NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
394465 | 1r9i | 6027 | cing | 4-filtered-FRED | STAR | entry | full | 203 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1r9i # This FRED archive file contains, for PDB entry <1r9i>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1r9i _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1r9i _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "disulfide and other bound" _Assembly.Molecular_mass 2610.10 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 $Mu_conotoxin_PIIIA A . 1 1 stop_ save_ save_Mu_conotoxin_PIIIA _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Mu conotoxin PIIIA" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code XRLCCGFXKSCRSRQCKXHRCX _Entity.Number_of_monomers 22 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 PCA $PCA 1 1 2 ARG . 1 1 3 LEU . 1 1 4 CYS . 1 1 5 CYS . 1 1 6 GLY . 1 1 7 PHE . 1 1 8 HYP $HYP 1 1 9 LYS . 1 1 10 SER . 1 1 11 CYS . 1 1 12 ARG . 1 1 13 SER . 1 1 14 ARG . 1 1 15 GLN . 1 1 16 CYS . 1 1 17 LYS . 1 1 18 HYP $HYP 1 1 19 HIS . 1 1 20 ARG . 1 1 21 CYS . 1 1 22 . $. 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 PCA 1 1 1 1 ARG 2 2 1 1 LEU 3 3 1 1 CYS 4 4 1 1 CYS 5 5 1 1 GLY 6 6 1 1 PHE 7 7 1 1 HYP 8 8 1 1 LYS 9 9 1 1 SER 10 10 1 1 CYS 11 11 1 1 ARG 12 12 1 1 SER 13 13 1 1 ARG 14 14 1 1 GLN 15 15 1 1 CYS 16 16 1 1 LYS 17 17 1 1 HYP 18 18 1 1 HIS 19 19 1 1 ARG 20 20 1 1 CYS 21 21 1 1 . 22 22 1 1 stop_ save_ save_HYP _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID HYP _Chem_comp.Type non-polymer save_ save_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _Chem_comp.Type non-polymer save_ save_PCA _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID PCA _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 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 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 PCA HA . 1 . HA 1 1 1 1 2 1 1 2 ARG H . 2 . HN 1 1 2 1 1 1 1 2 ARG H . 2 . HN 1 1 2 1 2 1 1 2 ARG QB . 2 . HB* 1 1 3 1 1 1 1 2 ARG H . 2 . HN 1 1 3 1 2 1 1 2 ARG QG . 2 . HG* 1 1 4 1 1 1 1 2 ARG HA . 2 . HA 1 1 4 1 2 1 1 3 LEU H . 3 . HN 1 1 5 1 1 1 1 2 ARG H . 2 . HN 1 1 5 1 2 1 1 3 LEU H . 3 . HN 1 1 6 1 1 1 1 2 ARG QB . 2 . HB* 1 1 6 1 2 1 1 3 LEU H . 3 . HN 1 1 7 1 1 1 1 3 LEU H . 3 . HN 1 1 7 1 2 1 1 7 PHE QE . 7 . HE* 1 1 8 1 1 1 1 3 LEU HA . 3 . HA 1 1 8 1 2 1 1 4 CYS H . 4 . HN 1 1 9 1 1 1 1 3 LEU HB2 . 3 . HB1 1 1 9 1 2 1 1 4 CYS H . 4 . HN 1 1 10 1 1 1 1 3 LEU HB3 . 3 . HB2 1 1 10 1 2 1 1 4 CYS H . 4 . HN 1 1 11 1 1 1 1 3 LEU QD . 3 . HD** 1 1 11 1 2 1 1 4 CYS H . 4 . HN 1 1 12 1 1 1 1 3 LEU H . 3 . HN 1 1 12 1 2 1 1 4 CYS H . 4 . HN 1 1 13 1 1 1 1 4 CYS H . 4 . HN 1 1 13 1 2 1 1 5 CYS H . 5 . HN 1 1 14 1 1 1 1 4 CYS H . 4 . HN 1 1 14 1 2 1 1 10 SER H . 10 . HN 1 1 15 1 1 1 1 4 CYS HB3 . 4 . HB2 1 1 15 1 2 1 1 19 HIS HB2 . 19 . HB1 1 1 16 1 1 1 1 4 CYS HB2 . 4 . HB1 1 1 16 1 2 1 1 19 HIS HB2 . 19 . HB1 1 1 17 1 1 1 1 4 CYS HB2 . 4 . HB1 1 1 17 1 2 1 1 19 HIS HB3 . 19 . HB2 1 1 18 1 1 1 1 4 CYS HB3 . 4 . HB2 1 1 18 1 2 1 1 19 HIS HB3 . 19 . HB2 1 1 19 1 1 1 1 4 CYS HB2 . 4 . HB1 1 1 19 1 2 1 1 16 CYS HB2 . 16 . HB1 1 1 20 1 1 1 1 4 CYS HA . 4 . HA 1 1 20 1 2 1 1 7 PHE HZ . 7 . HZ 1 1 21 1 1 1 1 2 ARG QB . 2 . HB* 1 1 21 1 2 1 1 7 PHE QE . 7 . HE* 1 1 22 1 1 1 1 3 LEU MD1 . 3 . HD1* 1 1 22 1 2 1 1 7 PHE QE . 7 . HE* 1 1 23 1 1 1 1 3 LEU MD1 . 3 . HD1* 1 1 23 1 2 1 1 7 PHE HZ . 7 . HZ 1 1 24 1 1 1 1 3 LEU MD2 . 3 . HD2* 1 1 24 1 2 1 1 7 PHE QE . 7 . HE* 1 1 25 1 1 1 1 3 LEU MD2 . 3 . HD2* 1 1 25 1 2 1 1 7 PHE HZ . 7 . HZ 1 1 26 1 1 1 1 3 LEU HA . 3 . HA 1 1 26 1 2 1 1 7 PHE HZ . 7 . HZ 1 1 27 1 1 1 1 3 LEU HA . 3 . HA 1 1 27 1 2 1 1 7 PHE QE . 7 . HE* 1 1 28 1 1 1 1 7 PHE QE . 7 . HE* 1 1 28 1 2 1 1 10 SER HA . 10 . HA 1 1 29 1 1 1 1 7 PHE QE . 7 . HE* 1 1 29 1 2 1 1 10 SER H . 10 . HN 1 1 30 1 1 1 1 7 PHE QE . 7 . HE* 1 1 30 1 2 1 1 10 SER HB2 . 10 . HB1 1 1 31 1 1 1 1 7 PHE QE . 7 . HE* 1 1 31 1 2 1 1 10 SER HB3 . 10 . HB2 1 1 32 1 1 1 1 7 PHE HZ . 7 . HZ 1 1 32 1 2 1 1 10 SER HB2 . 10 . HB1 1 1 33 1 1 1 1 7 PHE HZ . 7 . HZ 1 1 33 1 2 1 1 10 SER HB3 . 10 . HB2 1 1 34 1 1 1 1 8 HYP HB2 . 8 . HB2 1 1 34 1 2 1 1 8 HYP HG . 8 . HG 1 1 35 1 1 1 1 8 HYP HA . 8 . HA 1 1 35 1 2 1 1 8 HYP HB2 . 8 . HB2 1 1 36 1 1 1 1 8 HYP HA . 8 . HA 1 1 36 1 2 1 1 9 LYS H . 9 . HN 1 1 37 1 1 1 1 9 LYS H . 9 . HN 1 1 37 1 2 1 1 9 LYS HA . 9 . HA 1 1 38 1 1 1 1 8 HYP HB2 . 8 . HB2 1 1 38 1 2 1 1 9 LYS H . 9 . HN 1 1 39 1 1 1 1 9 LYS H . 9 . HN 1 1 39 1 2 1 1 10 SER H . 10 . HN 1 1 40 1 1 1 1 7 PHE QE . 7 . HE* 1 1 40 1 2 1 1 9 LYS H . 9 . HN 1 1 41 1 1 1 1 7 PHE HA . 7 . HA 1 1 41 1 2 1 1 9 LYS H . 9 . HN 1 1 42 1 1 1 1 9 LYS H . 9 . HN 1 1 42 1 2 1 1 11 CYS H . 11 . HN 1 1 43 1 1 1 1 8 HYP HA . 8 . HA 1 1 43 1 2 1 1 10 SER H . 10 . HN 1 1 44 1 1 1 1 9 LYS HA . 9 . HA 1 1 44 1 2 1 1 10 SER H . 10 . HN 1 1 45 1 1 1 1 9 LYS HB2 . 9 . HB1 1 1 45 1 2 1 1 10 SER H . 10 . HN 1 1 46 1 1 1 1 9 LYS HB3 . 9 . HB2 1 1 46 1 2 1 1 10 SER H . 10 . HN 1 1 47 1 1 1 1 7 PHE HB2 . 7 . HB1 1 1 47 1 2 1 1 10 SER H . 10 . HN 1 1 48 1 1 1 1 7 PHE HB3 . 7 . HB2 1 1 48 1 2 1 1 10 SER H . 10 . HN 1 1 49 1 1 1 1 7 PHE H . 7 . HN 1 1 49 1 2 1 1 10 SER H . 10 . HN 1 1 50 1 1 1 1 7 PHE HA . 7 . HA 1 1 50 1 2 1 1 10 SER H . 10 . HN 1 1 51 1 1 1 1 10 SER H . 10 . HN 1 1 51 1 2 1 1 11 CYS H . 11 . HN 1 1 52 1 1 1 1 10 SER HA . 10 . HA 1 1 52 1 2 1 1 11 CYS H . 11 . HN 1 1 53 1 1 1 1 10 SER HB2 . 10 . HB1 1 1 53 1 2 1 1 11 CYS H . 11 . HN 1 1 54 1 1 1 1 10 SER HB3 . 10 . HB2 1 1 54 1 2 1 1 11 CYS H . 11 . HN 1 1 55 1 1 1 1 9 LYS HA . 9 . HA 1 1 55 1 2 1 1 11 CYS H . 11 . HN 1 1 56 1 1 1 1 9 LYS QB . 9 . HB* 1 1 56 1 2 1 1 11 CYS H . 11 . HN 1 1 57 1 1 1 1 11 CYS H . 11 . HN 1 1 57 1 2 1 1 12 ARG H . 12 . HN 1 1 58 1 1 1 1 7 PHE QE . 7 . HE* 1 1 58 1 2 1 1 11 CYS H . 11 . HN 1 1 59 1 1 1 1 11 CYS H . 11 . HN 1 1 59 1 2 1 1 13 SER H . 13 . HN 1 1 60 1 1 1 1 11 CYS HA . 11 . HA 1 1 60 1 2 1 1 16 CYS HB2 . 16 . HB1 1 1 61 1 1 1 1 11 CYS HA . 11 . HA 1 1 61 1 2 1 1 16 CYS HB3 . 16 . HB2 1 1 62 1 1 1 1 11 CYS HA . 11 . HA 1 1 62 1 2 1 1 12 ARG H . 12 . HN 1 1 63 1 1 1 1 9 LYS HA . 9 . HA 1 1 63 1 2 1 1 12 ARG H . 12 . HN 1 1 64 1 1 1 1 10 SER HA . 10 . HA 1 1 64 1 2 1 1 12 ARG H . 12 . HN 1 1 65 1 1 1 1 12 ARG H . 12 . HN 1 1 65 1 2 1 1 12 ARG HB3 . 12 . HB2 1 1 66 1 1 1 1 12 ARG H . 12 . HN 1 1 66 1 2 1 1 12 ARG HG2 . 12 . HG1 1 1 67 1 1 1 1 12 ARG H . 12 . HN 1 1 67 1 2 1 1 12 ARG HG3 . 12 . HG2 1 1 68 1 1 1 1 11 CYS HB2 . 11 . HB1 1 1 68 1 2 1 1 12 ARG H . 12 . HN 1 1 69 1 1 1 1 11 CYS HB3 . 11 . HB2 1 1 69 1 2 1 1 12 ARG H . 12 . HN 1 1 70 1 1 1 1 12 ARG H . 12 . HN 1 1 70 1 2 1 1 12 ARG QD . 12 . HD* 1 1 71 1 1 1 1 12 ARG HA . 12 . HA 1 1 71 1 2 1 1 13 SER H . 13 . HN 1 1 72 1 1 1 1 11 CYS HA . 11 . HA 1 1 72 1 2 1 1 13 SER H . 13 . HN 1 1 73 1 1 1 1 13 SER H . 13 . HN 1 1 73 1 2 1 1 13 SER HB2 . 13 . HB1 1 1 74 1 1 1 1 13 SER H . 13 . HN 1 1 74 1 2 1 1 16 CYS HA . 16 . HA 1 1 75 1 1 1 1 13 SER H . 13 . HN 1 1 75 1 2 1 1 16 CYS HB2 . 16 . HB1 1 1 76 1 1 1 1 13 SER H . 13 . HN 1 1 76 1 2 1 1 16 CYS HB3 . 16 . HB2 1 1 77 1 1 1 1 12 ARG HB2 . 12 . HB1 1 1 77 1 2 1 1 13 SER H . 13 . HN 1 1 78 1 1 1 1 12 ARG HB3 . 12 . HB2 1 1 78 1 2 1 1 13 SER H . 13 . HN 1 1 79 1 1 1 1 12 ARG HG2 . 12 . HG1 1 1 79 1 2 1 1 13 SER H . 13 . HN 1 1 80 1 1 1 1 12 ARG HG3 . 12 . HG2 1 1 80 1 2 1 1 13 SER H . 13 . HN 1 1 81 1 1 1 1 13 SER H . 13 . HN 1 1 81 1 2 1 1 13 SER HG . 13 . HG 1 1 82 1 1 1 1 13 SER HG . 13 . HG 1 1 82 1 2 1 1 16 CYS H . 16 . HN 1 1 83 1 1 1 1 13 SER HG . 13 . HG 1 1 83 1 2 1 1 15 GLN H . 15 . HN 1 1 84 1 1 1 1 13 SER HG . 13 . HG 1 1 84 1 2 1 1 15 GLN HE21 . 15 . HE21 1 1 85 1 1 1 1 12 ARG H . 12 . HN 1 1 85 1 2 1 1 13 SER H . 13 . HN 1 1 86 1 1 1 1 13 SER H . 13 . HN 1 1 86 1 2 1 1 16 CYS H . 16 . HN 1 1 87 1 1 1 1 13 SER H . 13 . HN 1 1 87 1 2 1 1 17 LYS H . 17 . HN 1 1 88 1 1 1 1 13 SER HA . 13 . HA 1 1 88 1 2 1 1 14 ARG H . 14 . HN 1 1 89 1 1 1 1 13 SER HB3 . 13 . HB2 1 1 89 1 2 1 1 14 ARG H . 14 . HN 1 1 90 1 1 1 1 14 ARG H . 14 . HN 1 1 90 1 2 1 1 14 ARG HB2 . 14 . HB1 1 1 91 1 1 1 1 14 ARG H . 14 . HN 1 1 91 1 2 1 1 14 ARG HG2 . 14 . HG1 1 1 92 1 1 1 1 14 ARG H . 14 . HN 1 1 92 1 2 1 1 14 ARG HG3 . 14 . HG2 1 1 93 1 1 1 1 14 ARG H . 14 . HN 1 1 93 1 2 1 1 15 GLN H . 15 . HN 1 1 94 1 1 1 1 14 ARG H . 14 . HN 1 1 94 1 2 1 1 17 LYS H . 17 . HN 1 1 95 1 1 1 1 14 ARG H . 14 . HN 1 1 95 1 2 1 1 16 CYS H . 16 . HN 1 1 96 1 1 1 1 13 SER H . 13 . HN 1 1 96 1 2 1 1 14 ARG H . 14 . HN 1 1 97 1 1 1 1 13 SER HA . 13 . HA 1 1 97 1 2 1 1 15 GLN H . 15 . HN 1 1 98 1 1 1 1 15 GLN H . 15 . HN 1 1 98 1 2 1 1 15 GLN HA . 15 . HA 1 1 99 1 1 1 1 14 ARG HA . 14 . HA 1 1 99 1 2 1 1 15 GLN H . 15 . HN 1 1 100 1 1 1 1 13 SER HB2 . 13 . HB1 1 1 100 1 2 1 1 15 GLN H . 15 . HN 1 1 101 1 1 1 1 13 SER HB3 . 13 . HB2 1 1 101 1 2 1 1 15 GLN H . 15 . HN 1 1 102 1 1 1 1 15 GLN H . 15 . HN 1 1 102 1 2 1 1 15 GLN QG . 15 . HG* 1 1 103 1 1 1 1 14 ARG HB2 . 14 . HB1 1 1 103 1 2 1 1 15 GLN H . 15 . HN 1 1 104 1 1 1 1 14 ARG HB3 . 14 . HB2 1 1 104 1 2 1 1 15 GLN H . 15 . HN 1 1 105 1 1 1 1 14 ARG HG2 . 14 . HG1 1 1 105 1 2 1 1 15 GLN H . 15 . HN 1 1 106 1 1 1 1 14 ARG HG3 . 14 . HG2 1 1 106 1 2 1 1 15 GLN H . 15 . HN 1 1 107 1 1 1 1 15 GLN HA . 15 . HA 1 1 107 1 2 1 1 15 GLN HE21 . 15 . HE21 1 1 108 1 1 1 1 15 GLN HA . 15 . HA 1 1 108 1 2 1 1 15 GLN HE22 . 15 . HE22 1 1 109 1 1 1 1 13 SER QB . 13 . HB* 1 1 109 1 2 1 1 15 GLN HE21 . 15 . HE21 1 1 110 1 1 1 1 15 GLN H . 15 . HN 1 1 110 1 2 1 1 16 CYS H . 16 . HN 1 1 111 1 1 1 1 15 GLN H . 15 . HN 1 1 111 1 2 1 1 17 LYS H . 17 . HN 1 1 112 1 1 1 1 13 SER H . 13 . HN 1 1 112 1 2 1 1 15 GLN H . 15 . HN 1 1 113 1 1 1 1 15 GLN H . 15 . HN 1 1 113 1 2 1 1 15 GLN HE22 . 