LYS HG3 H 19.016 -5.191 0.663 1.00 . A A . 12 LYS HG3 1 1 9 2097 1 1 12 LYS HZ1 H 15.712 -7.301 -1.041 1.00 . A A . 12 LYS HZ1 1 1 9 2098 1 1 12 LYS HZ2 H 15.256 -7.396 0.590 1.00 . A A . 12 LYS HZ2 1 1 9 2099 1 1 12 LYS HZ3 H 16.890 -7.209 0.170 1.00 . A A . 12 LYS HZ3 1 1 9 2100 1 1 12 LYS N N 18.088 -2.086 0.861 1.00 . A A . 12 LYS N 1 1 9 2101 1 1 12 LYS NZ N 15.916 -6.956 -0.083 1.00 . A A . 12 LYS NZ 1 1 9 2102 1 1 12 LYS O O 20.986 -1.885 -1.191 1.00 . A A . 12 LYS O 1 1 9 2103 1 1 13 ILE C C 20.605 1.385 -0.975 1.00 . A A . 13 ILE C 1 1 9 2104 1 1 13 ILE CA C 19.765 0.488 -1.875 1.00 . A A . 13 ILE CA 1 1 9 2105 1 1 13 ILE CB C 18.682 1.316 -2.570 1.00 . A A . 13 ILE CB 1 1 9 2106 1 1 13 ILE CD1 C 18.257 -0.520 -4.238 1.00 . A A . 13 ILE CD1 1 1 9 2107 1 1 13 ILE CG1 C 17.620 0.383 -3.174 1.00 . A A . 13 ILE CG1 1 1 9 2108 1 1 13 ILE CG2 C 19.310 2.162 -3.686 1.00 . A A . 13 ILE CG2 1 1 9 2109 1 1 13 ILE H H 18.249 -0.464 -0.757 1.00 . A A . 13 ILE H 1 1 9 2110 1 1 13 ILE HA H 20.395 0.050 -2.619 1.00 . A A . 13 ILE HA 1 1 9 2111 1 1 13 ILE HB H 18.223 1.965 -1.847 1.00 . A A . 13 ILE HB 1 1 9 2112 1 1 13 ILE HD11 H 18.473 -1.487 -3.807 1.00 . A A . 13 ILE HD11 1 1 9 2113 1 1 13 ILE HD12 H 19.175 -0.072 -4.594 1.00 . A A . 13 ILE HD12 1 1 9 2114 1 1 13 ILE HD13 H 17.572 -0.640 -5.063 1.00 . A A . 13 ILE HD13 1 1 9 2115 1 1 13 ILE HG12 H 17.191 -0.228 -2.395 1.00 . A A . 13 ILE HG12 1 1 9 2116 1 1 13 ILE HG13 H 16.842 0.977 -3.632 1.00 . A A . 13 ILE HG13 1 1 9 2117 1 1 13 ILE HG21 H 20.176 2.687 -3.303 1.00 . A A . 13 ILE HG21 1 1 9 2118 1 1 13 ILE HG22 H 18.586 2.878 -4.045 1.00 . A A . 13 ILE HG22 1 1 9 2119 1 1 13 ILE HG23 H 19.611 1.516 -4.498 1.00 . A A . 13 ILE HG23 1 1 9 2120 1 1 13 ILE N N 19.161 -0.572 -1.089 1.00 . A A . 13 ILE N 1 1 9 2121 1 1 13 ILE O O 21.704 1.797 -1.348 1.00 . A A . 13 ILE O 1 1 9 2122 1 1 14 LEU C C 22.089 1.828 1.598 1.00 . A A . 14 LEU C 1 1 9 2123 1 1 14 LEU CA C 20.800 2.512 1.169 1.00 . A A . 14 LEU CA 1 1 9 2124 1 1 14 LEU CB C 19.924 2.782 2.402 1.00 . A A . 14 LEU CB 1 1 9 2125 1 1 14 LEU CD1 C 18.159 3.953 1.039 1.00 . A A . 14 LEU CD1 1 1 9 2126 1 1 14 LEU CD2 C 18.375 4.435 3.485 1.00 . A A . 14 LEU CD2 1 1 9 2127 1 1 14 LEU CG C 19.145 4.093 2.205 1.00 . A A . 14 LEU CG 1 1 9 2128 1 1 14 LEU H H 19.206 1.302 0.461 1.00 . A A . 14 LEU H 1 1 9 2129 1 1 14 LEU HA H 21.042 3.454 0.695 1.00 . A A . 14 LEU HA 1 1 9 2130 1 1 14 LEU HB2 H 19.229 1.962 2.540 1.00 . A A . 14 LEU HB2 1 1 9 2131 1 1 14 LEU HB3 H 20.553 2.866 3.278 1.00 . A A . 