15 . HE22 1 1 114 1 1 1 1 16 CYS H . 16 . HN 1 1 114 1 2 1 1 16 CYS HA . 16 . HA 1 1 115 1 1 1 1 13 SER HA . 13 . HA 1 1 115 1 2 1 1 16 CYS H . 16 . HN 1 1 116 1 1 1 1 13 SER HB2 . 13 . HB1 1 1 116 1 2 1 1 16 CYS H . 16 . HN 1 1 117 1 1 1 1 15 GLN HA . 15 . HA 1 1 117 1 2 1 1 16 CYS H . 16 . HN 1 1 118 1 1 1 1 14 ARG HA . 14 . HA 1 1 118 1 2 1 1 16 CYS H . 16 . HN 1 1 119 1 1 1 1 13 SER HB3 . 13 . HB2 1 1 119 1 2 1 1 16 CYS H . 16 . HN 1 1 120 1 1 1 1 15 GLN HB3 . 15 . HB1 1 1 120 1 2 1 1 16 CYS H . 16 . HN 1 1 121 1 1 1 1 15 GLN HB2 . 15 . HB2 1 1 121 1 2 1 1 16 CYS H . 16 . HN 1 1 122 1 1 1 1 15 GLN QG . 15 . HG* 1 1 122 1 2 1 1 16 CYS H . 16 . HN 1 1 123 1 1 1 1 15 GLN HG3 . 15 . HG2 1 1 123 1 2 1 1 16 CYS H . 16 . HN 1 1 124 1 1 1 1 14 ARG QB . 14 . HB* 1 1 124 1 2 1 1 16 CYS H . 16 . HN 1 1 125 1 1 1 1 16 CYS H . 16 . HN 1 1 125 1 2 1 1 17 LYS H . 17 . HN 1 1 126 1 1 1 1 3 LEU QD . 3 . HD** 1 1 126 1 2 1 1 16 CYS H . 16 . HN 1 1 127 1 1 1 1 16 CYS HA . 16 . HA 1 1 127 1 2 1 1 19 HIS QB . 19 . HB* 1 1 128 1 1 1 1 4 CYS HB2 . 4 . HB1 1 1 128 1 2 1 1 16 CYS HA . 16 . HA 1 1 129 1 1 1 1 4 CYS HB3 . 4 . HB2 1 1 129 1 2 1 1 16 CYS HA . 16 . HA 1 1 130 1 1 1 1 16 CYS HA . 16 . HA 1 1 130 1 2 1 1 17 LYS H . 17 . HN 1 1 131 1 1 1 1 17 LYS H . 17 . HN 1 1 131 1 2 1 1 17 LYS HA . 17 . HA 1 1 132 1 1 1 1 13 SER HA . 13 . HA 1 1 132 1 2 1 1 17 LYS H . 17 . HN 1 1 133 1 1 1 1 14 ARG HA . 14 . HA 1 1 133 1 2 1 1 17 LYS H . 17 . HN 1 1 134 1 1 1 1 17 LYS H . 17 . HN 1 1 134 1 2 1 1 18 HYP HA . 18 . HA 1 1 135 1 1 1 1 16 CYS HB2 . 16 . HB1 1 1 135 1 2 1 1 17 LYS H . 17 . HN 1 1 136 1 1 1 1 16 CYS HB3 . 16 . HB2 1 1 136 1 2 1 1 17 LYS H . 17 . HN 1 1 137 1 1 1 1 15 GLN HA . 15 . HA 1 1 137 1 2 1 1 17 LYS H . 17 . HN 1 1 138 1 1 1 1 18 HYP HA . 18 . HA 1 1 138 1 2 1 1 18 HYP HB2 . 18 . HB2 1 1 139 1 1 1 1 18 HYP HB2 . 18 . HB* 1 1 139 1 1 1 1 18 HYP HB3 . 18 . HB* 1 1 139 1 2 1 1 18 HYP HG . 18 . HG 1 1 140 1 1 1 1 16 CYS HA . 16 . HA 1 1 140 1 2 1 1 19 HIS H . 19 . HN 1 1 141 1 1 1 1 17 LYS HA . 17 . HA 1 1 141 1 2 1 1 19 HIS H . 19 . HN 1 1 142 1 1 1 1 18 HYP HA . 18 . HA 1 1 142 1 2 1 1 19 HIS H . 19 . HN 1 1 143 1 1 1 1 18 HYP HG . 18 . HG 1 1 143 1 2 1 1 19 HIS H . 19 . HN 1 1 144 1 1 1 1 17 LYS QB . 17 . HB* 1 1 144 1 2 1 1 19 HIS H . 19 . HN 1 1 145 1 1 1 1 17 LYS H . 17 . HN 1 1 145 1 2 1 1 19 HIS H . 19 . HN 1 1 146 1 1 1 1 19 HIS H . 19 . HN 1 1 146 1 2 1 1 19 HIS HD1 . 19 . HD1 1 1 147 1 1 1 1 16 CYS HA . 16 . HA 1 1 147 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 148 1 1 1 1 18 HYP HA . 18 . HA 1 1 148 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 149 1 1 1 1 17 LYS HA . 17 . HA 1 1 149 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 150 1 1 1 1 4 CYS HB2 . 4 . HB1 1 1 150 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 151 1 1 1 1 4 CYS HB3 . 4 . HB2 1 1 151 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 152 1 1 1 1 18 HYP HB2 . 18 . HB* 1 1 152 1 1 1 1 18 HYP HB3 . 18 . HB* 1 1 152 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 153 1 1 1 1 19 HIS HA . 19 . HA 1 1 153 1 2 1 1 20 ARG H . 20 . HN 1 1 154 1 1 1 1 20 ARG H . 20 . HN 1 1 154 1 2 1 1 20 ARG QB . 20 . HB* 1 1 155 1 1 1 1 19 HIS QB . 19 . HB* 1 1 155 1 2 1 1 20 ARG H . 20 . HN 1 1 156 1 1 1 1 19 HIS H . 19 . HN 1 1 156 1 2 1 1 20 ARG H . 20 . HN 1 1 157 1 1 1 1 20 ARG HA . 20 . HA 1 1 157 1 2 1 1 21 CYS H . 21 . HN 1 1 158 1 1 1 1 21 CYS H . 21 . HN 1 1 158 1 2 1 1 21 CYS HB3 . 21 . HB2 1 1 159 1 1 1 1 20 ARG QB . 20 . HB* 1 1 159 1 2 1 1 21 CYS H . 21 . HN 1 1 160 1 1 1 1 19 HIS QB . 19 . HB* 1 1 160 1 2 1 1 21 CYS H . 21 . HN 1 1 161 1 1 1 1 19 HIS H . 19 . HN 1 1 161 1 2 1 1 21 CYS H . 21 . HN 1 1 162 1 1 1 1 19 HIS HA . 19 . HA 1 1 162 1 2 1 1 21 CYS H . 21 . HN 1 1 163 1 1 1 1 5 CYS HB2 . 5 . HB2 1 1 163 1 2 1 1 21 CYS HA . 21 . HA 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 . . . . . 0.0 0.0 2.7 1 1 2 1 . . . . . 0.0 0.0 3.7 1 1 3 1 . . . . . 0.0 0.0 4.5 1 1 4 1 . . . . . 0.0 0.0 2.7 1 1 5 1 . . . . . 0.0 0.0 5.0 1 1 6 1 . . . . . 0.0 0.0 4.5 1 1 7 1 . . . . . 0.0 0.0 7.0 1 1 8 1 . . . . . 0.0 0.0 3.5 1 1 9 1 . . . . . 0.0 0.0 5.0 1 1 10 1 . . . . . 0.0 0.0 5.0 1 1 11 1 . . . . . 0.0 0.0 9.0 1 1 12 1 . . . . . 0.0 0.0 5.0 1 1 13 1 . . . . . 0.0 0.0 5.0 1 1 14 1 . . . . . 0.0 0.0 5.0 1 1 15 1 . . . . . 0.0 0.0 6.0 1 1 16 1 . . . . . 0.0 0.0 6.0 1 1 17 1 . . . . . 0.0 0.0 6.0 1 1 18 1 . . . . . 0.0 0.0 6.0 1 1 19 1 . . . . . 0.0 0.0 5.0 1 1 20 1 . . . . . 0.0 0.0 7.0 1 1 21 1 . . . . . 0.0 0.0 9.0 1 1 22 1 . . . . . 0.0 0.0 9.5 1 1 23 1 . . . . . 0.0 0.0 7.5 1 1 24 1 . . . . . 0.0 0.0 9.5 1 1 25 1 . . . . . 0.0 0.0 7.5 1 1 26 1 . . . . . 0.0 0.0 6.5 1 1 27 1 . . . . . 0.0 0.0 8.0 1 1 28 1 . . . . . 0.0 0.0 7.0 1 1 29 1 . . . . . 0.0 0.0 7.0 1 1 30 1 . . . . . 0.0 0.0 7.0 1 1 31 1 . . . . . 0.0 0.0 7.0 1 1 32 1 . . . . . 0.0 0.0 6.0 1 1 33 1 . . . . . 0.0 0.0 6.0 1 1 34 1 . . . . . 0.0 0.0 3.5 1 1 35 1 . . . . . 0.0 0.0 5.0 1 1 36 1 . . . . . 0.0 0.0 3.5 1 1 37 1 . . . . . 0.0 0.0 2.9 1 1 38 1 . . . . . 0.0 0.0 5.0 1 1 39 1 . . . . . 0.0 0.0 2.7 1 1 40 1 . . . . . 0.0 0.0 7.0 1 1 41 1 . . . . . 0.0 0.0 6.0 1 1 42 1 . . . . . 0.0 0.0 6.0 1 1 43 1 . . . . . 0.0 0.0 5.0 1 1 44 1 . . . . . 0.0 0.0 5.0 1 1 45 1 . . . . . 0.0 0.0 5.0 1 1 46 1 . . . . . 0.0 0.0 5.0 1 1 47 1 . . . . . 0.0 0.0 6.0 1 1 48 1 . . . . . 0.0 0.0 6.0 1 1 49 1 . . . . . 0.0 0.0 6.0 1 1 50 1 . . . . . 0.0 0.0 7.0 1 1 51 1 . . . . . 0.0 0.0 2.7 1 1 52 1 . . . . . 0.0 0.0 5.0 1 1 53 1 . . . . . 0.0 0.0 5.0 1 1 54 1 . . . . . 0.0 0.0 5.0 1 1 55 1 . . . . . 0.0 0.0 6.0 1 1 56 1 . . . . . 0.0 0.0 7.0 1 1 57 1 . . . . . 0.0 0.0 3.5 1 1 58 1 . . . . . 0.0 0.0 7.0 1 1 59 1 . . . . . 0.0 0.0 6.0 1 1 60 1 . . . . . 0.0 0.0 5.0 1 1 61 1 . . . . . 0.0 0.0 5.0 1 1 62 1 . . . . . 0.0 0.0 5.0 1 1 63 1 . . . . . 0.0 0.0 6.0 1 1 64 1 . . . . . 0.0 0.0 5.0 1 1 65 1 . . . . . 0.0 0.0 3.5 1 1 66 1 . . . . . 0.0 0.0 5.0 1 1 67 1 . . . . . 0.0 0.0 5.0 1 1 68 1 . . . . . 0.0 0.0 5.0 1 1 69 1 . . . . . 0.0 0.0 5.0 1 1 70 1 . . . . . 0.0 0.0 6.0 1 1 71 1 . . . . . 0.0 0.0 5.0 1 1 72 1 . . . . . 0.0 0.0 5.0 1 1 73 1 . . . . . 0.0 0.0 3.5 1 1 74 1 . . . . . 0.0 0.0 6.0 1 1 75 1 . . . . . 0.0 0.0 5.0 1 1 76 1 . . . . . 0.0 0.0 5.0 1 1 77 1 . . . . . 0.0 0.0 5.0 1 1 78 1 . . . . . 0.0 0.0 5.0 1 1 79 1 . . . . . 0.0 0.0 6.0 1 1 80 1 . . . . . 0.0 0.0 6.0 1 1 81 1 . . . . . 0.0 0.0 5.0 1 1 82 1 . . . . . 0.0 0.0 6.0 1 1 83 1 . . . . . 0.0 0.0 6.0 1 1 84 1 . . . . . 0.0 0.0 6.0 1 1 85 1 . . . . . 0.0 0.0 2.7 1 1 86 1 . . . . . 0.0 0.0 5.0 1 1 87 1 . . . . . 0.0 0.0 5.0 1 1 88 1 . . . . . 0.0 0.0 2.7 1 1 89 1 . . . . . 0.0 0.0 5.0 1 1 90 1 . . . . . 0.0 0.0 2.7 1 1 91 1 . . . . . 0.0 0.0 5.0 1 1 92 1 . . . . . 0.0 0.0 5.0 1 1 93 1 . . . . . 0.0 0.0 3.5 1 1 94 1 . . . . . 0.0 0.0 6.0 1 1 95 1 . . . . . 0.0 0.0 5.0 1 1 96 1 . . . . . 0.0 0.0 5.0 1 1 97 1 . . . . . 0.0 0.0 5.0 1 1 98 1 . . . . . 0.0 0.0 2.9 1 1 99 1 . . . . . 0.0 0.0 5.0 1 1 100 1 . . . . . 0.0 0.0 5.0 1 1 101 1 . . . . . 0.0 0.0 5.0 1 1 102 1 . . . . . 0.0 0.0 4.5 1 1 103 1 . . . . . 0.0 0.0 5.0 1 1 104 1 . . . . . 0.0 0.0 5.0 1 1 105 1 . . . . . 0.0 0.0 5.0 1 1 106 1 . . . . . 0.0 0.0 5.0 1 1 107 1 . . . . . 0.0 0.0 6.0 1 1 108 1 . . . . . 0.0 0.0 6.0 1 1 109 1 . . . . . 0.0 0.0 6.0 1 1 110 1 . . . . . 0.0 0.0 2.7 1 1 111 1 . . . . . 0.0 0.0 6.0 1 1 112 1 . . . . . 0.0 0.0 6.0 1 1 113 1 . . . . . 0.0 0.0 6.0 1 1 114 1 . . . . . 0.0 0.0 2.9 1 1 115 1 . . . . . 0.0 0.0 5.0 1 1 116 1 . . . . . 0.0 0.0 6.0 1 1 117 1 . . . . . 0.0 0.0 5.0 1 1 118 1 . . . . . 0.0 0.0 6.0 1 1 119 1 . . . . . 0.0 0.0 5.0 1 1 120 1 . . . . . 0.0 0.0 3.5 1 1 121 1 . . . . . 0.0 0.0 6.0 1 1 122 1 . . . . . 0.0 0.0 6.0 1 1 123 1 . . . . . 0.0 0.0 5.0 1 1 124 1 . . . . . 0.0 0.0 7.0 1 1 125 1 . . . . . 0.0 0.0 2.7 1 1 126 1 . . . . . 0.0 0.0 9.5 1 1 127 1 . . . . . 0.0 0.0 6.0 1 1 128 1 . . . . . 0.0 0.0 6.0 1 1 129 1 . . . . . 0.0 0.0 6.0 1 1 130 1 . . . . . 0.0 0.0 5.0 1 1 131 1 . . . . . 0.0 0.0 2.9 1 1 132 1 . . . . . 0.0 0.0 6.0 1 1 133 1 . . . . . 0.0 0.0 5.0 1 1 134 1 . . . . . 0.0 0.0 6.0 1 1 135 1 . . . . . 0.0 0.0 5.0 1 1 136 1 . . . . . 0.0 0.0 5.0 1 1 137 1 . . . . . 0.0 0.0 5.0 1 1 138 1 . . . . . 0.0 0.0 3.5 1 1 139 1 . . . . . 0.0 0.0 3.7 1 1 140 1 . . . . . 0.0 0.0 5.0 1 1 141 1 . . . . . 0.0 0.0 5.0 1 1 142 1 . . . . . 0.0 0.0 3.5 1 1 143 1 . . . . . 0.0 0.0 5.0 1 1 144 1 . . . . . 0.0 0.0 6.0 1 1 145 1 . . . . . 0.0 0.0 5.0 1 1 146 1 . . . . . 0.0 0.0 5.5 1 1 147 1 . . . . . 0.0 0.0 4.0 1 1 148 1 . . . . . 0.0 0.0 6.5 1 1 149 1 . . . . . 0.0 0.0 6.5 1 1 150 1 . . . . . 0.0 0.0 5.5 1 1 151 1 . . . . . 0.0 0.0 5.5 1 1 152 1 . . . . . 0.0 0.0 6.5 1 1 153 1 . . . . . 0.0 0.0 5.0 1 1 154 1 . . . . . 0.0 0.0 3.7 1 1 155 1 . . . . . 0.0 0.0 4.5 1 1 156 1 . . . . . 0.0 0.0 5.0 1 1 157 1 . . . . . 0.0 0.0 5.0 1 1 158 1 . . . . . 0.0 0.0 3.5 1 1 159 1 . . . . . 0.0 0.0 6.0 1 1 160 1 . . . . . 0.0 0.0 6.0 1 1 161 1 . . . . . 0.0 0.0 5.0 1 1 162 1 . . . . . 0.0 0.0 5.0 1 1 163 1 . . . . . 0.0 0.0 6.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _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 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 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 16 CYS O . 16 . O 1 2 1 1 2 1 1 19 HIS H . 19 . HN 1 2 2 1 1 1 1 16 CYS O . 16 . O 1 2 2 1 2 1 1 19 HIS N . 19 . N 1 2 3 1 1 1 1 10 SER O . 10 . O 1 2 3 1 2 1 1 13 SER H . 13 . HN 1 2 4 1 1 1 1 10 SER O . 10 . O 1 2 4 1 2 1 1 13 SER N . 13 . N 1 2 5 1 1 1 1 13 SER O . 13 . O 1 2 5 1 2 1 1 17 LYS H . 17 . HN 1 2 6 1 1 1 1 13 SER O . 13 . O 1 2 6 1 2 1 1 17 LYS N . 17 . N 1 2 7 1 1 1 1 3 LEU O . 3 . O 1 2 7 1 2 1 1 7 PHE H . 7 . HN 1 2 8 1 1 1 1 3 LEU O . 3 . O 1 2 8 1 2 1 1 7 PHE N . 7 . N 1 2 9 1 1 1 1 7 PHE O . 7 . O 1 2 9 1 2 1 1 10 SER H . 10 . HN 1 2 10 1 1 1 1 7 PHE O . 7 . O 1 2 10 1 2 1 1 10 SER N . 10 . N 1 2 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 . . . . . 1.88 1.58 2.3 1 2 2 1 . . . . . 1.88 1.58 3.2 1 2 3 1 . . . . . 1.88 1.58 2.3 1 2 4 1 . . . . . 1.88 1.58 3.2 1 2 5 1 . . . . . 1.88 1.58 2.3 1 2 6 1 . . . . . 1.88 1.58 3.2 1 2 7 1 . . . . . 1.88 1.58 2.3 1 2 8 1 . . . . . 1.88 1.58 3.2 1 2 9 1 . . . . . 1.88 1.58 2.3 1 2 10 1 . . . . . 1.88 1.58 3.2 1 2 stop_ save_ save_CNS/XPLOR_dihedral_4 _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 11 CYS C 1 1 12 ARG N 1 1 12 ARG CA 1 1 12 ARG C -160.0 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 2 . 1 1 13 SER C 1 1 14 ARG N 1 1 14 ARG CA 1 1 14 ARG C -95.0 -35.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 3 . 1 1 14 ARG C 1 1 15 GLN N 1 1 15 GLN CA 1 1 15 GLN C -95.0 -35.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 4 . 1 1 15 GLN C 1 1 16 CYS N 1 1 16 CYS CA 1 1 16 CYS C -160.0 -80.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 5 . 1 1 16 CYS C 1 1 17 LYS N 1 1 17 LYS CA 1 1 17 LYS C -95.0 -35.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 6 . 1 1 6 GLY C 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE C -160.0 -80.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 7 . 1 1 9 LYS C 1 1 10 SER N 1 1 10 SER CA 1 1 10 SER C -95.0 -35.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 8 . 1 1 19 HIS C 1 1 20 ARG N 1 1 20 ARG CA 1 1 20 ARG C -95.0 -35.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 9 . 1 1 2 ARG C 1 1 3 LEU N 1 1 3 LEU CA 1 1 3 LEU C -95.0 -35.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 10 . 1 1 3 LEU C 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS C -95.0 -35.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 11 . 1 1 20 ARG C 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS C -160.0 -20.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 12 . 1 1 18 HYP C 1 1 19 HIS N 1 1 19 HIS CA 1 1 19 HIS C -95.0 -35.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 13 . 1 1 1 PCA C 1 1 2 ARG N 1 1 2 ARG CA 1 1 2 ARG C -160.0 -20.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 14 . 1 1 4 CYS C 1 1 5 CYS N 1 1 5 CYS CA 1 1 5 CYS C -95.0 -35.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 15 . 1 1 8 HYP C 1 1 9 LYS N 1 1 9 LYS CA 1 1 9 LYS C -95.0 -35.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 16 . 1 1 10 SER C 1 1 11 CYS N 1 1 11 CYS CA 1 1 11 CYS C -95.0 -35.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 17 . 1 1 7 PHE C 1 1 8 HYP N 1 1 8 HYP CA 1 1 8 HYP C -105.0 -25.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 18 . 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE C 1 1 8 HYP N 0.0 240.0 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 19 . 1 1 17 LYS C 1 1 18 HYP N 1 1 18 HYP CA 1 1 18 HYP C -105.0 -25.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 20 . 1 1 17 LYS N 1 1 17 LYS CA 1 1 17 LYS C 1 1 18 HYP N -120.0 0.0 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 21 . 1 1 15 GLN N 1 1 15 GLN CA 1 1 15 GLN CB 1 1 15 GLN CG 150.0 210.0 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1 22 . 1 1 14 ARG N 1 1 14 ARG CA 1 1 14 ARG CB 1 1 14 ARG CG 150.0 210.0 . 14 . N . 14 . CA . 14 . CB . 14 . CG 1 1 23 . 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS CB 1 1 4 CYS SG -89.99999 -30.0 . 4 . N . 4 . CA . 4 . CB . 4 . SG 1 1 24 . 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE CB 1 1 7 PHE CG 30.0 89.99999 . 7 . N . 7 . CA . 7 . CB . 7 . CG 1 1 25 . 1 1 10 SER N 1 1 10 SER CA 1 1 10 SER CB 1 1 10 SER OG -89.99999 -30.0 . 10 . N . 10 . CA . 10 . CB . 10 . OG 1 1 26 . 1 1 12 ARG N 1 1 12 ARG CA 1 1 12 ARG CB 1 1 12 ARG CG 150.0 210.0 . 12 . N . 12 . CA . 12 . CB . 12 . CG 1 1 27 . 1 1 16 CYS N 1 1 16 CYS CA 1 1 16 CYS CB 1 1 16 CYS SG -89.99999 -30.0 . 16 . N . 16 . CA . 16 . CB . 16 . SG 1 1 28 . 1 1 19 HIS N 1 1 19 HIS CA 1 1 19 HIS CB 1 1 19 HIS CG -89.99999 -30.0 . 19 . N . 19 . CA . 19 . CB . 19 . CG 1 1 29 . 1 1 20 ARG N 1 1 20 ARG CA 1 1 20 ARG CB 1 1 20 ARG CG -89.99999 -30.0 . 20 . N . 20 . CA . 20 . CB . 20 . CG 1 1 30 . 1 1 21 CYS N 1 1 21 CYS CA 1 1 21 CYS CB 1 1 21 CYS SG -89.99999 -30.0 . 21 . N . 21 . CA . 21 . CB . 21 . SG 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 PCA C C -4.982 3.636 2.985 1.00 . A A . 1 PCA C 1 1 1 2 1 1 1 PCA CA C -6.432 3.231 2.675 1.00 . A A . 1 PCA CA 1 1 1 3 1 1 1 PCA CB C -6.713 1.752 3.007 1.00 . A A . 1 PCA CB 1 1 1 4 1 1 1 PCA CD C -7.195 2.112 0.705 1.00 . A A . 1 PCA CD 1 1 1 5 1 1 1 PCA CG C -7.513 1.182 1.844 1.00 . A A . 1 PCA CG 1 1 1 6 1 1 1 PCA HA H -7.098 3.860 3.247 1.00 . A A . 1 PCA HA 1 1 1 7 1 1 1 PCA HB2 H -7.266 1.689 3.934 1.00 . A A . 1 PCA HB2 1 1 1 8 1 1 1 PCA HB3 H -5.789 1.210 3.146 1.00 . A A . 1 PCA HB3 1 1 1 9 1 1 1 PCA HG2 H -8.569 1.200 2.068 1.00 . A A . 1 PCA HG2 1 1 1 10 1 1 1 PCA HG3 H -7.188 0.176 1.621 1.00 . A A . 1 PCA HG3 1 1 1 11 1 1 1 PCA N N -6.750 3.394 1.240 1.00 . A A . 1 PCA N 1 1 1 12 1 1 1 PCA O O -4.333 4.253 2.163 1.00 . A A . 1 PCA O 1 1 1 13 1 1 1 PCA OE O -7.297 1.828 -0.473 1.00 . A A . 1 PCA OE 1 1 1 14 1 1 2 ARG C C -2.200 2.476 4.115 1.00 . A A . 2 ARG C 1 1 1 15 1 1 2 ARG CA C -3.149 3.586 4.611 1.00 . A A . 2 ARG CA 1 1 1 16 1 1 2 ARG CB C -3.137 3.667 6.158 1.00 . A A . 2 ARG CB 1 1 1 17 1 1 2 ARG CD C -4.053 4.830 8.184 1.00 . A A . 2 ARG CD 1 1 1 18 1 1 2 ARG CG C -4.100 4.769 6.643 1.00 . A A . 2 ARG CG 1 1 1 19 1 1 2 ARG CZ C -4.707 7.166 8.583 1.00 . A A . 2 ARG CZ 1 1 1 20 1 1 2 ARG H H -5.138 2.774 4.763 1.00 . A A . 2 ARG H 1 1 1 21 1 1 2 ARG HA H -2.840 4.528 4.182 1.00 . A A . 2 ARG HA 1 1 1 22 1 1 2 ARG HB2 H -3.442 2.716 6.571 1.00 . A A . 2 ARG HB2 1 1 1 23 1 1 2 ARG HB3 H -2.140 3.886 6.509 1.00 . A A . 2 ARG HB3 1 1 1 24 1 1 2 ARG HD2 H -4.361 3.885 8.606 1.00 . A A . 2 ARG HD2 1 1 1 25 1 1 2 ARG HD3 H -3.057 5.061 8.534 1.00 . A A . 2 ARG HD3 1 1 1 26 1 1 2 ARG HE H -5.865 5.624 9.028 1.00 . A A . 2 ARG HE 1 1 1 27 1 1 2 ARG HG2 H -3.804 5.720 6.227 1.00 . A A . 2 ARG HG2 1 1 1 28 1 1 2 ARG HG3 H -5.109 4.550 6.322 1.00 . A A . 2 ARG HG3 1 1 1 29 1 1 2 ARG HH11 H -2.896 6.896 7.761 1.00 . A A . 2 ARG HH11 1 1 1 30 1 1 2 ARG HH12 H -3.354 8.541 8.043 1.00 . A A . 2 ARG HH12 1 1 1 31 1 1 2 ARG HH21 H -6.459 7.694 9.393 1.00 . A A . 2 ARG HH21 1 1 1 32 1 1 2 ARG HH22 H -5.401 9.002 8.979 1.00 . A A . 2 ARG HH22 1 1 1 33 1 1 2 ARG N N -4.541 3.268 4.162 1.00 . A A . 2 ARG N 1 1 1 34 1 1 2 ARG NE N -5.000 5.891 8.654 1.00 . A A . 2 ARG NE 1 1 1 35 1 1 2 ARG NH1 N -3.563 7.563 8.090 1.00 . A A . 2 ARG NH1 1 1 1 36 1 1 2 ARG NH2 N -5.591 8.021 9.019 1.00 . A A . 2 ARG NH2 1 1 1 37 1 1 2 ARG O O -1.370 1.982 4.850 1.00 . A A . 2 ARG O 1 1 1 38 1 1 3 LEU C C 0.005 1.339 2.194 1.00 . A A . 3 LEU C 1 1 1 39 1 1 3 LEU CA C -1.521 1.058 2.226 1.00 . A A . 3 LEU CA 1 1 1 40 1 1 3 LEU CB C -2.100 0.859 0.787 1.00 . A A . 3 LEU CB 1 1 1 41 1 1 3 LEU CD1 C -4.092 0.357 -0.656 1.00 . A A . 3 LEU CD1 1 1 1 42 1 1 3 LEU CD2 C -3.765 -0.941 1.463 1.00 . A A . 3 LEU CD2 1 1 1 43 1 1 3 LEU CG C -3.598 0.450 0.805 1.00 . A A . 3 LEU CG 1 1 1 44 1 1 3 LEU H H -3.037 2.574 2.329 1.00 . A A . 3 LEU H 1 1 1 45 1 1 3 LEU HA H -1.649 0.152 2.790 1.00 . A A . 3 LEU HA 1 1 1 46 1 1 3 LEU HB2 H -1.981 1.775 0.226 1.00 . A A . 3 LEU HB2 1 1 1 47 1 1 3 LEU HB3 H -1.554 0.076 0.282 1.00 . A A . 3 LEU HB3 1 1 1 48 1 1 3 LEU HD11 H -3.983 1.314 -1.145 1.00 . A A . 3 LEU HD11 1 1 1 49 1 1 3 LEU HD12 H -5.134 0.074 -0.684 1.00 . A A . 3 LEU HD12 1 1 1 50 1 1 3 LEU HD13 H -3.519 -0.379 -1.205 1.00 . A A . 3 LEU HD13 1 1 1 51 1 1 3 LEU HD21 H -3.205 -1.685 0.916 1.00 . A A . 3 LEU HD21 1 1 1 52 1 1 3 LEU HD22 H -4.807 -1.224 1.466 1.00 . A A . 3 LEU HD22 1 1 1 53 1 1 3 LEU HD23 H -3.412 -0.926 2.484 1.00 . A A . 3 LEU HD23 1 1 1 54 1 1 3 LEU HG H -4.184 1.185 1.338 1.00 . A A . 3 LEU HG 1 1 1 55 1 1 3 LEU N N -2.354 2.124 2.865 1.00 . A A . 3 LEU N 1 1 1 56 1 1 3 LEU O O 0.602 1.710 3.184 1.00 . A A . 3 LEU O 1 1 1 57 1 1 4 CYS C C 2.731 2.451 1.532 1.00 . A A . 4 CYS C 1 1 1 58 1 1 4 CYS CA C 2.030 1.340 0.757 1.00 . A A . 4 CYS CA 1 1 1 59 1 1 4 CYS CB C 2.223 1.648 -0.722 1.00 . A A . 4 CYS CB 1 1 1 60 1 1 4 CYS H H 0.032 0.827 0.299 1.00 . A A . 4 CYS H 1 1 1 61 1 1 4 CYS HA H 2.541 0.419 0.972 1.00 . A A . 4 CYS HA 1 1 1 62 1 1 4 CYS HB2 H 1.835 2.620 -0.926 1.00 . A A . 4 CYS HB2 1 1 1 63 1 1 4 CYS HB3 H 3.287 1.724 -0.888 1.00 . A A . 4 CYS HB3 1 1 1 64 1 1 4 CYS N N 0.580 1.142 1.036 1.00 . A A . 4 CYS N 1 1 1 65 1 1 4 CYS O O 3.732 2.200 2.176 1.00 . A A . 4 CYS O 1 1 1 66 1 1 4 CYS SG S 1.579 0.587 -2.036 1.00 . A A . 4 CYS SG 1 1 1 67 1 1 5 CYS C C 2.186 5.022 3.543 1.00 . A A . 5 CYS C 1 1 1 68 1 1 5 CYS CA C 2.824 4.781 2.166 1.00 . A A . 5 CYS CA 1 1 1 69 1 1 5 CYS CB C 2.702 6.019 1.235 1.00 . A A . 5 CYS CB 1 1 1 70 1 1 5 CYS H H 1.365 3.748 0.924 1.00 . A A . 5 CYS H 1 1 1 71 1 1 5 CYS HA H 3.858 4.541 2.317 1.00 . A A . 5 CYS HA 1 1 1 72 1 1 5 CYS HB2 H 2.842 5.671 0.222 1.00 . A A . 5 CYS HB2 1 1 1 73 1 1 5 CYS HB3 H 1.695 6.404 1.305 1.00 . A A . 5 CYS HB3 1 1 1 74 1 1 5 CYS N N 2.185 3.636 1.449 1.00 . A A . 5 CYS N 1 1 1 75 1 1 5 CYS O O 2.776 5.669 4.385 1.00 . A A . 5 CYS O 1 1 1 76 1 1 5 CYS SG S 3.836 7.423 1.427 1.00 . A A . 5 CYS SG 1 1 1 77 1 1 6 GLY C C 1.083 3.886 6.128 1.00 . A A . 6 GLY C 1 1 1 78 1 1 6 GLY CA C 0.317 4.682 5.064 1.00 . A A . 6 GLY CA 1 1 1 79 1 1 6 GLY H H 0.566 3.977 3.041 1.00 . A A . 6 GLY H 1 1 1 80 1 1 6 GLY HA2 H 0.309 5.730 5.325 1.00 . A A . 6 GLY HA2 1 1 1 81 1 1 6 GLY HA3 H -0.692 4.322 4.994 1.00 . A A . 6 GLY HA3 1 1 1 82 1 1 6 GLY N N 1.003 4.495 3.748 1.00 . A A . 