14 LEU HB3 1 1 9 2132 1 1 14 LEU HD11 H 18.705 3.924 0.107 1.00 . A A . 14 LEU HD11 1 1 9 2133 1 1 14 LEU HD12 H 17.486 4.799 1.030 1.00 . A A . 14 LEU HD12 1 1 9 2134 1 1 14 LEU HD13 H 17.590 3.043 1.148 1.00 . A A . 14 LEU HD13 1 1 9 2135 1 1 14 LEU HD21 H 19.066 4.513 4.312 1.00 . A A . 14 LEU HD21 1 1 9 2136 1 1 14 LEU HD22 H 17.649 3.661 3.693 1.00 . A A . 14 LEU HD22 1 1 9 2137 1 1 14 LEU HD23 H 17.867 5.379 3.354 1.00 . A A . 14 LEU HD23 1 1 9 2138 1 1 14 LEU HG H 19.844 4.888 1.983 1.00 . A A . 14 LEU HG 1 1 9 2139 1 1 14 LEU N N 20.086 1.672 0.215 1.00 . A A . 14 LEU N 1 1 9 2140 1 1 14 LEU O O 23.134 2.467 1.713 1.00 . A A . 14 LEU O 1 1 9 2141 1 1 15 NH2 HN1 H 21.234 0.050 1.747 1.00 . A A . 15 NH2 HN1 1 1 9 2142 1 1 15 NH2 N N 22.071 0.554 1.841 1.00 . A A . 15 NH2 N 1 1 10 2143 1 1 1 ILE C C 1.434 0.000 1.706 1.00 . A A . 1 ILE C 1 1 10 2144 1 1 1 ILE CA C 0.952 -1.371 1.234 1.00 . A A . 1 ILE CA 1 1 10 2145 1 1 1 ILE CB C 0.066 -2.022 2.321 1.00 . A A . 1 ILE CB 1 1 10 2146 1 1 1 ILE CD1 C 1.123 -4.211 3.008 1.00 . A A . 1 ILE CD1 1 1 10 2147 1 1 1 ILE CG1 C 0.933 -2.736 3.382 1.00 . A A . 1 ILE CG1 1 1 10 2148 1 1 1 ILE CG2 C -0.888 -3.032 1.674 1.00 . A A . 1 ILE CG2 1 1 10 2149 1 1 1 ILE H1 H 2.995 -1.653 0.934 1.00 . A A . 1 ILE H1 1 1 10 2150 1 1 1 ILE H2 H 2.009 -2.682 0.008 1.00 . A A . 1 ILE H2 1 1 10 2151 1 1 1 ILE H3 H 2.218 -2.967 1.663 1.00 . A A . 1 ILE H3 1 1 10 2152 1 1 1 ILE HA H 0.373 -1.242 0.332 1.00 . A A . 1 ILE HA 1 1 10 2153 1 1 1 ILE HB H -0.520 -1.247 2.801 1.00 . A A . 1 ILE HB 1 1 10 2154 1 1 1 ILE HD11 H 1.068 -4.329 1.936 1.00 . A A . 1 ILE HD11 1 1 10 2155 1 1 1 ILE HD12 H 0.346 -4.801 3.474 1.00 . A A . 1 ILE HD12 1 1 10 2156 1 1 1 ILE HD13 H 2.088 -4.549 3.359 1.00 . A A . 1 ILE HD13 1 1 10 2157 1 1 1 ILE HG12 H 1.895 -2.257 3.448 1.00 . A A . 1 ILE HG12 1 1 10 2158 1 1 1 ILE HG13 H 0.442 -2.675 4.342 1.00 . A A . 1 ILE HG13 1 1 10 2159 1 1 1 ILE HG21 H -1.728 -2.509 1.242 1.00 . A A . 1 ILE HG21 1 1 10 2160 1 1 1 ILE HG22 H -1.242 -3.726 2.423 1.00 . A A . 1 ILE HG22 1 1 10 2161 1 1 1 ILE HG23 H -0.366 -3.575 0.899 1.00 . A A . 1 ILE HG23 1 1 10 2162 1 1 1 ILE N N 2.130 -2.234 0.939 1.00 . A A . 1 ILE N 1 1 10 2163 1 1 1 ILE O O 0.938 1.033 1.252 1.00 . A A . 1 ILE O 1 1 10 2164 1 1 2 ASN C C 4.325 1.529 2.640 1.00 . A A . 2 ASN C 1 1 10 2165 1 1 2 ASN CA C 2.917 1.272 3.152 1.00 . A A . 2 ASN CA 1 1 10 2166 1 1 2 ASN CB C 2.926 1.249 4.685 1.00 . A A . 2 ASN CB 1 1 10 2167 1 1 2 ASN CG C 1.566 0.808 5.217 1.00 . A A . 