6 GLY N 1 1 1 83 1 1 6 GLY O O 1.555 4.451 7.096 1.00 . A A . 6 GLY O 1 1 1 84 1 1 7 PHE C C 2.851 0.735 6.093 1.00 . A A . 7 PHE C 1 1 1 85 1 1 7 PHE CA C 1.905 1.696 6.853 1.00 . A A . 7 PHE CA 1 1 1 86 1 1 7 PHE CB C 0.851 0.898 7.715 1.00 . A A . 7 PHE CB 1 1 1 87 1 1 7 PHE CD1 C 0.188 -0.938 6.059 1.00 . A A . 7 PHE CD1 1 1 1 88 1 1 7 PHE CD2 C -1.528 0.401 7.021 1.00 . A A . 7 PHE CD2 1 1 1 89 1 1 7 PHE CE1 C -0.757 -1.638 5.347 1.00 . A A . 7 PHE CE1 1 1 1 90 1 1 7 PHE CE2 C -2.476 -0.303 6.305 1.00 . A A . 7 PHE CE2 1 1 1 91 1 1 7 PHE CG C -0.183 0.091 6.904 1.00 . A A . 7 PHE CG 1 1 1 92 1 1 7 PHE CZ C -2.088 -1.323 5.466 1.00 . A A . 7 PHE CZ 1 1 1 93 1 1 7 PHE H H 0.764 2.220 5.103 1.00 . A A . 7 PHE H 1 1 1 94 1 1 7 PHE HA H 2.499 2.309 7.513 1.00 . A A . 7 PHE HA 1 1 1 95 1 1 7 PHE HB2 H 1.369 0.211 8.367 1.00 . A A . 7 PHE HB2 1 1 1 96 1 1 7 PHE HB3 H 0.323 1.602 8.341 1.00 . A A . 7 PHE HB3 1 1 1 97 1 1 7 PHE HD1 H 1.225 -1.209 5.955 1.00 . A A . 7 PHE HD1 1 1 1 98 1 1 7 PHE HD2 H -1.842 1.198 7.677 1.00 . A A . 7 PHE HD2 1 1 1 99 1 1 7 PHE HE1 H -0.452 -2.442 4.694 1.00 . A A . 7 PHE HE1 1 1 1 100 1 1 7 PHE HE2 H -3.522 -0.052 6.405 1.00 . A A . 7 PHE HE2 1 1 1 101 1 1 7 PHE HZ H -2.822 -1.874 4.899 1.00 . A A . 7 PHE HZ 1 1 1 102 1 1 7 PHE N N 1.179 2.597 5.906 1.00 . A A . 7 PHE N 1 1 1 103 1 1 7 PHE O O 2.580 0.328 4.975 1.00 . A A . 7 PHE O 1 1 1 104 1 1 8 HYP C C 4.773 -1.708 5.646 1.00 . A A . 8 HYP C 1 1 1 105 1 1 8 HYP CA C 5.088 -0.272 6.078 1.00 . A A . 8 HYP CA 1 1 1 106 1 1 8 HYP CB C 6.218 -0.189 7.098 1.00 . A A . 8 HYP CB 1 1 1 107 1 1 8 HYP CD C 4.241 0.609 8.173 1.00 . A A . 8 HYP CD 1 1 1 108 1 1 8 HYP CG C 5.505 -0.177 8.404 1.00 . A A . 8 HYP CG 1 1 1 109 1 1 8 HYP HA H 5.393 0.282 5.202 1.00 . A A . 8 HYP HA 1 1 1 110 1 1 8 HYP HB2 H 6.798 0.709 6.940 1.00 . A A . 8 HYP HB2 1 1 1 111 1 1 8 HYP HB3 H 6.885 -1.034 7.008 1.00 . A A . 8 HYP HB3 1 1 1 112 1 1 8 HYP HD1 H 5.796 0.472 10.212 1.00 . A A . 8 HYP HD1 1 1 1 113 1 1 8 HYP HD22 H 4.403 1.656 8.384 1.00 . A A . 8 HYP HD22 1 1 1 114 1 1 8 HYP HD23 H 3.450 0.216 8.793 1.00 . A A . 8 HYP HD23 1 1 1 115 1 1 8 HYP HG H 5.267 -1.189 8.701 1.00 . A A . 8 HYP HG 1 1 1 116 1 1 8 HYP N N 3.949 0.397 6.736 1.00 . A A . 8 HYP N 1 1 1 117 1 1 8 HYP O O 5.548 -2.299 4.918 1.00 . A A . 8 HYP O 1 1 1 118 1 1 8 HYP OD1 O 6.305 0.443 9.400 1.00 . A A . 8 HYP OD1 1 1 1 119 1 1 9 LYS C C 3.046 -3.695 4.226 1.00 . A A . 9 LYS C 1 1 1 120 1 1 9 LYS CA C 3.266 -3.605 5.738 1.00 . A A . 9 LYS CA 1 1 1 121 1 1 9 LYS CB C 1.966 -4.005 6.479 1.00 . A A . 9 LYS CB 1 1 1 122 1 1 9 LYS CD C 0.934 -4.396 8.794 1.00 . A A . 9 LYS CD 1 1 1 123 1 1 9 LYS CE C -0.280 -3.485 8.523 1.00 . A A . 9 LYS CE 1 1 1 124 1 1 9 LYS CG C 2.198 -3.937 8.012 1.00 . A A . 9 LYS CG 1 1 1 125 1 1 9 LYS H H 3.075 -1.679 6.688 1.00 . A A . 9 LYS H 1 1 1 126 1 1 9 LYS HA H 4.069 -4.274 6.015 1.00 . A A . 9 LYS HA 1 1 1 127 1 1 9 LYS HB2 H 1.163 -3.351 6.188 1.00 . A A . 9 LYS HB2 1 1 1 128 1 1 9 LYS HB3 H 1.697 -5.016 6.207 1.00 . A A . 9 LYS HB3 1 1 1 129 1 1 9 LYS HD2 H 0.688 -5.410 8.513 1.00 . A A . 9 LYS HD2 1 1 1 130 1 1 9 LYS HD3 H 1.155 -4.386 9.852 1.00 . A A . 9 LYS HD3 1 1 1 131 1 1 9 LYS HE2 H -0.547 -3.488 7.478 1.00 . A A . 9 LYS HE2 1 1 1 132 1 1 9 LYS HE3 H -1.128 -3.832 9.095 1.00 . A A . 9 LYS HE3 1 1 1 133 1 1 9 LYS HG2 H 3.026 -4.578 8.278 1.00 . A A . 9 LYS HG2 1 1 1 134 1 1 9 LYS HG3 H 2.448 -2.926 8.299 1.00 . A A . 9 LYS HG3 1 1 1 135 1 1 9 LYS HZ1 H -0.808 -1.488 8.785 1.00 . A A . 9 LYS HZ1 1 1 1 136 1 1 9 LYS HZ2 H 0.823 -1.728 8.376 1.00 . A A . 9 LYS HZ2 1 1 1 137 1 1 9 LYS HZ3 H 0.283 -2.077 9.949 1.00 . A A . 9 LYS HZ3 1 1 1 138 1 1 9 LYS N N 3.655 -2.213 6.106 1.00 . A A . 9 LYS N 1 1 1 139 1 1 9 LYS NZ N 0.027 -2.088 8.940 1.00 . A A . 9 LYS NZ 1 1 1 140 1 1 9 LYS O O 3.348 -4.721 3.643 1.00 . A A . 9 LYS O 1 1 1 141 1 1 10 SER C C 3.627 -2.450 1.381 1.00 . A A . 10 SER C 1 1 1 142 1 1 10 SER CA C 2.317 -2.698 2.151 1.00 . A A . 10 SER CA 1 1 1 143 1 1 10 SER CB C 1.269 -1.652 1.803 1.00 . A A . 10 SER CB 1 1 1 144 1 1 10 SER H H 2.295 -1.811 4.092 1.00 . A A . 10 SER H 1 1 1 145 1 1 10 SER HA H 1.945 -3.677 1.886 1.00 . A A . 10 SER HA 1 1 1 146 1 1 10 SER HB2 H 1.546 -0.715 2.255 1.00 . A A . 10 SER HB2 1 1 1 147 1 1 10 SER HB3 H 1.106 -1.548 0.741 1.00 . A A . 10 SER HB3 1 1 1 148 1 1 10 SER HG H -0.488 -2.487 1.760 1.00 . A A . 10 SER HG 1 1 1 149 1 1 10 SER N N 2.539 -2.642 3.621 1.00 . A A . 10 SER N 1 1 1 150 1 1 10 SER O O 3.739 -2.898 0.259 1.00 . A A . 10 SER O 1 1 1 151 1 1 10 SER OG O 0.081 -2.107 2.433 1.00 . A A . 10 SER OG 1 1 1 152 1 1 11 CYS C C 6.650 -2.721 0.810 1.00 . A A . 11 CYS C 1 1 1 153 1 1 11 CYS CA C 5.886 -1.480 1.296 1.00 . A A . 11 CYS CA 1 1 1 154 1 1 11 CYS CB C 6.845 -0.712 2.225 1.00 . A A . 11 CYS CB 1 1 1 155 1 1 11 CYS H H 4.423 -1.427 2.894 1.00 . A A . 11 CYS H 1 1 1 156 1 1 11 CYS HA H 5.691 -0.856 0.440 1.00 . A A . 11 CYS HA 1 1 1 157 1 1 11 CYS HB2 H 6.949 -1.279 3.137 1.00 . A A . 11 CYS HB2 1 1 1 158 1 1 11 CYS HB3 H 7.820 -0.686 1.760 1.00 . A A . 11 CYS HB3 1 1 1 159 1 1 11 CYS N N 4.575 -1.761 1.986 1.00 . A A . 11 CYS N 1 1 1 160 1 1 11 CYS O O 7.586 -2.598 0.043 1.00 . A A . 11 CYS O 1 1 1 161 1 1 11 CYS SG S 6.467 0.990 2.697 1.00 . A A . 11 CYS SG 1 1 1 162 1 1 12 ARG C C 6.446 -5.549 -0.566 1.00 . A A . 12 ARG C 1 1 1 163 1 1 12 ARG CA C 6.910 -5.142 0.850 1.00 . A A . 12 ARG CA 1 1 1 164 1 1 12 ARG CB C 6.547 -6.194 1.919 1.00 . A A . 12 ARG CB 1 1 1 165 1 1 12 ARG CD C 6.904 -8.549 2.792 1.00 . A A . 12 ARG CD 1 1 1 166 1 1 12 ARG CG C 7.274 -7.539 1.681 1.00 . A A . 12 ARG CG 1 1 1 167 1 1 12 ARG CZ C 6.533 -7.349 4.921 1.00 . A A . 12 ARG CZ 1 1 1 168 1 1 12 ARG H H 5.466 -3.909 1.871 1.00 . A A . 12 ARG H 1 1 1 169 1 1 12 ARG HA H 7.979 -4.984 0.840 1.00 . A A . 12 ARG HA 1 1 1 170 1 1 12 ARG HB2 H 6.827 -5.793 2.882 1.00 . A A . 12 ARG HB2 1 1 1 171 1 1 12 ARG HB3 H 5.477 -6.353 1.913 1.00 . A A . 12 ARG HB3 1 1 1 172 1 1 12 ARG HD2 H 5.843 -8.749 2.798 1.00 . A A . 12 ARG HD2 1 1 1 173 1 1 12 ARG HD3 H 7.428 -9.478 2.618 1.00 . A A . 12 ARG HD3 1 1 1 174 1 1 12 ARG HE H 8.264 -8.159 4.411 1.00 . A A . 12 ARG HE 1 1 1 175 1 1 12 ARG HG2 H 6.987 -7.960 0.728 1.00 . A A . 12 ARG HG2 1 1 1 176 1 1 12 ARG HG3 H 8.343 -7.380 1.681 1.00 . A A . 12 ARG HG3 1 1 1 177 1 1 12 ARG HH11 H 4.930 -7.447 3.714 1.00 . A A . 12 ARG HH11 1 1 1 178 1 1 12 ARG HH12 H 4.694 -6.616 5.213 1.00 . A A . 12 ARG HH12 1 1 1 179 1 1 12 ARG HH21 H 7.968 -7.110 6.294 1.00 . A A . 12 ARG HH21 1 1 1 180 1 1 12 ARG HH22 H 6.429 -6.419 6.690 1.00 . A A . 12 ARG HH22 1 1 1 181 1 1 12 ARG N N 6.231 -3.874 1.260 1.00 . A A . 12 ARG N 1 1 1 182 1 1 12 ARG NE N 7.340 -8.011 4.123 1.00 . A A . 12 ARG NE 1 1 1 183 1 1 12 ARG NH1 N 5.289 -7.121 4.589 1.00 . A A . 12 ARG NH1 1 1 1 184 1 1 12 ARG NH2 N 7.014 -6.927 6.057 1.00 . A A . 12 ARG NH2 1 1 1 185 1 1 12 ARG O O 6.965 -6.480 -1.152 1.00 . A A . 12 ARG O 1 1 1 186 1 1 13 SER C C 5.820 -4.444 -3.497 1.00 . A A . 13 SER C 1 1 1 187 1 1 13 SER CA C 4.922 -5.091 -2.431 1.00 . A A . 13 SER CA 1 1 1 188 1 1 13 SER CB C 3.503 -4.503 -2.507 1.00 . A A . 13 SER CB 1 1 1 189 1 1 13 SER H H 5.111 -4.086 -0.547 1.00 . A A . 13 SER H 1 1 1 190 1 1 13 SER HA H 4.888 -6.159 -2.597 1.00 . A A . 13 SER HA 1 1 1 191 1 1 13 SER HB2 H 2.846 -4.961 -1.782 1.00 . A A . 13 SER HB2 1 1 1 192 1 1 13 SER HB3 H 3.513 -3.432 -2.376 1.00 . A A . 13 SER HB3 1 1 1 193 1 1 13 SER HG H 3.265 -5.722 -4.007 1.00 . A A . 13 SER HG 1 1 1 194 1 1 13 SER N N 5.478 -4.824 -1.072 1.00 . A A . 13 SER N 1 1 1 195 1 1 13 SER O O 6.506 -3.475 -3.235 1.00 . A A . 13 SER O 1 1 1 196 1 1 13 SER OG O 3.045 -4.807 -3.817 1.00 . A A . 13 SER OG 1 1 1 197 1 1 14 ARG C C 6.179 -3.081 -6.178 1.00 . A A . 14 ARG C 1 1 1 198 1 1 14 ARG CA C 6.578 -4.527 -5.830 1.00 . A A . 14 ARG CA 1 1 1 199 1 1 14 ARG CB C 6.315 -5.468 -7.034 1.00 . A A . 14 ARG CB 1 1 1 200 1 1 14 ARG CD C 8.606 -5.243 -8.236 1.00 . A A . 14 ARG CD 1 1 1 201 1 1 14 ARG CG C 7.073 -5.078 -8.342 1.00 . A A . 14 ARG CG 1 1 1 202 1 1 14 ARG CZ C 10.304 -4.588 -6.603 1.00 . A A . 14 ARG CZ 1 1 1 203 1 1 14 ARG H H 5.188 -5.800 -4.795 1.00 . A A . 14 ARG H 1 1 1 204 1 1 14 ARG HA H 7.614 -4.548 -5.534 1.00 . A A . 14 ARG HA 1 1 1 205 1 1 14 ARG HB2 H 6.606 -6.471 -6.754 1.00 . A A . 14 ARG HB2 1 1 1 206 1 1 14 ARG HB3 H 5.255 -5.482 -7.243 1.00 . A A . 14 ARG HB3 1 1 1 207 1 1 14 ARG HD2 H 8.833 -6.267 -7.976 1.00 . A A . 14 ARG HD2 1 1 1 208 1 1 14 ARG HD3 H 9.070 -5.010 -9.182 1.00 . A A . 14 ARG HD3 1 1 1 209 1 1 14 ARG HE H 8.661 -3.529 -6.937 1.00 . A A . 14 ARG HE 1 1 1 210 1 1 14 ARG HG2 H 6.719 -5.709 -9.146 1.00 . A A . 14 ARG HG2 1 1 1 211 1 1 14 ARG HG3 H 6.845 -4.054 -8.602 1.00 . A A . 14 ARG HG3 1 1 1 212 1 1 14 ARG HH11 H 10.665 -6.281 -7.619 1.00 . A A . 14 ARG HH11 1 1 1 213 1 1 14 ARG HH12 H 11.865 -5.831 -6.456 1.00 . A A . 14 ARG HH12 1 1 1 214 1 1 14 ARG HH21 H 10.181 -2.947 -5.470 1.00 . A A . 14 ARG HH21 1 1 1 215 1 1 14 ARG HH22 H 11.591 -3.921 -5.225 1.00 . A A . 14 ARG HH22 1 1 1 216 1 1 14 ARG N N 5.771 -5.022 -4.672 1.00 . A A . 14 ARG N 1 1 1 217 1 1 14 ARG NE N 9.162 -4.332 -7.190 1.00 . A A . 14 ARG NE 1 1 1 218 1 1 14 ARG NH1 N 10.998 -5.651 -6.918 1.00 . A A . 14 ARG NH1 1 1 1 219 1 1 14 ARG NH2 N 10.725 -3.754 -5.696 1.00 . A A . 14 ARG NH2 1 1 1 220 1 1 14 ARG O O 7.018 -2.229 -6.398 1.00 . A A . 14 ARG O 1 1 1 221 1 1 15 GLN C C 4.517 -0.532 -5.394 1.00 . A A . 15 GLN C 1 1 1 222 1 1 15 GLN CA C 4.296 -1.541 -6.532 1.00 . A A . 15 GLN CA 1 1 1 223 1 1 15 GLN CB C 2.785 -1.782 -6.818 1.00 . A A . 15 GLN CB 1 1 1 224 1 1 15 GLN CD C 1.950 0.598 -6.244 1.00 . A A . 15 GLN CD 1 1 1 225 1 1 15 GLN CG C 2.015 -0.515 -7.301 1.00 . A A . 15 GLN CG 1 1 1 226 1 1 15 GLN H H 4.283 -3.625 -6.011 1.00 . A A . 15 GLN H 1 1 1 227 1 1 15 GLN HA H 4.775 -1.164 -7.426 1.00 . A A . 15 GLN HA 1 1 1 228 1 1 15 GLN HB2 H 2.698 -2.542 -7.581 1.00 . A A . 15 GLN HB2 1 1 1 229 1 1 15 GLN HB3 H 2.315 -2.160 -5.922 1.00 . A A . 15 GLN HB3 1 1 1 230 1 1 15 GLN HE21 H 1.459 -0.634 -4.767 1.00 . A A . 15 GLN HE21 1 1 1 231 1 1 15 GLN HE22 H 1.602 1.003 -4.336 1.00 . A A . 15 GLN HE22 1 1 1 232 1 1 15 GLN HG2 H 2.496 -0.120 -8.184 1.00 . A A . 15 GLN HG2 1 1 1 233 1 1 15 GLN HG3 H 1.003 -0.791 -7.562 1.00 . A A . 15 GLN HG3 1 1 1 234 1 1 15 GLN N N 4.885 -2.877 -6.208 1.00 . A A . 15 GLN N 1 1 1 235 1 1 15 GLN NE2 N 1.645 0.296 -5.013 1.00 . A A . 15 GLN NE2 1 1 1 236 1 1 15 GLN O O 4.701 0.639 -5.659 1.00 . A A . 15 GLN O 1 1 1 237 1 1 15 GLN OE1 O 2.178 1.756 -6.530 1.00 . A A . 15 GLN OE1 1 1 1 238 1 1 16 CYS C C 6.161 0.296 -2.702 1.00 . A A . 16 CYS C 1 1 1 239 1 1 16 CYS CA C 4.700 -0.088 -3.001 1.00 . A A . 16 CYS CA 1 1 1 240 1 1 16 CYS CB C 4.155 -0.724 -1.738 1.00 . A A . 16 CYS CB 1 1 1 241 1 1 16 CYS H H 4.347 -1.958 -4.014 1.00 . A A . 16 CYS H 1 1 1 242 1 1 16 CYS HA H 4.144 0.819 -3.181 1.00 . A A . 16 CYS HA 1 1 1 243 1 1 16 CYS HB2 H 4.724 -1.600 -1.532 1.00 . A A . 16 CYS HB2 1 1 1 244 1 1 16 CYS HB3 H 4.361 -0.042 -0.929 1.00 . A A . 16 CYS HB3 1 1 1 245 1 1 16 CYS N N 4.498 -1.003 -4.170 1.00 . A A . 16 CYS N 1 1 1 246 1 1 16 CYS O O 6.403 1.361 -2.164 1.00 . A A . 16 CYS O 1 1 1 247 1 1 16 CYS SG S 2.416 -1.180 -1.566 1.00 . A A . 16 CYS SG 1 1 1 248 1 1 17 LYS C C 9.006 1.120 -3.131 1.00 . A A . 17 LYS C 1 1 1 249 1 1 17 LYS CA C 8.540 -0.323 -2.810 1.00 . A A . 17 LYS CA 1 1 1 250 1 1 17 LYS CB C 9.312 -1.404 -3.650 1.00 . A A . 17 LYS CB 1 1 1 251 1 1 17 LYS CD C 11.614 -0.166 -4.067 1.00 . A A . 17 LYS CD 1 1 1 252 1 1 17 LYS CE C 11.332 -0.021 -5.577 1.00 . A A . 17 LYS CE 1 1 1 253 1 1 17 LYS CG C 10.871 -1.398 -3.471 1.00 . A A . 17 LYS CG 1 1 1 254 1 1 17 LYS H H 6.801 -1.404 -3.486 1.00 . A A . 17 LYS H 1 1 1 255 1 1 17 LYS HA H 8.734 -0.511 -1.763 1.00 . A A . 17 LYS HA 1 1 1 256 1 1 17 LYS HB2 H 8.953 -2.377 -3.349 1.00 . A A . 17 LYS HB2 1 1 1 257 1 1 17 LYS HB3 H 9.076 -1.291 -4.696 1.00 . A A . 17 LYS HB3 1 1 1 258 1 1 17 LYS HD2 H 11.377 0.745 -3.548 1.00 . A A . 17 LYS HD2 1 1 1 259 1 1 17 LYS HD3 H 12.674 -0.333 -3.947 1.00 . A A . 17 LYS HD3 1 1 1 260 1 1 17 LYS HE2 H 10.279 0.124 -5.757 1.00 . A A . 17 LYS HE2 1 1 1 261 1 1 17 LYS HE3 H 11.868 0.832 -5.965 1.00 . A A . 17 LYS HE3 1 1 1 262 1 1 17 LYS HG2 H 11.080 -1.423 -2.411 1.00 . A A . 17 LYS HG2 1 1 1 263 1 1 17 LYS HG3 H 11.286 -2.298 -3.895 1.00 . A A . 17 LYS HG3 1 1 1 264 1 1 17 LYS HZ1 H 12.400 -0.951 -7.103 1.00 . A A . 17 LYS HZ1 1 1 1 265 1 1 17 LYS HZ2 H 10.946 -1.729 -6.701 1.00 . A A . 17 LYS HZ2 1 1 1 266 1 1 17 LYS HZ3 H 12.293 -1.867 -5.676 1.00 . A A . 17 LYS HZ3 1 1 1 267 1 1 17 LYS N N 7.079 -0.570 -3.052 1.00 . A A . 17 LYS N 1 1 1 268 1 1 17 LYS NZ N 11.777 -1.233 -6.320 1.00 . A A . 17 LYS NZ 1 1 1 269 1 1 17 LYS O O 9.669 1.714 -2.302 1.00 . A A . 17 LYS O 1 1 1 270 1 1 18 HYP C C 8.531 4.190 -4.237 1.00 . A A . 18 HYP C 1 1 1 271 1 1 18 HYP CA C 9.254 2.926 -4.758 1.00 . A A . 18 HYP CA 1 1 1 272 1 1 18 HYP CB C 9.224 2.778 -6.281 1.00 . A A . 18 HYP CB 1 1 1 273 1 1 18 HYP CD C 7.688 1.174 -5.269 1.00 . A A . 18 HYP CD 1 1 1 274 1 1 18 HYP CG C 8.103 1.822 -6.572 1.00 . A A . 18 HYP CG 1 1 1 275 1 1 18 HYP HA H 10.291 2.995 -4.461 1.00 . A A . 18 HYP HA 1 1 1 276 1 1 18 HYP HB2 H 10.177 2.404 -6.627 1.00 . A A . 18 HYP HB2 1 1 1 277 1 1 18 HYP HB3 H 9.064 3.735 -6.755 1.00 . A A . 18 HYP HB3 1 1 1 278 1 1 18 HYP HD1 H 7.889 0.111 -7.474 1.00 . A A . 18 HYP HD1 1 1 1 279 1 1 18 HYP HD22 H 7.702 0.100 -5.357 1.00 . A A . 18 HYP HD22 1 1 1 280 1 1 18 HYP HD23 H 6.703 1.514 -4.999 1.00 . A A . 18 HYP HD23 1 1 1 281 1 1 18 HYP HG H 7.268 2.371 -6.985 1.00 . A A . 18 HYP HG 1 1 1 282 1 1 18 HYP N N 8.665 1.663 -4.282 1.00 . A A . 18 HYP N 1 1 1 283 1 1 18 HYP O O 8.703 5.250 -4.809 1.00 . A A . 18 HYP O 1 1 1 284 1 1 18 HYP OD1 O 8.524 0.830 -7.498 1.00 . A A . 18 HYP OD1 1 1 1 285 1 1 19 HIS C C 7.931 6.052 -1.709 1.00 . A A . 19 HIS C 1 1 1 286 1 1 19 HIS CA C 7.024 5.223 -2.621 1.00 . A A . 19 HIS CA 1 1 1 287 1 1 19 HIS CB C 5.797 4.722 -1.829 1.00 . A A . 19 HIS CB 1 1 1 288 1 1 19 HIS CD2 C 4.912 3.507 -4.040 1.00 . A A . 19 HIS CD2 1 1 1 289 1 1 19 HIS CE1 C 2.932 3.289 -3.470 1.00 . A A . 19 HIS CE1 1 1 1 290 1 1 19 HIS CG C 4.781 4.050 -2.769 1.00 . A A . 19 HIS CG 1 1 1 291 1 1 19 HIS H H 7.656 3.171 -2.758 1.00 . A A . 19 HIS H 1 1 1 292 1 1 19 HIS HA H 6.698 5.857 -3.433 1.00 . A A . 19 HIS HA 1 1 1 293 1 1 19 HIS HB2 H 6.102 4.003 -1.084 1.00 . A A . 19 HIS HB2 1 1 1 294 1 1 19 HIS HB3 H 5.307 5.549 -1.334 1.00 . A A . 19 HIS HB3 1 1 1 295 1 1 19 HIS HD1 H 3.104 4.152 -1.647 1.00 . A A . 19 HIS HD1 1 1 1 296 1 1 19 HIS HD2 H 5.827 3.471 -4.611 1.00 . A A . 19 HIS HD2 1 1 1 297 1 1 19 HIS HE1 H 1.883 3.036 -3.477 1.00 . A A . 19 HIS HE1 1 1 1 298 1 1 19 HIS N N 7.760 4.046 -3.186 1.00 . A A . 19 HIS N 1 1 1 299 1 1 19 HIS ND1 N 3.533 3.877 -2.484 1.00 . A A . 19 HIS ND1 1 1 1 300 1 1 19 HIS NE2 N 3.752 3.040 -4.459 1.00 . A A . 19 HIS NE2 1 1 1 301 1 1 19 HIS O O 8.972 5.590 -1.289 1.00 . A A . 19 HIS O 1 1 1 302 1 1 20 ARG C C 8.383 7.637 0.879 1.00 . A A . 20 ARG C 1 1 1 303 1 1 20 ARG CA C 8.281 8.180 -0.552 1.00 . A A . 20 ARG CA 1 1 1 304 1 1 20 ARG CB C 7.592 9.563 -0.534 1.00 . A A . 20 ARG CB 1 1 1 305 1 1 20 ARG CD C 8.937 10.418 -2.529 1.00 . A A . 20 ARG CD 1 1 1 306 1 1 20 ARG CG C 7.521 10.186 -1.953 1.00 . A A . 20 ARG CG 1 1 1 307 1 1 20 ARG CZ C 8.599 12.332 -4.032 1.00 . A A . 20 ARG CZ 1 1 1 308 1 1 20 ARG H H 6.644 7.556 -1.809 1.00 . A A . 20 ARG H 1 1 1 309 1 1 20 ARG HA H 9.283 8.266 -0.947 1.00 . A A . 20 ARG HA 1 1 1 310 1 1 20 ARG HB2 H 6.588 9.458 -0.146 1.00 . A A . 20 ARG HB2 1 1 1 311 1 1 20 ARG HB3 H 8.138 10.228 0.120 1.00 . A A . 20 ARG HB3 1 1 1 312 1 1 20 ARG HD2 H 9.522 11.059 -1.886 1.00 . A A . 20 ARG HD2 1 1 1 313 1 1 20 ARG HD3 H 9.457 9.479 -2.653 1.00 . A A . 20 ARG HD3 1 1 1 314 1 1 20 ARG HE H 8.879 10.480 -4.679 1.00 . A A . 20 ARG HE 1 1 1 315 1 1 20 ARG HG2 H 6.968 9.531 -2.611 1.00 . A A . 20 ARG HG2 1 1 1 316 1 1 20 ARG HG3 H 6.996 11.127 -1.895 1.00 . A A . 20 ARG HG3 1 1 1 317 1 1 20 ARG HH11 H 8.572 12.743 -2.069 1.00 . A A . 20 ARG HH11 1 1 1 318 1 1 20 ARG HH12 H 8.339 14.097 -3.124 1.00 . A A . 20 ARG HH12 1 1 1 319 1 1 20 ARG HH21 H 8.581 12.180 -6.027 1.00 . A A . 20 ARG HH21 1 1 1 320 1 1 20 ARG HH22 H 8.343 13.775 -5.394 1.00 . A A . 20 ARG HH22 1 1 1 321 1 1 20 ARG N N 7.497 7.256 -1.433 1.00 . A A . 20 ARG N 1 1 1 322 1 1 20 ARG NE N 8.806 11.046 -3.881 1.00 . A A . 20 ARG NE 1 1 1 323 1 1 20 ARG NH1 N 8.496 13.118 -2.993 1.00 . A A . 20 ARG NH1 1 1 1 324 1 1 20 ARG NH2 N 8.499 12.798 -5.245 1.00 . A A . 20 ARG NH2 1 1 1 325 1 1 20 ARG O O 9.352 7.892 1.567 1.00 . A A . 20 ARG O 1 1 1 326 1 1 21 CYS C C 8.103 4.971 2.666 1.00 . A A . 21 CYS C 1 1 1 327 1 1 21 CYS CA C 7.350 6.310 2.654 1.00 . A A . 21 CYS CA 1 1 1 328 1 1 21 CYS CB C 5.927 6.025 3.094 1.00 . A A . 21 CYS CB 1 1 1 329 1 1 21 CYS H H 6.629 6.730 0.661 1.00 . A A . 21 CYS H 1 1 1 330 1 1 21 CYS HA H 7.817 6.992 3.348 1.00 . A A . 21 CYS HA 1 1 1 331 1 1 21 CYS HB2 H 5.568 5.329 2.357 1.00 . A A . 21 CYS HB2 1 1 1 332 1 1 21 CYS HB3 H 5.963 5.503 4.039 1.00 . A A . 21 CYS HB3 1 1 1 333 1 1 21 CYS N N 7.375 6.901 1.277 1.00 . A A . 21 CYS N 1 1 1 334 1 1 21 CYS O O 8.472 4.477 3.714 1.00 . A A . 21 CYS O 1 1 1 335 1 1 21 CYS SG S 4.667 7.314 3.263 1.00 . A A . 21 CYS SG 1 1 1 336 1 1 22 . C C 10.359 3.422 0.666 1.00 . A A . 22 CY3 C 1 1 1 337 1 1 22 . CA C 9.008 3.132 1.326 1.00 . A A . 22 CY3 CA 1 1 1 338 1 1 22 . CB C 8.149 2.233 0.438 1.00 . A A . 22 CY3 CB 1 1 1 339 1 1 22 . H H 7.996 4.894 0.680 1.00 . A A . 22 CY3 H 1 1 1 340 1 1 22 . HA H 9.174 2.669 2.289 1.00 . A A . 22 CY3 HA 1 1 1 341 1 1 22 . HB2 H 8.637 1.274 0.354 1.00 . A A . 22 CY3 HB2 1 1 1 342 1 1 22 . HB3 H 8.127 2.671 -0.548 1.00 . A A . 22 CY3 HB3 1 1 1 343 1 1 22 . HN11 H 10.066 5.382 0.738 1.00 . A A . 22 CY3 HN11 1 1 1 344 1 1 22 . HN12 H 11.524 4.901 0.036 1.00 . A A . 22 CY3 HN12 1 1 1 345 1 1 22 . N N 8.302 4.433 1.488 1.00 . A A . 22 CY3 N 1 1 1 346 1 1 22 . N1 N 10.681 4.669 0.463 1.00 . A A . 22 CY3 N1 1 1 1 347 1 1 22 . O O 11.118 2.534 0.327 1.00 . A A . 22 CY3 O 1 1 1 348 1 1 22 . SG S 6.427 1.919 0.904 1.00 . A A . 22 CY3 SG 1 1 2 349 1 1 1 PCA C C -4.586 5.787 2.495 1.00 . A A . 1 PCA C 1 1 2 350 1 1 1 PCA CA C -5.342 6.807 3.348 1.00 . A A . 1 PCA CA 1 1 2 351 1 1 1 PCA CB C -4.571 7.149 4.631 1.00 . A A . 1 PCA CB 1 1 2 352 1 1 1 PCA CD C -6.806 6.456 5.214 1.00 . A A . 1 PCA CD 1 1 2 353 1 1 1 PCA CG C -5.480 6.853 5.820 1.00 . A A . 1 PCA CG 1 1 2 354 1 1 1 PCA HA H -5.484 7.709 2.770 1.00 . A A . 1 PCA HA 1 1 2 355 1 1 1 PCA HB2 H -4.277 8.187 4.600 1.00 . A A . 1 PCA HB2 1 1 2 356 1 1 1 PCA HB3 H -3.664 6.562 4.684 1.00 . A A . 1 PCA HB3 1 1 2 357 1 1 1 PCA HG2 H -5.596 7.734 6.434 1.00 . A A . 1 PCA HG2 1 1 2 358 1 1 1 PCA HG3 H -5.074 6.038 6.403 1.00 . A A . 1 PCA HG3 1 1 2 359 1 1 1 PCA N N -6.668 6.312 3.767 1.00 . A A . 1 PCA N 1 1 2 360 1 1 1 PCA O O -5.060 4.688 2.275 1.00 . A A . 1 PCA O 1 1 2 361 1 1 1 PCA OE O -7.828 6.285 5.846 1.00 . A A . 1 PCA OE 1 1 2 362 1 1 2 ARG C C -1.994 4.211 2.090 1.00 . A A . 2 ARG C 1 1 2 363 1 1 2 ARG CA C -2.566 5.326 1.210 1.00 . A A . 2 ARG CA 1 1 2 364 1 1 2 ARG CB C -1.412 6.156 0.595 1.00 . A A . 2 ARG CB 1 1 2 365 1 1 2 ARG CD C -2.859 8.260 0.141 1.00 . A A . 2 ARG CD 1 1 2 366 1 1 2 ARG CG C -1.899 7.207 -0.448 1.00 . A A . 