2 ASN CG 1 1 10 2168 1 1 2 ASN H H 2.747 -0.836 2.962 1.00 . A A . 2 ASN H 1 1 10 2169 1 1 2 ASN HA H 2.286 2.082 2.827 1.00 . A A . 2 ASN HA 1 1 10 2170 1 1 2 ASN HB2 H 3.682 0.561 5.033 1.00 . A A . 2 ASN HB2 1 1 10 2171 1 1 2 ASN HB3 H 3.148 2.237 5.050 1.00 . A A . 2 ASN HB3 1 1 10 2172 1 1 2 ASN HD21 H 0.561 1.514 3.660 1.00 . A A . 2 ASN HD21 1 1 10 2173 1 1 2 ASN HD22 H -0.385 0.761 4.852 1.00 . A A . 2 ASN HD22 1 1 10 2174 1 1 2 ASN N N 2.391 0.011 2.627 1.00 . A A . 2 ASN N 1 1 10 2175 1 1 2 ASN ND2 N 0.491 1.049 4.520 1.00 . A A . 2 ASN ND2 1 1 10 2176 1 1 2 ASN O O 4.832 0.796 1.791 1.00 . A A . 2 ASN O 1 1 10 2177 1 1 2 ASN OD1 O 1.481 0.234 6.304 1.00 . A A . 2 ASN OD1 1 1 10 2178 1 1 3 LEU C C 7.269 1.813 3.180 1.00 . A A . 3 LEU C 1 1 10 2179 1 1 3 LEU CA C 6.311 2.919 2.775 1.00 . A A . 3 LEU CA 1 1 10 2180 1 1 3 LEU CB C 6.717 4.213 3.450 1.00 . A A . 3 LEU CB 1 1 10 2181 1 1 3 LEU CD1 C 4.516 5.338 3.933 1.00 . A A . 3 LEU CD1 1 1 10 2182 1 1 3 LEU CD2 C 6.482 6.691 3.188 1.00 . A A . 3 LEU CD2 1 1 10 2183 1 1 3 LEU CG C 5.764 5.347 3.039 1.00 . A A . 3 LEU CG 1 1 10 2184 1 1 3 LEU H H 4.505 3.110 3.851 1.00 . A A . 3 LEU H 1 1 10 2185 1 1 3 LEU HA H 6.351 3.058 1.720 1.00 . A A . 3 LEU HA 1 1 10 2186 1 1 3 LEU HB2 H 6.668 4.070 4.504 1.00 . A A . 3 LEU HB2 1 1 10 2187 1 1 3 LEU HB3 H 7.726 4.469 3.163 1.00 . A A . 3 LEU HB3 1 1 10 2188 1 1 3 LEU HD11 H 4.223 6.355 4.153 1.00 . A A . 3 LEU HD11 1 1 10 2189 1 1 3 LEU HD12 H 4.731 4.821 4.857 1.00 . A A . 3 LEU HD12 1 1 10 2190 1 1 3 LEU HD13 H 3.708 4.839 3.418 1.00 . A A . 3 LEU HD13 1 1 10 2191 1 1 3 LEU HD21 H 5.776 7.493 3.035 1.00 . A A . 3 LEU HD21 1 1 10 2192 1 1 3 LEU HD22 H 7.270 6.761 2.453 1.00 . A A . 3 LEU HD22 1 1 10 2193 1 1 3 LEU HD23 H 6.904 6.766 4.179 1.00 . A A . 3 LEU HD23 1 1 10 2194 1 1 3 LEU HG H 5.466 5.212 2.009 1.00 . A A . 3 LEU HG 1 1 10 2195 1 1 3 LEU N N 4.956 2.568 3.171 1.00 . A A . 3 LEU N 1 1 10 2196 1 1 3 LEU O O 8.348 1.651 2.604 1.00 . A A . 3 LEU O 1 1 10 2197 1 1 4 LYS C C 8.072 -0.960 3.565 1.00 . A A . 4 LYS C 1 1 10 2198 1 1 4 LYS CA C 7.665 -0.029 4.695 1.00 . A A . 4 LYS CA 1 1 10 2199 1 1 4 LYS CB C 6.867 -0.811 5.731 1.00 . A A . 4 LYS CB 1 1 10 2200 1 1 4 LYS CD C 5.612 -0.119 7.788 1.00 . A A . 4 LYS CD 1 1 10 2201 1 1 4 LYS CE C 5.725 0.577 9.147 1.00 . A A . 4 LYS CE 1 1 10 2202 1 1 4 LYS CG C 6.978 -0.123 7.101 1.00 . A A . 4 LYS CG 1 1 10 2203 1 1 4 LYS H H 5.993 1.251 4.602 1.00 . A A . 4 LYS H 1 1 10 2204 1 1 4 LYS HA H 8.548 0.373 5.159 1.00 . A A . 