2 ARG CG 1 1 2 367 1 1 2 ARG CZ C -4.210 10.048 -0.855 1.00 . A A . 2 ARG CZ 1 1 2 368 1 1 2 ARG H H -3.119 7.104 2.282 1.00 . A A . 2 ARG H 1 1 2 369 1 1 2 ARG HA H -3.171 4.891 0.427 1.00 . A A . 2 ARG HA 1 1 2 370 1 1 2 ARG HB2 H -0.897 6.674 1.389 1.00 . A A . 2 ARG HB2 1 1 2 371 1 1 2 ARG HB3 H -0.711 5.487 0.117 1.00 . A A . 2 ARG HB3 1 1 2 372 1 1 2 ARG HD2 H -3.782 7.799 0.454 1.00 . A A . 2 ARG HD2 1 1 2 373 1 1 2 ARG HD3 H -2.409 8.780 0.973 1.00 . A A . 2 ARG HD3 1 1 2 374 1 1 2 ARG HE H -2.612 9.278 -1.738 1.00 . A A . 2 ARG HE 1 1 2 375 1 1 2 ARG HG2 H -1.036 7.711 -0.858 1.00 . A A . 2 ARG HG2 1 1 2 376 1 1 2 ARG HG3 H -2.399 6.693 -1.256 1.00 . A A . 2 ARG HG3 1 1 2 377 1 1 2 ARG HH11 H -4.814 9.392 0.944 1.00 . A A . 2 ARG HH11 1 1 2 378 1 1 2 ARG HH12 H -5.775 10.648 0.241 1.00 . A A . 2 ARG HH12 1 1 2 379 1 1 2 ARG HH21 H -3.813 10.871 -2.635 1.00 . A A . 2 ARG HH21 1 1 2 380 1 1 2 ARG HH22 H -5.200 11.501 -1.811 1.00 . A A . 2 ARG HH22 1 1 2 381 1 1 2 ARG N N -3.426 6.203 2.054 1.00 . A A . 2 ARG N 1 1 2 382 1 1 2 ARG NE N -3.182 9.239 -0.942 1.00 . A A . 2 ARG NE 1 1 2 383 1 1 2 ARG NH1 N -4.993 10.026 0.192 1.00 . A A . 2 ARG NH1 1 1 2 384 1 1 2 ARG NH2 N -4.425 10.871 -1.844 1.00 . A A . 2 ARG NH2 1 1 2 385 1 1 2 ARG O O -1.394 4.472 3.116 1.00 . A A . 2 ARG O 1 1 2 386 1 1 3 LEU C C -0.206 1.928 2.562 1.00 . A A . 3 LEU C 1 1 2 387 1 1 3 LEU CA C -1.724 1.792 2.376 1.00 . A A . 3 LEU CA 1 1 2 388 1 1 3 LEU CB C -2.048 0.511 1.559 1.00 . A A . 3 LEU CB 1 1 2 389 1 1 3 LEU CD1 C -4.331 1.285 0.573 1.00 . A A . 3 LEU CD1 1 1 2 390 1 1 3 LEU CD2 C -3.692 -1.151 0.633 1.00 . A A . 3 LEU CD2 1 1 2 391 1 1 3 LEU CG C -3.568 0.201 1.371 1.00 . A A . 3 LEU CG 1 1 2 392 1 1 3 LEU H H -2.704 2.900 0.805 1.00 . A A . 3 LEU H 1 1 2 393 1 1 3 LEU HA H -2.203 1.755 3.343 1.00 . A A . 3 LEU HA 1 1 2 394 1 1 3 LEU HB2 H -1.584 0.577 0.585 1.00 . A A . 3 LEU HB2 1 1 2 395 1 1 3 LEU HB3 H -1.609 -0.318 2.084 1.00 . A A . 3 LEU HB3 1 1 2 396 1 1 3 LEU HD11 H -4.308 2.234 1.082 1.00 . A A . 3 LEU HD11 1 1 2 397 1 1 3 LEU HD12 H -5.365 0.997 0.461 1.00 . A A . 3 LEU HD12 1 1 2 398 1 1 3 LEU HD13 H -3.898 1.403 -0.411 1.00 . A A . 3 LEU HD13 1 1 2 399 1 1 3 LEU HD21 H -3.207 -1.103 -0.331 1.00 . A A . 3 LEU HD21 1 1 2 400 1 1 3 LEU HD22 H -4.732 -1.404 0.487 1.00 . A A . 3 LEU HD22 1 1 2 401 1 1 3 LEU HD23 H -3.225 -1.932 1.216 1.00 . A A . 3 LEU HD23 1 1 2 402 1 1 3 LEU HG H -4.031 0.106 2.344 1.00 . A A . 3 LEU HG 1 1 2 403 1 1 3 LEU N N -2.212 3.001 1.643 1.00 . A A . 3 LEU N 1 1 2 404 1 1 3 LEU O O 0.255 2.168 3.659 1.00 . A A . 3 LEU O 1 1 2 405 1 1 4 CYS C C 2.512 2.973 2.320 1.00 . A A . 4 CYS C 1 1 2 406 1 1 4 CYS CA C 1.991 1.857 1.403 1.00 . A A . 4 CYS CA 1 1 2 407 1 1 4 CYS CB C 2.430 2.195 -0.023 1.00 . A A . 4 CYS CB 1 1 2 408 1 1 4 CYS H H 0.022 1.536 0.650 1.00 . A A . 4 CYS H 1 1 2 409 1 1 4 CYS HA H 2.440 0.928 1.709 1.00 . A A . 4 CYS HA 1 1 2 410 1 1 4 CYS HB2 H 2.250 3.230 -0.230 1.00 . A A . 4 CYS HB2 1 1 2 411 1 1 4 CYS HB3 H 3.503 2.089 -0.030 1.00 . A A . 4 CYS HB3 1 1 2 412 1 1 4 CYS N N 0.498 1.759 1.471 1.00 . A A . 4 CYS N 1 1 2 413 1 1 4 CYS O O 3.336 2.748 3.185 1.00 . A A . 4 CYS O 1 1 2 414 1 1 4 CYS SG S 1.820 1.291 -1.464 1.00 . A A . 4 CYS SG 1 1 2 415 1 1 5 CYS C C 1.428 5.481 4.074 1.00 . A A . 5 CYS C 1 1 2 416 1 1 5 CYS CA C 2.372 5.352 2.864 1.00 . A A . 5 CYS CA 1 1 2 417 1 1 5 CYS CB C 2.270 6.570 1.923 1.00 . A A . 5 CYS CB 1 1 2 418 1 1 5 CYS H H 1.312 4.233 1.365 1.00 . A A . 5 CYS H 1 1 2 419 1 1 5 CYS HA H 3.387 5.241 3.218 1.00 . A A . 5 CYS HA 1 1 2 420 1 1 5 CYS HB2 H 2.664 6.289 0.957 1.00 . A A . 5 CYS HB2 1 1 2 421 1 1 5 CYS HB3 H 1.231 6.826 1.786 1.00 . A A . 5 CYS HB3 1 1 2 422 1 1 5 CYS N N 1.981 4.147 2.078 1.00 . A A . 5 CYS N 1 1 2 423 1 1 5 CYS O O 0.819 6.510 4.301 1.00 . A A . 5 CYS O 1 1 2 424 1 1 5 CYS SG S 3.137 8.060 2.462 1.00 . A A . 5 CYS SG 1 1 2 425 1 1 6 GLY C C 0.920 3.214 6.943 1.00 . A A . 6 GLY C 1 1 2 426 1 1 6 GLY CA C 0.476 4.357 6.027 1.00 . A A . 6 GLY CA 1 1 2 427 1 1 6 GLY H H 1.869 3.613 4.571 1.00 . A A . 6 GLY H 1 1 2 428 1 1 6 GLY HA2 H 0.549 5.292 6.564 1.00 . A A . 6 GLY HA2 1 1 2 429 1 1 6 GLY HA3 H -0.547 4.192 5.724 1.00 . A A . 6 GLY HA3 1 1 2 430 1 1 6 GLY N N 1.346 4.406 4.814 1.00 . A A . 6 GLY N 1 1 2 431 1 1 6 GLY O O 0.904 3.354 8.151 1.00 . A A . 6 GLY O 1 1 2 432 1 1 7 PHE C C 2.609 -0.044 6.256 1.00 . A A . 7 PHE C 1 1 2 433 1 1 7 PHE CA C 1.760 0.925 7.112 1.00 . A A . 7 PHE CA 1 1 2 434 1 1 7 PHE CB C 0.509 0.200 7.683 1.00 . A A . 7 PHE CB 1 1 2 435 1 1 7 PHE CD1 C -0.274 -1.306 5.794 1.00 . A A . 7 PHE CD1 1 1 2 436 1 1 7 PHE CD2 C -1.637 0.555 6.380 1.00 . A A . 7 PHE CD2 1 1 2 437 1 1 7 PHE CE1 C -1.180 -1.666 4.819 1.00 . A A . 7 PHE CE1 1 1 2 438 1 1 7 PHE CE2 C -2.545 0.198 5.405 1.00 . A A . 7 PHE CE2 1 1 2 439 1 1 7 PHE CG C -0.494 -0.195 6.583 1.00 . A A . 7 PHE CG 1 1 2 440 1 1 7 PHE CZ C -2.317 -0.913 4.625 1.00 . A A . 7 PHE CZ 1 1 2 441 1 1 7 PHE H H 1.290 2.075 5.358 1.00 . A A . 7 PHE H 1 1 2 442 1 1 7 PHE HA H 2.365 1.283 7.931 1.00 . A A . 7 PHE HA 1 1 2 443 1 1 7 PHE HB2 H 0.810 -0.696 8.204 1.00 . A A . 7 PHE HB2 1 1 2 444 1 1 7 PHE HB3 H 0.009 0.844 8.393 1.00 . A A . 7 PHE HB3 1 1 2 445 1 1 7 PHE HD1 H 0.617 -1.895 5.941 1.00 . A A . 7 PHE HD1 1 1 2 446 1 1 7 PHE HD2 H -1.824 1.428 6.988 1.00 . A A . 7 PHE HD2 1 1 2 447 1 1 7 PHE HE1 H -1.001 -2.538 4.208 1.00 . A A . 7 PHE HE1 1 1 2 448 1 1 7 PHE HE2 H -3.436 0.792 5.254 1.00 . A A . 7 PHE HE2 1 1 2 449 1 1 7 PHE HZ H -3.026 -1.197 3.862 1.00 . A A . 7 PHE HZ 1 1 2 450 1 1 7 PHE N N 1.302 2.116 6.336 1.00 . A A . 7 PHE N 1 1 2 451 1 1 7 PHE O O 2.360 -0.228 5.077 1.00 . A A . 7 PHE O 1 1 2 452 1 1 8 HYP C C 4.284 -2.584 5.460 1.00 . A A . 8 HYP C 1 1 2 453 1 1 8 HYP CA C 4.711 -1.311 6.198 1.00 . A A . 8 HYP CA 1 1 2 454 1 1 8 HYP CB C 5.737 -1.579 7.291 1.00 . A A . 8 HYP CB 1 1 2 455 1 1 8 HYP CD C 3.768 -0.765 8.359 1.00 . A A . 8 HYP CD 1 1 2 456 1 1 8 HYP CG C 4.893 -1.760 8.503 1.00 . A A . 8 HYP CG 1 1 2 457 1 1 8 HYP HA H 5.157 -0.638 5.480 1.00 . A A . 8 HYP HA 1 1 2 458 1 1 8 HYP HB2 H 6.416 -0.742 7.383 1.00 . A A . 8 HYP HB2 1 1 2 459 1 1 8 HYP HB3 H 6.322 -2.460 7.066 1.00 . A A . 8 HYP HB3 1 1 2 460 1 1 8 HYP HD1 H 5.067 -1.629 10.433 1.00 . A A . 8 HYP HD1 1 1 2 461 1 1 8 HYP HD22 H 4.046 0.184 8.795 1.00 . A A . 8 HYP HD22 1 1 2 462 1 1 8 HYP HD23 H 2.874 -1.147 8.827 1.00 . A A . 8 HYP HD23 1 1 2 463 1 1 8 HYP HG H 4.505 -2.767 8.527 1.00 . A A . 8 HYP HG 1 1 2 464 1 1 8 HYP N N 3.595 -0.642 6.893 1.00 . A A . 8 HYP N 1 1 2 465 1 1 8 HYP O O 5.056 -3.104 4.675 1.00 . A A . 8 HYP O 1 1 2 466 1 1 8 HYP OD1 O 5.648 -1.503 9.678 1.00 . A A . 8 HYP OD1 1 1 2 467 1 1 9 LYS C C 2.545 -4.014 3.558 1.00 . A A . 9 LYS C 1 1 2 468 1 1 9 LYS CA C 2.585 -4.270 5.063 1.00 . A A . 9 LYS CA 1 1 2 469 1 1 9 LYS CB C 1.153 -4.648 5.548 1.00 . A A . 9 LYS CB 1 1 2 470 1 1 9 LYS CD C 1.479 -3.888 8.014 1.00 . A A . 9 LYS CD 1 1 2 471 1 1 9 LYS CE C 1.302 -4.340 9.472 1.00 . A A . 9 LYS CE 1 1 2 472 1 1 9 LYS CG C 1.080 -5.039 7.055 1.00 . A A . 9 LYS CG 1 1 2 473 1 1 9 LYS H H 2.514 -2.558 6.375 1.00 . A A . 9 LYS H 1 1 2 474 1 1 9 LYS HA H 3.272 -5.080 5.264 1.00 . A A . 9 LYS HA 1 1 2 475 1 1 9 LYS HB2 H 0.468 -3.843 5.351 1.00 . A A . 9 LYS HB2 1 1 2 476 1 1 9 LYS HB3 H 0.819 -5.500 4.972 1.00 . A A . 9 LYS HB3 1 1 2 477 1 1 9 LYS HD2 H 2.519 -3.634 7.887 1.00 . A A . 9 LYS HD2 1 1 2 478 1 1 9 LYS HD3 H 0.875 -3.015 7.824 1.00 . A A . 9 LYS HD3 1 1 2 479 1 1 9 LYS HE2 H 1.912 -5.207 9.677 1.00 . A A . 9 LYS HE2 1 1 2 480 1 1 9 LYS HE3 H 1.592 -3.543 10.142 1.00 . A A . 9 LYS HE3 1 1 2 481 1 1 9 LYS HG2 H 0.070 -5.355 7.275 1.00 . A A . 9 LYS HG2 1 1 2 482 1 1 9 LYS HG3 H 1.736 -5.881 7.227 1.00 . A A . 9 LYS HG3 1 1 2 483 1 1 9 LYS HZ1 H -0.284 -5.688 9.499 1.00 . A A . 9 LYS HZ1 1 1 2 484 1 1 9 LYS HZ2 H -0.742 -4.088 9.154 1.00 . A A . 9 LYS HZ2 1 1 2 485 1 1 9 LYS HZ3 H -0.337 -4.531 10.744 1.00 . A A . 9 LYS HZ3 1 1 2 486 1 1 9 LYS N N 3.083 -3.034 5.735 1.00 . A A . 9 LYS N 1 1 2 487 1 1 9 LYS NZ N -0.124 -4.687 9.738 1.00 . A A . 9 LYS NZ 1 1 2 488 1 1 9 LYS O O 2.890 -4.894 2.793 1.00 . A A . 9 LYS O 1 1 2 489 1 1 10 SER C C 3.503 -2.188 1.244 1.00 . A A . 10 SER C 1 1 2 490 1 1 10 SER CA C 2.086 -2.538 1.710 1.00 . A A . 10 SER CA 1 1 2 491 1 1 10 SER CB C 1.085 -1.403 1.522 1.00 . A A . 10 SER CB 1 1 2 492 1 1 10 SER H H 1.856 -2.111 3.783 1.00 . A A . 10 SER H 1 1 2 493 1 1 10 SER HA H 1.749 -3.417 1.179 1.00 . A A . 10 SER HA 1 1 2 494 1 1 10 SER HB2 H 1.284 -0.582 2.189 1.00 . A A . 10 SER HB2 1 1 2 495 1 1 10 SER HB3 H 0.998 -1.071 0.499 1.00 . A A . 10 SER HB3 1 1 2 496 1 1 10 SER HG H -0.754 -1.949 1.204 1.00 . A A . 10 SER HG 1 1 2 497 1 1 10 SER N N 2.135 -2.827 3.165 1.00 . A A . 10 SER N 1 1 2 498 1 1 10 SER O O 3.894 -2.636 0.186 1.00 . A A . 10 SER O 1 1 2 499 1 1 10 SER OG O -0.129 -2.014 1.930 1.00 . A A . 10 SER OG 1 1 2 500 1 1 11 CYS C C 6.533 -2.287 1.280 1.00 . A A . 11 CYS C 1 1 2 501 1 1 11 CYS CA C 5.647 -1.070 1.571 1.00 . A A . 11 CYS CA 1 1 2 502 1 1 11 CYS CB C 6.381 -0.243 2.638 1.00 . A A . 11 CYS CB 1 1 2 503 1 1 11 CYS H H 3.895 -1.080 2.859 1.00 . A A . 11 CYS H 1 1 2 504 1 1 11 CYS HA H 5.586 -0.473 0.678 1.00 . A A . 11 CYS HA 1 1 2 505 1 1 11 CYS HB2 H 6.262 -0.746 3.586 1.00 . A A . 11 CYS HB2 1 1 2 506 1 1 11 CYS HB3 H 7.438 -0.246 2.411 1.00 . A A . 11 CYS HB3 1 1 2 507 1 1 11 CYS N N 4.248 -1.420 2.010 1.00 . A A . 11 CYS N 1 1 2 508 1 1 11 CYS O O 7.528 -2.170 0.590 1.00 . A A . 11 CYS O 1 1 2 509 1 1 11 CYS SG S 5.928 1.487 2.899 1.00 . A A . 11 CYS SG 1 1 2 510 1 1 12 ARG C C 6.581 -5.317 0.239 1.00 . A A . 12 ARG C 1 1 2 511 1 1 12 ARG CA C 6.921 -4.670 1.605 1.00 . A A . 12 ARG CA 1 1 2 512 1 1 12 ARG CB C 6.577 -5.574 2.815 1.00 . A A . 12 ARG CB 1 1 2 513 1 1 12 ARG CD C 7.138 -7.606 4.158 1.00 . A A . 12 ARG CD 1 1 2 514 1 1 12 ARG CG C 7.490 -6.816 2.889 1.00 . A A . 12 ARG CG 1 1 2 515 1 1 12 ARG CZ C 8.936 -8.911 5.239 1.00 . A A . 12 ARG CZ 1 1 2 516 1 1 12 ARG H H 5.322 -3.435 2.349 1.00 . A A . 12 ARG H 1 1 2 517 1 1 12 ARG HA H 7.975 -4.434 1.622 1.00 . A A . 12 ARG HA 1 1 2 518 1 1 12 ARG HB2 H 6.686 -5.000 3.724 1.00 . A A . 12 ARG HB2 1 1 2 519 1 1 12 ARG HB3 H 5.547 -5.891 2.739 1.00 . A A . 12 ARG HB3 1 1 2 520 1 1 12 ARG HD2 H 7.214 -6.975 5.029 1.00 . A A . 12 ARG HD2 1 1 2 521 1 1 12 ARG HD3 H 6.129 -7.985 4.090 1.00 . A A . 12 ARG HD3 1 1 2 522 1 1 12 ARG HE H 8.054 -9.453 3.555 1.00 . A A . 12 ARG HE 1 1 2 523 1 1 12 ARG HG2 H 7.339 -7.459 2.036 1.00 . A A . 12 ARG HG2 1 1 2 524 1 1 12 ARG HG3 H 8.527 -6.514 2.920 1.00 . A A . 12 ARG HG3 1 1 2 525 1 1 12 ARG HH11 H 8.436 -7.230 6.229 1.00 . A A . 12 ARG HH11 1 1 2 526 1 1 12 ARG HH12 H 9.689 -8.180 6.942 1.00 . A A . 12 ARG HH12 1 1 2 527 1 1 12 ARG HH21 H 9.632 -10.624 4.473 1.00 . A A . 12 ARG HH21 1 1 2 528 1 1 12 ARG HH22 H 10.374 -10.107 5.951 1.00 . A A . 12 ARG HH22 1 1 2 529 1 1 12 ARG N N 6.140 -3.415 1.811 1.00 . A A . 12 ARG N 1 1 2 530 1 1 12 ARG NE N 8.078 -8.769 4.255 1.00 . A A . 12 ARG NE 1 1 2 531 1 1 12 ARG NH1 N 9.024 -8.038 6.209 1.00 . A A . 12 ARG NH1 1 1 2 532 1 1 12 ARG NH2 N 9.707 -9.964 5.219 1.00 . A A . 12 ARG NH2 1 1 2 533 1 1 12 ARG O O 6.957 -6.443 -0.021 1.00 . A A . 12 ARG O 1 1 2 534 1 1 13 SER C C 6.237 -4.318 -3.042 1.00 . A A . 13 SER C 1 1 2 535 1 1 13 SER CA C 5.492 -5.103 -1.952 1.00 . A A . 13 SER CA 1 1 2 536 1 1 13 SER CB C 3.970 -4.943 -2.173 1.00 . A A . 13 SER CB 1 1 2 537 1 1 13 SER H H 5.607 -3.682 -0.335 1.00 . A A . 13 SER H 1 1 2 538 1 1 13 SER HA H 5.757 -6.147 -2.037 1.00 . A A . 13 SER HA 1 1 2 539 1 1 13 SER HB2 H 3.662 -5.371 -3.116 1.00 . A A . 13 SER HB2 1 1 2 540 1 1 13 SER HB3 H 3.410 -5.391 -1.365 1.00 . A A . 13 SER HB3 1 1 2 541 1 1 13 SER HG H 2.919 -3.373 -1.701 1.00 . A A . 13 SER HG 1 1 2 542 1 1 13 SER N N 5.880 -4.584 -0.598 1.00 . A A . 13 SER N 1 1 2 543 1 1 13 SER O O 6.793 -3.265 -2.790 1.00 . A A . 13 SER O 1 1 2 544 1 1 13 SER OG O 3.727 -3.542 -2.191 1.00 . A A . 13 SER OG 1 1 2 545 1 1 14 ARG C C 6.140 -2.963 -5.823 1.00 . A A . 14 ARG C 1 1 2 546 1 1 14 ARG CA C 6.883 -4.244 -5.405 1.00 . A A . 14 ARG CA 1 1 2 547 1 1 14 ARG CB C 6.887 -5.272 -6.552 1.00 . A A . 14 ARG CB 1 1 2 548 1 1 14 ARG CD C 7.576 -5.728 -8.942 1.00 . A A . 14 ARG CD 1 1 2 549 1 1 14 ARG CG C 7.588 -4.692 -7.804 1.00 . A A . 14 ARG CG 1 1 2 550 1 1 14 ARG CZ C 5.823 -6.641 -10.400 1.00 . A A . 14 ARG CZ 1 1 2 551 1 1 14 ARG H H 5.736 -5.722 -4.346 1.00 . A A . 14 ARG H 1 1 2 552 1 1 14 ARG HA H 7.898 -3.992 -5.132 1.00 . A A . 14 ARG HA 1 1 2 553 1 1 14 ARG HB2 H 7.406 -6.163 -6.228 1.00 . A A . 14 ARG HB2 1 1 2 554 1 1 14 ARG HB3 H 5.867 -5.542 -6.788 1.00 . A A . 14 ARG HB3 1 1 2 555 1 1 14 ARG HD2 H 8.070 -5.318 -9.812 1.00 . A A . 14 ARG HD2 1 1 2 556 1 1 14 ARG HD3 H 8.074 -6.637 -8.641 1.00 . A A . 14 ARG HD3 1 1 2 557 1 1 14 ARG HE H 5.442 -5.796 -8.652 1.00 . A A . 14 ARG HE 1 1 2 558 1 1 14 ARG HG2 H 7.076 -3.802 -8.139 1.00 . A A . 14 ARG HG2 1 1 2 559 1 1 14 ARG HG3 H 8.610 -4.436 -7.563 1.00 . A A . 14 ARG HG3 1 1 2 560 1 1 14 ARG HH11 H 7.703 -6.798 -11.083 1.00 . A A . 14 ARG HH11 1 1 2 561 1 1 14 ARG HH12 H 6.472 -7.443 -12.115 1.00 . A A . 14 ARG HH12 1 1 2 562 1 1 14 ARG HH21 H 3.876 -6.603 -9.938 1.00 . A A . 14 ARG HH21 1 1 2 563 1 1 14 ARG HH22 H 4.272 -7.332 -11.459 1.00 . A A . 14 ARG HH22 1 1 2 564 1 1 14 ARG N N 6.210 -4.873 -4.227 1.00 . A A . 14 ARG N 1 1 2 565 1 1 14 ARG NE N 6.151 -6.043 -9.281 1.00 . A A . 14 ARG NE 1 1 2 566 1 1 14 ARG NH1 N 6.739 -6.987 -11.266 1.00 . A A . 14 ARG NH1 1 1 2 567 1 1 14 ARG NH2 N 4.559 -6.877 -10.616 1.00 . A A . 14 ARG NH2 1 1 2 568 1 1 14 ARG O O 6.748 -1.998 -6.246 1.00 . A A . 14 ARG O 1 1 2 569 1 1 15 GLN C C 4.332 -0.609 -5.199 1.00 . A A . 15 GLN C 1 1 2 570 1 1 15 GLN CA C 3.974 -1.839 -6.049 1.00 . A A . 15 GLN CA 1 1 2 571 1 1 15 GLN CB C 2.510 -2.266 -5.828 1.00 . A A . 15 GLN CB 1 1 2 572 1 1 15 GLN CD C 0.101 -1.609 -5.963 1.00 . A A . 15 GLN CD 1 1 2 573 1 1 15 GLN CG C 1.539 -1.126 -6.194 1.00 . A A . 15 GLN CG 1 1 2 574 1 1 15 GLN H H 4.422 -3.817 -5.331 1.00 . A A . 15 GLN H 1 1 2 575 1 1 15 GLN HA H 4.133 -1.602 -7.092 1.00 . A A . 15 GLN HA 1 1 2 576 1 1 15 GLN HB2 H 2.300 -3.126 -6.447 1.00 . A A . 15 GLN HB2 1 1 2 577 1 1 15 GLN HB3 H 2.371 -2.550 -4.794 1.00 . A A . 15 GLN HB3 1 1 2 578 1 1 15 GLN HE21 H 0.319 -1.717 -3.994 1.00 . A A . 15 GLN HE21 1 1 2 579 1 1 15 GLN HE22 H -1.213 -2.156 -4.579 1.00 . A A . 15 GLN HE22 1 1 2 580 1 1 15 GLN HG2 H 1.712 -0.257 -5.577 1.00 . A A . 15 GLN HG2 1 1 2 581 1 1 15 GLN HG3 H 1.653 -0.850 -7.232 1.00 . A A . 15 GLN HG3 1 1 2 582 1 1 15 GLN N N 4.838 -3.004 -5.684 1.00 . A A . 15 GLN N 1 1 2 583 1 1 15 GLN NE2 N -0.297 -1.847 -4.744 1.00 . A A . 15 GLN NE2 1 1 2 584 1 1 15 GLN O O 4.458 0.485 -5.714 1.00 . A A . 15 GLN O 1 1 2 585 1 1 15 GLN OE1 O -0.670 -1.775 -6.888 1.00 . A A . 15 GLN OE1 1 1 2 586 1 1 16 CYS C C 6.333 0.570 -2.898 1.00 . A A . 16 CYS C 1 1 2 587 1 1 16 CYS CA C 4.829 0.252 -2.966 1.00 . A A . 16 CYS CA 1 1 2 588 1 1 16 CYS CB C 4.389 -0.132 -1.580 1.00 . A A . 16 CYS CB 1 1 2 589 1 1 16 CYS H H 4.355 -1.753 -3.578 1.00 . A A . 16 CYS H 1 1 2 590 1 1 16 CYS HA H 4.299 1.144 -3.259 1.00 . A A . 16 CYS HA 1 1 2 591 1 1 16 CYS HB2 H 4.963 -0.976 -1.259 1.00 . A A . 16 CYS HB2 1 1 2 592 1 1 16 CYS HB3 H 4.661 0.682 -0.927 1.00 . A A . 16 CYS HB3 1 1 2 593 1 1 16 CYS N N 4.480 -0.844 -3.920 1.00 . A A . 16 CYS N 1 1 2 594 1 1 16 CYS O O 6.710 1.626 -2.424 1.00 . A A . 16 CYS O 1 1 2 595 1 1 16 CYS SG S 2.661 -0.521 -1.236 1.00 . A A . 16 CYS SG 1 1 2 596 1 1 17 LYS C C 9.125 1.228 -3.841 1.00 . A A . 17 LYS C 1 1 2 597 1 1 17 LYS CA C 8.625 -0.159 -3.349 1.00 . A A . 17 LYS CA 1 1 2 598 1 1 17 LYS CB C 9.250 -1.308 -4.201 1.00 . A A . 17 LYS CB 1 1 2 599 1 1 17 LYS CD C 11.381 -1.400 -2.818 1.00 . A A . 17 LYS CD 1 1 2 600 1 1 17 LYS CE C 12.913 -1.359 -2.888 1.00 . A A . 17 LYS CE 1 1 2 601 1 1 17 LYS CG C 10.796 -1.235 -4.239 1.00 . A A . 17 LYS CG 1 1 2 602 1 1 17 LYS H H 6.763 -1.174 -3.740 1.00 . A A . 17 LYS H 1 1 2 603 1 1 17 LYS HA H 8.941 -0.281 -2.324 1.00 . A A . 17 LYS HA 1 1 2 604 1 1 17 LYS HB2 H 8.963 -2.254 -3.766 1.00 . A A . 17 LYS HB2 1 1 2 605 1 1 17 LYS HB3 H 8.878 -1.290 -5.212 1.00 . A A . 17 LYS HB3 1 1 2 606 1 1 17 LYS HD2 H 11.047 -0.597 -2.177 1.00 . A A . 17 LYS HD2 1 1 2 607 1 1 17 LYS HD3 H 11.061 -2.340 -2.391 1.00 . A A . 17 LYS HD3 1 1 2 608 1 1 17 LYS HE2 H 13.284 -2.142 -3.533 1.00 . A A . 17 LYS HE2 1 1 2 609 1 1 17 LYS HE3 H 13.248 -0.403 -3.263 1.00 . A A . 17 LYS HE3 1 1 2 610 1 1 17 LYS HG2 H 11.166 -2.030 -4.869 1.00 . A A . 17 LYS HG2 1 1 2 611 1 1 17 LYS HG3 H 11.112 -0.293 -4.662 1.00 . A A . 17 LYS HG3 1 1 2 612 1 1 17 LYS HZ1 H 13.056 -2.409 -1.101 1.00 . A A . 17 LYS HZ1 1 1 2 613 1 1 17 LYS HZ2 H 13.251 -0.731 -0.933 1.00 . A A . 17 LYS HZ2 1 1 2 614 1 1 17 LYS HZ3 H 14.507 -1.671 -1.587 1.00 . A A . 17 LYS HZ3 1 1 2 615 1 1 17 LYS N N 7.139 -0.349 -3.368 1.00 . A A . 17 LYS N 1 1 2 616 1 1 17 LYS NZ N 13.476 -1.557 -1.524 1.00 . A A . 17 LYS NZ 1 1 2 617 1 1 17 LYS O O 9.870 1.865 -3.120 1.00 . A A . 17 LYS O 1 1 2 618 1 1 18 HYP C C 8.812 4.224 -4.973 1.00 . A A . 18 HYP C 1 1 2 619 1 1 18 HYP CA C 9.277 2.904 -5.628 1.00 . A A . 18 HYP CA 1 1 2 620 1 1 18 HYP CB C 8.868 2.795 -7.089 1.00 . A A . 18 HYP CB 1 1 2 621 1 1 18 HYP CD C 7.715 1.076 -5.913 1.00 . A A . 18 HYP CD 1 1 2 622 1 1 18 HYP CG C 7.551 2.102 -7.004 1.00 . A A . 18 HYP CG 1 1 2 623 1 1 18 HYP HA H 10.357 2.885 -5.592 1.00 . A A . 18 HYP HA 1 1 2 624 1 1 18 HYP HB2 H 9.601 2.226 -7.643 1.00 . A A . 18 HYP HB2 1 1 2 625 1 1 18 HYP HB3 H 8.791 3.771 -7.547 1.00 . A A . 18 HYP HB3 1 1 2 626 1 1 18 HYP HD1 H 6.506 0.872 -8.087 1.00 . A A . 18 HYP HD1 1 1 2 627 1 1 18 HYP HD22 H 8.067 0.152 -6.340 1.00 . A A . 18 HYP HD22 1 1 2 628 1 1 18 HYP HD23 H 6.777 0.929 -5.409 1.00 . A A . 18 HYP HD23 1 1 2 629 1 1 18 HYP HG H 6.778 2.812 -6.744 1.00 . A A . 18 HYP HG 1 1 2 630 1 1 18 HYP N N 8.726 1.673 -5.015 1.00 . A A . 18 HYP N 1 1 2 631 1 1 18 HYP O O 9.247 5.279 -5.398 1.00 . A A . 18 HYP O 1 1 2 632 1 1 18 HYP OD1 O 7.241 1.472 -8.238 1.00 . A A . 18 HYP OD1 1 1 2 633 1 1 19 HIS C C 8.462 5.884 -2.264 1.00 . A A . 19 HIS C 1 1 2 634 1 1 19 HIS CA C 7.469 5.371 -3.298 1.00 . A A . 19 HIS CA 1 1 2 635 1 1 19 HIS CB C 6.120 5.058 -2.623 1.00 . A A . 19 HIS CB 1 1 2 636 1 1 19 HIS CD2 C 5.040 3.497 -4.480 1.00 . A A . 19 HIS CD2 1 1 2 637 1 1 19 HIS CE1 C 3.433 4.701 -4.989 1.00 . A A . 19 HIS CE1 1 1 2 638 1 1 19 HIS CG C 5.108 4.637 -3.696 1.00 . A A . 19 HIS CG 1 1 2 639 1 1 19 HIS H H 7.650 3.264 -3.659 1.00 . A A . 19 HIS H 1 1 2 640 1 1 19 HIS HA H 7.337 6.145 -4.036 1.00 . A A . 19 HIS HA 1 1 2 641 1 1 19 HIS HB2 H 6.228 4.255 -1.910 1.00 . A A . 19 HIS HB2 1 1 2 642 1 1 19 HIS HB3 H 5.741 5.933 -2.113 1.00 . A A . 19 HIS HB3 1 1 2 643 1 1 19 HIS HD1 H 3.838 6.211 -3.705 1.00 . A A . 19 HIS HD1 1 1 2 644 1 1 19 HIS HD2 H 5.742 2.681 -4.446 1.00 . A A . 19 HIS HD2 1 1 2 645 1 1 19 HIS HE1 H 2.538 5.074 -5.463 1.00 . A A . 19 HIS HE1 1 1 2 646 1 1 19 HIS N N 7.965 4.135 -3.976 1.00 . A A . 19 HIS N 1 1 2 647 1 1 19 HIS ND1 N 4.085 5.335 -4.066 1.00 . A A . 19 HIS ND1 1 1 2 648 1 1 19 HIS NE2 N 3.993 3.554 -5.277 1.00 . A A . 19 HIS NE2 1 1 2 649 1 1 19 HIS O O 9.119 5.107 -1.602 1.00 . A A . 19 HIS O 1 1 2 650 1 1 20 ARG C C 8.996 7.601 0.238 1.00 . A A . 