4 LYS HA 1 1 10 2205 1 1 4 LYS HB2 H 5.828 -0.850 5.422 1.00 . A A . 4 LYS HB2 1 1 10 2206 1 1 4 LYS HB3 H 7.261 -1.812 5.797 1.00 . A A . 4 LYS HB3 1 1 10 2207 1 1 4 LYS HD2 H 4.896 0.408 7.172 1.00 . A A . 4 LYS HD2 1 1 10 2208 1 1 4 LYS HD3 H 5.283 -1.134 7.934 1.00 . A A . 4 LYS HD3 1 1 10 2209 1 1 4 LYS HE2 H 6.350 1.451 9.053 1.00 . A A . 4 LYS HE2 1 1 10 2210 1 1 4 LYS HE3 H 4.739 0.872 9.480 1.00 . A A . 4 LYS HE3 1 1 10 2211 1 1 4 LYS HG2 H 7.688 -0.657 7.713 1.00 . A A . 4 LYS HG2 1 1 10 2212 1 1 4 LYS HG3 H 7.316 0.893 6.967 1.00 . A A . 4 LYS HG3 1 1 10 2213 1 1 4 LYS HZ1 H 7.121 -0.866 9.717 1.00 . A A . 4 LYS HZ1 1 1 10 2214 1 1 4 LYS HZ2 H 5.599 -1.036 10.457 1.00 . A A . 4 LYS HZ2 1 1 10 2215 1 1 4 LYS HZ3 H 6.660 0.184 10.962 1.00 . A A . 4 LYS HZ3 1 1 10 2216 1 1 4 LYS N N 6.858 1.058 4.186 1.00 . A A . 4 LYS N 1 1 10 2217 1 1 4 LYS NZ N 6.322 -0.354 10.142 1.00 . A A . 4 LYS NZ 1 1 10 2218 1 1 4 LYS O O 9.220 -1.412 3.498 1.00 . A A . 4 LYS O 1 1 10 2219 1 1 5 ALA C C 8.544 -1.528 0.717 1.00 . A A . 5 ALA C 1 1 10 2220 1 1 5 ALA CA C 7.415 -2.116 1.549 1.00 . A A . 5 ALA CA 1 1 10 2221 1 1 5 ALA CB C 6.171 -2.278 0.675 1.00 . A A . 5 ALA CB 1 1 10 2222 1 1 5 ALA H H 6.240 -0.856 2.781 1.00 . A A . 5 ALA H 1 1 10 2223 1 1 5 ALA HA H 7.715 -3.089 1.917 1.00 . A A . 5 ALA HA 1 1 10 2224 1 1 5 ALA HB1 H 6.462 -2.287 -0.366 1.00 . A A . 5 ALA HB1 1 1 10 2225 1 1 5 ALA HB2 H 5.497 -1.454 0.853 1.00 . A A . 5 ALA HB2 1 1 10 2226 1 1 5 ALA HB3 H 5.679 -3.207 0.917 1.00 . A A . 5 ALA HB3 1 1 10 2227 1 1 5 ALA N N 7.132 -1.244 2.676 1.00 . A A . 5 ALA N 1 1 10 2228 1 1 5 ALA O O 9.459 -2.236 0.312 1.00 . A A . 5 ALA O 1 1 10 2229 1 1 6 LEU C C 10.804 0.447 0.471 1.00 . A A . 6 LEU C 1 1 10 2230 1 1 6 LEU CA C 9.502 0.445 -0.304 1.00 . A A . 6 LEU CA 1 1 10 2231 1 1 6 LEU CB C 9.082 1.892 -0.562 1.00 . A A . 6 LEU CB 1 1 10 2232 1 1 6 LEU CD1 C 7.869 3.396 -2.122 1.00 . A A . 6 LEU CD1 1 1 10 2233 1 1 6 LEU CD2 C 9.721 1.939 -2.972 1.00 . A A . 6 LEU CD2 1 1 10 2234 1 1 6 LEU CG C 8.553 2.035 -1.986 1.00 . A A . 6 LEU CG 1 1 10 2235 1 1 6 LEU H H 7.719 0.291 0.829 1.00 . A A . 6 LEU H 1 1 10 2236 1 1 6 LEU HA H 9.636 -0.065 -1.243 1.00 . A A . 6 LEU HA 1 1 10 2237 1 1 6 LEU HB2 H 8.308 2.169 0.140 1.00 . A A . 6 LEU HB2 1 1 10 2238 1 1 6 LEU HB3 H 9.933 2.543 -0.431 1.00 . A A . 6 LEU HB3 1 1 10 2239 1 1 6 LEU HD11 H 7.294 3.420 -3.034 1.00 . A A . 6 LEU HD11 1 1 10 2240 1 1 6 LEU HD12 H 8.616 4.176 -2.142 1.00 . A A . 6 LEU HD12 1 1 10 2241 1 1 6 LEU HD13 H 7.212 3.548 -1.278 1.00 . A A . 6 LEU HD13 1 1 10 2242 1 1 6 LEU HD21 H 9.872 0.906 -3.247 1.00 . A A . 6 LEU HD21 1 1 10 2243 1 1 6 LEU HD22 H 10.620 2.320 -2.505 1.00 . A A . 6 LEU HD22 1 1 10 2244 1 1 6 LEU HD23 H 9.502 2.519 -3.855 1.00 . A A . 6 LEU HD23 1 1 10 2245 1 1 6 LEU HG H 7.837 1.250 -2.190 1.00 . A A . 6 LEU HG 1 1 10 2246 1 1 6 LEU N N 8.472 -0.227 0.474 1.00 . A A . 6 LEU N 1 1 10 2247 1 1 6 LEU O O 11.869 0.135 -0.064 1.00 . A A . 6 LEU O 1 1 10 2248 1 1 7 ALA C C 12.558 -0.500 2.638 1.00 . A A . 7 ALA C 1 1 10 2249 1 1 7 ALA CA C 11.857 0.847 2.615 1.00 . A A . 7 ALA CA 1 1 10 2250 1 1 7 ALA CB C 11.429 1.228 4.035 1.00 . A A . 7 ALA CB 1 1 10 2251 1 1 7 ALA H H 9.809 1.033 2.092 1.00 . A A . 7 ALA H 1 1 10 2252 1 1 7 ALA HA H 12.542 1.588 2.245 1.00 . A A . 7 ALA HA 1 1 10 2253 1 1 7 ALA HB1 H 12.290 1.204 4.688 1.00 . A A . 7 ALA HB1 1 1 10 2254 1 1 7 ALA HB2 H 10.689 0.526 4.390 1.00 . A A . 7 ALA HB2 1 1 10 2255 1 1 7 ALA HB3 H 11.009 2.221 4.031 1.00 . A A . 7 ALA HB3 1 1 10 2256 1 1 7 ALA N N 10.695 0.796 1.741 1.00 . A A . 7 ALA N 1 1 10 2257 1 1 7 ALA O O 13.782 -0.573 2.723 1.00 . A A . 7 ALA O 1 1 10 2258 1 1 8 ALA C C 13.315 -3.067 1.412 1.00 . A A . 8 ALA C 1 1 10 2259 1 1 8 ALA CA C 12.341 -2.906 2.566 1.00 . A A . 8 ALA CA 1 1 10 2260 1 1 8 ALA CB C 11.226 -3.951 2.457 1.00 . A A . 8 ALA CB 1 1 10 2261 1 1 8 ALA H H 10.807 -1.440 2.483 1.00 . A A . 8 ALA H 1 1 10 2262 1 1 8 ALA HA H 12.872 -3.056 3.486 1.00 . A A . 8 ALA HA 1 1 10 2263 1 1 8 ALA HB1 H 11.661 -4.930 2.313 1.00 . A A . 8 ALA HB1 1 1 10 2264 1 1 8 ALA HB2 H 10.591 -3.714 1.618 1.00 . A A . 8 ALA HB2 1 1 10 2265 1 1 8 ALA HB3 H 10.638 -3.949 3.364 1.00 . A A . 8 ALA HB3 1 1 10 2266 1 1 8 ALA N N 11.777 -1.563 2.555 1.00 . A A . 8 ALA N 1 1 10 2267 1 1 8 ALA O O 14.435 -3.553 1.588 1.00 . A A . 8 ALA O 1 1 10 2268 1 1 9 LEU C C 14.847 -1.686 -0.847 1.00 . A A . 9 LEU C 1 1 10 2269 1 1 9 LEU CA C 13.731 -2.719 -0.943 1.00 . A A . 9 LEU CA 1 1 10 2270 1 1 9 LEU CB C 12.911 -2.464 -2.220 1.00 . A A . 9 LEU CB 1 1 10 2271 1 1 9 LEU CD1 C 10.633 -2.502 -3.265 1.00 . A A . 9 LEU CD1 1 1 10 2272 1 1 9 LEU CD2 C 11.295 -4.301 -1.653 1.00 . A A . 9 LEU CD2 1 1 10 2273 1 1 9 LEU CG C 11.433 -2.813 -1.994 1.00 . A A . 9 LEU CG 1 1 10 2274 1 1 9 LEU H H 11.998 -2.253 0.178 1.00 . A A . 9 LEU H 1 1 10 2275 1 1 9 LEU HA H 14.169 -3.704 -1.000 1.00 . A A . 9 LEU HA 1 1 10 2276 1 1 9 LEU HB2 H 12.991 -1.422 -2.495 1.00 . A A . 9 LEU HB2 1 1 10 2277 1 1 9 LEU HB3 H 13.302 -3.074 -3.021 1.00 . A A . 9 LEU HB3 1 1 10 2278 1 1 9 LEU HD11 H 9.693 -3.035 -3.242 1.00 . A A . 9 LEU HD11 1 1 10 2279 1 1 9 LEU HD12 H 11.199 -2.806 -4.133 1.00 . A A . 9 LEU HD12 1 1 10 2280 1 1 9 LEU HD13 H 10.443 -1.442 -3.316 1.00 . A A . 9 LEU HD13 1 1 10 2281 1 1 9 LEU HD21 H 12.275 -4.745 -1.565 1.00 . A A . 9 LEU HD21 1 1 10 2282 1 1 9 LEU HD22 H 10.741 -4.805 -2.433 1.00 . A A . 9 LEU HD22 1 1 10 2283 1 1 9 LEU HD23 H 10.771 -4.405 -0.715 1.00 . A A . 9 LEU HD23 1 1 10 2284 1 1 9 LEU HG H 11.047 -2.220 -1.180 1.00 . A A . 9 LEU HG 1 1 10 2285 1 1 9 LEU N N 12.888 -2.641 0.242 1.00 . A A . 9 LEU N 1 1 10 2286 1 1 9 LEU O O 16.014 -1.982 -1.102 1.00 . A A . 9 LEU O 1 1 10 2287 1 1 10 ALA C C 16.445 0.382 0.726 1.00 . A A . 10 ALA C 1 1 10 2288 1 1 10 ALA CA C 15.406 0.636 -0.368 1.00 . A A . 10 ALA CA 1 1 10 2289 1 1 10 ALA CB C 14.651 1.934 -0.068 1.00 . A A . 10 ALA CB 1 1 10 2290 1 1 10 ALA H H 13.507 -0.310 -0.307 1.00 . A A . 10 ALA H 1 1 10 2291 1 1 10 ALA HA H 15.921 0.749 -1.309 1.00 . A A . 10 ALA HA 1 1 10 2292 1 1 10 ALA HB1 H 14.947 2.698 -0.774 1.00 . A A . 10 ALA HB1 1 1 10 2293 1 1 10 ALA HB2 H 14.881 2.262 0.934 1.00 . A A . 10 ALA HB2 1 1 10 2294 1 1 10 ALA HB3 H 13.587 1.761 -0.154 1.00 . A A . 10 ALA HB3 1 1 10 2295 1 1 10 ALA N N 14.461 -0.471 -0.486 1.00 . A A . 10 ALA N 1 1 10 2296 1 1 10 ALA O O 17.595 0.796 0.601 1.00 . A A . 10 ALA O 1 1 10 2297 1 1 11 LYS C C 18.260 -1.122 2.444 1.00 . A A . 11 LYS C 1 1 10 2298 1 1 11 LYS CA C 16.937 -0.535 2.923 1.00 . A A . 11 LYS CA 1 1 10 2299 1 1 11 LYS CB C 16.273 -1.510 3.904 1.00 . A A . 11 LYS CB 1 1 10 2300 1 1 11 LYS CD C 17.125 -0.583 6.072 1.00 . A A . 11 LYS CD 1 1 10 2301 1 1 11 LYS CE C 17.618 -1.036 7.442 1.00 . A A . 11 LYS CE 1 1 10 2302 1 1 11 LYS CG C 17.196 -1.763 5.104 1.00 . A A . 11 LYS CG 1 1 10 2303 1 1 11 LYS H H 15.094 -0.564 1.862 1.00 . A A . 11 LYS H 1 1 10 2304 1 1 11 LYS HA H 17.135 0.390 3.436 1.00 . A A . 11 LYS HA 1 1 10 2305 1 1 11 LYS HB2 H 15.341 -1.090 4.253 1.00 . A A . 11 LYS HB2 1 1 10 2306 1 1 11 LYS HB3 H 16.078 -2.447 3.402 1.00 . A A . 11 LYS HB3 1 1 10 2307 1 1 11 LYS HD2 H 17.749 0.222 5.707 1.00 . A A . 11 LYS HD2 1 1 10 2308 1 1 11 LYS HD3 H 16.104 -0.240 6.154 1.00 . A A . 11 LYS HD3 1 1 10 2309 1 1 11 LYS HE2 H 17.534 -0.218 8.141 1.00 . A A . 11 LYS HE2 1 1 10 2310 1 1 11 LYS HE3 H 17.020 -1.869 7.786 1.00 . A A . 11 LYS HE3 1 1 10 2311 1 1 11 LYS HG2 H 16.882 -2.663 5.614 1.00 . A A . 11 LYS HG2 1 1 10 2312 1 1 11 LYS HG3 H 18.213 -1.884 4.764 1.00 . A A . 11 LYS HG3 1 1 10 2313 1 1 11 LYS HZ1 H 19.099 -2.475 7.148 1.00 . A A . 11 LYS HZ1 1 1 10 2314 1 1 11 LYS HZ2 H 19.534 -1.236 8.227 1.00 . A A . 11 LYS HZ2 1 1 10 2315 1 1 11 LYS HZ3 H 19.500 -0.937 6.559 1.00 . A A . 11 LYS HZ3 1 1 10 2316 1 1 11 LYS N N 16.031 -0.272 1.804 1.00 . A A . 11 LYS N 1 1 10 2317 1 1 11 LYS NZ N 19.043 -1.453 7.337 1.00 . A A . 11 LYS NZ 1 1 10 2318 1 1 11 LYS O O 19.327 -0.763 2.947 1.00 . A A . 11 LYS O 1 1 10 2319 1 1 12 LYS C C 20.126 -1.745 0.003 1.00 . A A . 12 LYS C 1 1 10 2320 1 1 12 LYS CA C 19.389 -2.664 0.970 1.00 . A A . 12 LYS CA 1 1 10 2321 1 1 12 LYS CB C 19.022 -3.985 0.289 1.00 . A A . 12 LYS CB 1 1 10 2322 1 1 12 LYS CD C 17.208 -4.916 1.748 1.00 . A A . 12 LYS CD 1 1 10 2323 1 1 12 LYS CE C 16.427 -5.997 1.008 1.00 . A A . 12 LYS CE 1 1 10 2324 1 1 12 LYS CG C 18.683 -5.021 1.366 1.00 . A A . 12 LYS CG 1 1 10 2325 1 1 12 LYS H H 17.318 -2.289 1.131 1.00 . A A . 12 LYS H 1 1 10 2326 1 1 12 LYS HA H 20.040 -2.879 1.800 1.00 . A A . 12 LYS HA 1 1 10 2327 1 1 12 LYS HB2 H 18.169 -3.836 -0.360 1.00 . A A . 12 LYS HB2 1 1 10 2328 1 1 12 LYS HB3 H 19.861 -4.338 -0.292 1.00 . A A . 12 LYS HB3 1 1 10 2329 1 1 12 LYS HD2 H 17.103 -5.058 2.816 1.00 . A A . 12 LYS HD2 1 1 10 2330 1 1 12 LYS HD3 H 16.824 -3.946 1.473 1.00 . A A . 12 LYS HD3 1 1 10 2331 1 1 12 LYS HE2 H 16.588 -5.886 -0.053 1.00 . A A . 12 LYS HE2 1 1 10 2332 1 1 12 LYS HE3 H 16.772 -6.969 1.325 1.00 . A A . 12 LYS HE3 1 1 10 2333 1 1 12 LYS HG2 H 18.883 -6.014 0.985 1.00 . A A . 12 LYS HG2 1 1 10 2334 1 1 12 LYS HG3 H 19.289 -4.844 2.240 1.00 . A A . 12 LYS HG3 1 1 10 2335 1 1 12 LYS HZ1 H 14.754 -6.373 2.180 1.00 . A A . 12 LYS HZ1 1 1 10 2336 1 1 12 LYS HZ2 H 14.427 -6.241 0.518 1.00 . A A . 12 LYS HZ2 1 1 10 2337 1 1 12 LYS HZ3 H 14.756 -4.845 1.440 1.00 . A A . 12 LYS HZ3 1 1 10 2338 1 1 12 LYS N N 18.189 -2.033 1.488 1.00 . A A . 12 LYS N 1 1 10 2339 1 1 12 LYS NZ N 14.984 -5.855 1.309 1.00 . A A . 12 LYS NZ 1 1 10 2340 1 1 12 LYS O O 21.343 -1.843 -0.150 1.00 . A A . 12 LYS O 1 1 10 2341 1 1 13 ILE C C 20.520 1.316 -0.865 1.00 . A A . 13 ILE C 1 1 10 2342 1 1 13 ILE CA C 20.015 0.071 -1.585 1.00 . A A . 13 ILE CA 1 1 10 2343 1 1 13 ILE CB C 19.021 0.462 -2.678 1.00 . A A . 13 ILE CB 1 1 10 2344 1 1 13 ILE CD1 C 19.217 -1.749 -3.855 1.00 . A A . 13 ILE CD1 1 1 10 2345 1 1 13 ILE CG1 C 18.257 -0.786 -3.153 1.00 . A A . 13 ILE CG1 1 1 10 2346 1 1 13 ILE CG2 C 19.770 1.073 -3.863 1.00 . A A . 13 ILE CG2 1 1 10 2347 1 1 13 ILE H H 18.431 -0.799 -0.484 1.00 . A A . 13 ILE H 1 1 10 2348 1 1 13 ILE HA H 20.843 -0.420 -2.042 1.00 . A A . 13 ILE HA 1 1 10 2349 1 1 13 ILE HB H 18.332 1.180 -2.280 1.00 . A A . 13 ILE HB 1 1 10 2350 1 1 13 ILE HD11 H 20.081 -1.921 -3.231 1.00 . A A . 13 ILE HD11 1 1 10 2351 1 1 13 ILE HD12 H 19.531 -1.321 -4.793 1.00 . A A . 13 ILE HD12 1 1 10 2352 1 1 13 ILE HD13 H 18.715 -2.686 -4.041 1.00 . A A . 13 ILE HD13 1 1 10 2353 1 1 13 ILE HG12 H 17.812 -1.279 -2.306 1.00 . A A . 13 ILE HG12 1 1 10 2354 1 1 13 ILE HG13 H 17.481 -0.491 -3.845 1.00 . A A . 13 ILE HG13 1 1 10 2355 1 1 13 ILE HG21 H 19.068 1.309 -4.649 1.00 . A A . 13 ILE HG21 1 1 10 2356 1 1 13 ILE HG22 H 20.496 0.365 -4.230 1.00 . A A . 13 ILE HG22 1 1 10 2357 1 1 13 ILE HG23 H 20.276 1.976 -3.548 1.00 . A A . 13 ILE HG23 1 1 10 2358 1 1 13 ILE N N 19.394 -0.848 -0.644 1.00 . A A . 13 ILE N 1 1 10 2359 1 1 13 ILE O O 21.609 1.820 -1.165 1.00 . A A . 13 ILE O 1 1 10 2360 1 1 14 LEU C C 21.300 2.668 1.745 1.00 . A A . 14 LEU C 1 1 10 2361 1 1 14 LEU CA C 20.111 2.987 0.843 1.00 . A A . 14 LEU CA 1 1 10 2362 1 1 14 LEU CB C 18.927 3.480 1.690 1.00 . A A . 14 LEU CB 1 1 10 2363 1 1 14 LEU CD1 C 17.670 3.885 -0.445 1.00 . A A . 14 LEU CD1 1 1 10 2364 1 1 14 LEU CD2 C 16.845 4.863 1.693 1.00 . A A . 14 LEU CD2 1 1 10 2365 1 1 14 LEU CG C 18.095 4.492 0.892 1.00 . A A . 14 LEU CG 1 1 10 2366 1 1 14 LEU H H 18.884 1.349 0.284 1.00 . A A . 14 LEU H 1 1 10 2367 1 1 14 LEU HA H 20.395 3.768 0.153 1.00 . A A . 14 LEU HA 1 1 10 2368 1 1 14 LEU HB2 H 18.304 2.640 1.968 1.00 . A A . 14 LEU HB2 1 1 10 2369 1 1 14 LEU HB3 H 19.301 3.957 2.583 1.00 . A A . 14 LEU HB3 1 1 10 2370 1 1 14 LEU HD11 H 17.019 4.574 -0.964 1.00 . A A . 14 LEU HD11 1 1 10 2371 1 1 14 LEU HD12 H 17.142 2.960 -0.268 1.00 . A A . 14 LEU HD12 1 1 10 2372 1 1 14 LEU HD13 H 18.543 3.692 -1.048 1.00 . A A . 14 LEU HD13 1 1 10 2373 1 1 14 LEU HD21 H 16.144 5.374 1.049 1.00 . A A . 14 LEU HD21 1 1 10 2374 1 1 14 LEU HD22 H 17.119 5.513 2.511 1.00 . A A . 14 LEU HD22 1 1 10 2375 1 1 14 LEU HD23 H 16.390 3.966 2.082 1.00 . A A . 14 LEU HD23 1 1 10 2376 1 1 14 LEU HG H 18.684 5.380 0.712 1.00 . A A . 14 LEU HG 1 1 10 2377 1 1 14 LEU N N 19.735 1.801 0.085 1.00 . A A . 14 LEU N 1 1 10 2378 1 1 14 LEU O O 21.206 2.770 2.968 1.00 . A A . 14 LEU O 1 1 10 2379 1 1 15 NH2 HN1 H 22.495 2.187 0.233 1.00 . A A . 15 NH2 HN1 1 1 10 2380 1 1 15 NH2 N N 22.419 2.267 1.212 1.00 . A A . 15 NH2 N 1 1 stop_ save_
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