20 ARG C 1 1 2 651 1 1 20 ARG CA C 9.452 7.861 -1.205 1.00 . A A . 20 ARG CA 1 1 2 652 1 1 20 ARG CB C 9.456 9.380 -1.478 1.00 . A A . 20 ARG CB 1 1 2 653 1 1 20 ARG CD C 11.402 9.281 -3.134 1.00 . A A . 20 ARG CD 1 1 2 654 1 1 20 ARG CG C 9.937 9.710 -2.916 1.00 . A A . 20 ARG CG 1 1 2 655 1 1 20 ARG CZ C 12.020 8.800 -5.483 1.00 . A A . 20 ARG CZ 1 1 2 656 1 1 20 ARG H H 7.960 7.740 -2.749 1.00 . A A . 20 ARG H 1 1 2 657 1 1 20 ARG HA H 10.444 7.450 -1.327 1.00 . A A . 20 ARG HA 1 1 2 658 1 1 20 ARG HB2 H 8.459 9.771 -1.341 1.00 . A A . 20 ARG HB2 1 1 2 659 1 1 20 ARG HB3 H 10.107 9.867 -0.767 1.00 . A A . 20 ARG HB3 1 1 2 660 1 1 20 ARG HD2 H 12.048 9.808 -2.447 1.00 . A A . 20 ARG HD2 1 1 2 661 1 1 20 ARG HD3 H 11.533 8.220 -2.992 1.00 . A A . 20 ARG HD3 1 1 2 662 1 1 20 ARG HE H 11.861 10.625 -4.743 1.00 . A A . 20 ARG HE 1 1 2 663 1 1 20 ARG HG2 H 9.306 9.205 -3.634 1.00 . A A . 20 ARG HG2 1 1 2 664 1 1 20 ARG HG3 H 9.852 10.774 -3.081 1.00 . A A . 20 ARG HG3 1 1 2 665 1 1 20 ARG HH11 H 11.691 7.155 -4.371 1.00 . A A . 20 ARG HH11 1 1 2 666 1 1 20 ARG HH12 H 12.124 6.878 -6.021 1.00 . A A . 20 ARG HH12 1 1 2 667 1 1 20 ARG HH21 H 12.398 10.254 -6.805 1.00 . A A . 20 ARG HH21 1 1 2 668 1 1 20 ARG HH22 H 12.527 8.638 -7.414 1.00 . A A . 20 ARG HH22 1 1 2 669 1 1 20 ARG N N 8.529 7.189 -2.171 1.00 . A A . 20 ARG N 1 1 2 670 1 1 20 ARG NE N 11.785 9.672 -4.530 1.00 . A A . 20 ARG NE 1 1 2 671 1 1 20 ARG NH1 N 11.937 7.512 -5.271 1.00 . A A . 20 ARG NH1 1 1 2 672 1 1 20 ARG NH2 N 12.340 9.267 -6.659 1.00 . A A . 20 ARG NH2 1 1 2 673 1 1 20 ARG O O 9.771 7.747 1.162 1.00 . A A . 20 ARG O 1 1 2 674 1 1 21 CYS C C 7.812 5.634 2.258 1.00 . A A . 21 CYS C 1 1 2 675 1 1 21 CYS CA C 7.190 6.937 1.744 1.00 . A A . 21 CYS CA 1 1 2 676 1 1 21 CYS CB C 5.684 6.743 1.671 1.00 . A A . 21 CYS CB 1 1 2 677 1 1 21 CYS H H 7.182 7.117 -0.412 1.00 . A A . 21 CYS H 1 1 2 678 1 1 21 CYS HA H 7.439 7.749 2.414 1.00 . A A . 21 CYS HA 1 1 2 679 1 1 21 CYS HB2 H 5.492 5.881 1.047 1.00 . A A . 21 CYS HB2 1 1 2 680 1 1 21 CYS HB3 H 5.345 6.491 2.665 1.00 . A A . 21 CYS HB3 1 1 2 681 1 1 21 CYS N N 7.750 7.222 0.383 1.00 . A A . 21 CYS N 1 1 2 682 1 1 21 CYS O O 7.999 5.441 3.443 1.00 . A A . 21 CYS O 1 1 2 683 1 1 21 CYS SG S 4.607 8.069 1.076 1.00 . A A . 21 CYS SG 1 1 2 684 1 1 22 . C C 10.174 3.536 1.087 1.00 . A A . 22 CY3 C 1 1 2 685 1 1 22 . CA C 8.716 3.462 1.565 1.00 . A A . 22 CY3 CA 1 1 2 686 1 1 22 . CB C 7.938 2.414 0.770 1.00 . A A . 22 CY3 CB 1 1 2 687 1 1 22 . H H 7.929 5.038 0.371 1.00 . A A . 22 CY3 H 1 1 2 688 1 1 22 . HA H 8.697 3.242 2.623 1.00 . A A . 22 CY3 HA 1 1 2 689 1 1 22 . HB2 H 8.388 1.448 0.943 1.00 . A A . 22 CY3 HB2 1 1 2 690 1 1 22 . HB3 H 8.069 2.641 -0.279 1.00 . A A . 22 CY3 HB3 1 1 2 691 1 1 22 . HN11 H 9.932 5.374 0.385 1.00 . A A . 22 CY3 HN11 1 1 2 692 1 1 22 . HN12 H 11.472 4.735 0.163 1.00 . A A . 22 CY3 HN12 1 1 2 693 1 1 22 . N N 8.106 4.790 1.303 1.00 . A A . 22 CY3 N 1 1 2 694 1 1 22 . N1 N 10.565 4.635 0.498 1.00 . A A . 22 CY3 N1 1 1 2 695 1 1 22 . O O 10.953 2.614 1.232 1.00 . A A . 22 CY3 O 1 1 2 696 1 1 22 . SG S 6.154 2.231 1.034 1.00 . A A . 22 CY3 SG 1 1 3 697 1 1 1 PCA C C -4.226 4.300 -0.597 1.00 . A A . 1 PCA C 1 1 3 698 1 1 1 PCA CA C -5.727 4.501 -0.851 1.00 . A A . 1 PCA CA 1 1 3 699 1 1 1 PCA CB C -6.573 3.306 -0.399 1.00 . A A . 1 PCA CB 1 1 3 700 1 1 1 PCA CD C -6.783 3.515 -2.750 1.00 . A A . 1 PCA CD 1 1 3 701 1 1 1 PCA CG C -6.825 2.483 -1.655 1.00 . A A . 1 PCA CG 1 1 3 702 1 1 1 PCA HA H -6.059 5.392 -0.336 1.00 . A A . 1 PCA HA 1 1 3 703 1 1 1 PCA HB2 H -7.498 3.662 0.029 1.00 . A A . 1 PCA HB2 1 1 3 704 1 1 1 PCA HB3 H -6.059 2.742 0.365 1.00 . A A . 1 PCA HB3 1 1 3 705 1 1 1 PCA HG2 H -7.794 2.006 -1.608 1.00 . A A . 1 PCA HG2 1 1 3 706 1 1 1 PCA HG3 H -6.044 1.750 -1.797 1.00 . A A . 1 PCA HG3 1 1 3 707 1 1 1 PCA N N -6.011 4.668 -2.292 1.00 . A A . 1 PCA N 1 1 3 708 1 1 1 PCA O O -3.567 3.616 -1.356 1.00 . A A . 1 PCA O 1 1 3 709 1 1 1 PCA OE O -7.311 3.396 -3.838 1.00 . A A . 1 PCA OE 1 1 3 710 1 1 2 ARG C C -2.052 3.666 1.836 1.00 . A A . 2 ARG C 1 1 3 711 1 1 2 ARG CA C -2.313 4.812 0.843 1.00 . A A . 2 ARG CA 1 1 3 712 1 1 2 ARG CB C -1.866 6.166 1.469 1.00 . A A . 2 ARG CB 1 1 3 713 1 1 2 ARG CD C -3.222 7.635 -0.200 1.00 . A A . 2 ARG CD 1 1 3 714 1 1 2 ARG CG C -1.850 7.355 0.457 1.00 . A A . 2 ARG CG 1 1 3 715 1 1 2 ARG CZ C -4.353 8.979 1.519 1.00 . A A . 2 ARG CZ 1 1 3 716 1 1 2 ARG H H -4.364 5.440 1.019 1.00 . A A . 2 ARG H 1 1 3 717 1 1 2 ARG HA H -1.724 4.634 -0.046 1.00 . A A . 2 ARG HA 1 1 3 718 1 1 2 ARG HB2 H -2.526 6.411 2.289 1.00 . A A . 2 ARG HB2 1 1 3 719 1 1 2 ARG HB3 H -0.870 6.051 1.872 1.00 . A A . 2 ARG HB3 1 1 3 720 1 1 2 ARG HD2 H -3.156 8.529 -0.804 1.00 . A A . 2 ARG HD2 1 1 3 721 1 1 2 ARG HD3 H -3.530 6.827 -0.843 1.00 . A A . 2 ARG HD3 1 1 3 722 1 1 2 ARG HE H -4.865 7.115 1.086 1.00 . A A . 2 ARG HE 1 1 3 723 1 1 2 ARG HG2 H -1.521 8.244 0.975 1.00 . A A . 2 ARG HG2 1 1 3 724 1 1 2 ARG HG3 H -1.131 7.140 -0.320 1.00 . A A . 2 ARG HG3 1 1 3 725 1 1 2 ARG HH11 H -2.849 9.886 0.552 1.00 . A A . 2 ARG HH11 1 1 3 726 1 1 2 ARG HH12 H -3.644 10.836 1.762 1.00 . A A . 2 ARG HH12 1 1 3 727 1 1 2 ARG HH21 H -5.879 8.294 2.616 1.00 . A A . 2 ARG HH21 1 1 3 728 1 1 2 ARG HH22 H -5.387 9.921 2.951 1.00 . A A . 2 ARG HH22 1 1 3 729 1 1 2 ARG N N -3.755 4.909 0.463 1.00 . A A . 2 ARG N 1 1 3 730 1 1 2 ARG NE N -4.250 7.847 0.867 1.00 . A A . 2 ARG NE 1 1 3 731 1 1 2 ARG NH1 N -3.553 9.977 1.257 1.00 . A A . 2 ARG NH1 1 1 3 732 1 1 2 ARG NH2 N -5.279 9.073 2.433 1.00 . A A . 2 ARG NH2 1 1 3 733 1 1 2 ARG O O -2.004 3.875 3.034 1.00 . A A . 2 ARG O 1 1 3 734 1 1 3 LEU C C -0.133 1.321 2.512 1.00 . A A . 3 LEU C 1 1 3 735 1 1 3 LEU CA C -1.629 1.287 2.176 1.00 . A A . 3 LEU CA 1 1 3 736 1 1 3 LEU CB C -1.950 -0.035 1.429 1.00 . A A . 3 LEU CB 1 1 3 737 1 1 3 LEU CD1 C -4.006 0.842 0.127 1.00 . A A . 3 LEU CD1 1 1 3 738 1 1 3 LEU CD2 C -3.626 -1.621 0.424 1.00 . A A . 3 LEU CD2 1 1 3 739 1 1 3 LEU CG C -3.455 -0.234 1.081 1.00 . A A . 3 LEU CG 1 1 3 740 1 1 3 LEU H H -1.951 2.369 0.334 1.00 . A A . 3 LEU H 1 1 3 741 1 1 3 LEU HA H -2.209 1.367 3.084 1.00 . A A . 3 LEU HA 1 1 3 742 1 1 3 LEU HB2 H -1.369 -0.080 0.518 1.00 . A A . 3 LEU HB2 1 1 3 743 1 1 3 LEU HB3 H -1.644 -0.855 2.059 1.00 . A A . 3 LEU HB3 1 1 3 744 1 1 3 LEU HD11 H -3.946 1.820 0.573 1.00 . A A . 3 LEU HD11 1 1 3 745 1 1 3 LEU HD12 H -5.045 0.634 -0.084 1.00 . A A . 3 LEU HD12 1 1 3 746 1 1 3 LEU HD13 H -3.457 0.843 -0.804 1.00 . A A . 3 LEU HD13 1 1 3 747 1 1 3 LEU HD21 H -3.306 -2.395 1.105 1.00 . A A . 3 LEU HD21 1 1 3 748 1 1 3 LEU HD22 H -3.034 -1.684 -0.478 1.00 . A A . 3 LEU HD22 1 1 3 749 1 1 3 LEU HD23 H -4.662 -1.789 0.170 1.00 . A A . 3 LEU HD23 1 1 3 750 1 1 3 LEU HG H -4.029 -0.212 1.997 1.00 . A A . 3 LEU HG 1 1 3 751 1 1 3 LEU N N -1.894 2.477 1.306 1.00 . A A . 3 LEU N 1 1 3 752 1 1 3 LEU O O 0.259 1.313 3.660 1.00 . A A . 3 LEU O 1 1 3 753 1 1 4 CYS C C 2.641 2.472 2.433 1.00 . A A . 4 CYS C 1 1 3 754 1 1 4 CYS CA C 2.120 1.397 1.467 1.00 . A A . 4 CYS CA 1 1 3 755 1 1 4 CYS CB C 2.639 1.728 0.062 1.00 . A A . 4 CYS CB 1 1 3 756 1 1 4 CYS H H 0.189 1.334 0.582 1.00 . A A . 4 CYS H 1 1 3 757 1 1 4 CYS HA H 2.515 0.444 1.778 1.00 . A A . 4 CYS HA 1 1 3 758 1 1 4 CYS HB2 H 2.528 2.772 -0.151 1.00 . A A . 4 CYS HB2 1 1 3 759 1 1 4 CYS HB3 H 3.702 1.555 0.098 1.00 . A A . 4 CYS HB3 1 1 3 760 1 1 4 CYS N N 0.628 1.352 1.449 1.00 . A A . 4 CYS N 1 1 3 761 1 1 4 CYS O O 3.327 2.179 3.394 1.00 . A A . 4 CYS O 1 1 3 762 1 1 4 CYS SG S 2.034 0.863 -1.407 1.00 . A A . 4 CYS SG 1 1 3 763 1 1 5 CYS C C 1.978 4.893 4.294 1.00 . A A . 5 CYS C 1 1 3 764 1 1 5 CYS CA C 2.694 4.861 2.943 1.00 . A A . 5 CYS CA 1 1 3 765 1 1 5 CYS CB C 2.388 6.151 2.166 1.00 . A A . 5 CYS CB 1 1 3 766 1 1 5 CYS H H 1.709 3.833 1.333 1.00 . A A . 5 CYS H 1 1 3 767 1 1 5 CYS HA H 3.759 4.792 3.116 1.00 . A A . 5 CYS HA 1 1 3 768 1 1 5 CYS HB2 H 2.725 6.033 1.146 1.00 . A A . 5 CYS HB2 1 1 3 769 1 1 5 CYS HB3 H 1.320 6.312 2.142 1.00 . A A . 5 CYS HB3 1 1 3 770 1 1 5 CYS N N 2.273 3.690 2.122 1.00 . A A . 5 CYS N 1 1 3 771 1 1 5 CYS O O 2.594 5.164 5.308 1.00 . A A . 5 CYS O 1 1 3 772 1 1 5 CYS SG S 3.160 7.639 2.842 1.00 . A A . 5 CYS SG 1 1 3 773 1 1 6 GLY C C 0.463 3.652 6.560 1.00 . A A . 6 GLY C 1 1 3 774 1 1 6 GLY CA C -0.120 4.614 5.520 1.00 . A A . 6 GLY CA 1 1 3 775 1 1 6 GLY H H 0.267 4.406 3.409 1.00 . A A . 6 GLY H 1 1 3 776 1 1 6 GLY HA2 H -0.143 5.614 5.929 1.00 . A A . 6 GLY HA2 1 1 3 777 1 1 6 GLY HA3 H -1.127 4.302 5.286 1.00 . A A . 6 GLY HA3 1 1 3 778 1 1 6 GLY N N 0.696 4.615 4.265 1.00 . A A . 6 GLY N 1 1 3 779 1 1 6 GLY O O 0.432 3.922 7.744 1.00 . A A . 6 GLY O 1 1 3 780 1 1 7 PHE C C 2.536 0.559 6.173 1.00 . A A . 7 PHE C 1 1 3 781 1 1 7 PHE CA C 1.585 1.514 6.946 1.00 . A A . 7 PHE CA 1 1 3 782 1 1 7 PHE CB C 0.431 0.726 7.629 1.00 . A A . 7 PHE CB 1 1 3 783 1 1 7 PHE CD1 C -0.256 -1.043 5.959 1.00 . A A . 7 PHE CD1 1 1 3 784 1 1 7 PHE CD2 C -1.744 0.775 6.321 1.00 . A A . 7 PHE CD2 1 1 3 785 1 1 7 PHE CE1 C -1.131 -1.588 5.046 1.00 . A A . 7 PHE CE1 1 1 3 786 1 1 7 PHE CE2 C -2.624 0.235 5.407 1.00 . A A . 7 PHE CE2 1 1 3 787 1 1 7 PHE CG C -0.552 0.137 6.604 1.00 . A A . 7 PHE CG 1 1 3 788 1 1 7 PHE CZ C -2.319 -0.947 4.769 1.00 . A A . 7 PHE CZ 1 1 3 789 1 1 7 PHE H H 0.963 2.417 5.098 1.00 . A A . 7 PHE H 1 1 3 790 1 1 7 PHE HA H 2.146 2.030 7.710 1.00 . A A . 7 PHE HA 1 1 3 791 1 1 7 PHE HB2 H 0.841 -0.082 8.217 1.00 . A A . 7 PHE HB2 1 1 3 792 1 1 7 PHE HB3 H -0.113 1.382 8.294 1.00 . A A . 7 PHE HB3 1 1 3 793 1 1 7 PHE HD1 H 0.676 -1.536 6.180 1.00 . A A . 7 PHE HD1 1 1 3 794 1 1 7 PHE HD2 H -1.991 1.702 6.818 1.00 . A A . 7 PHE HD2 1 1 3 795 1 1 7 PHE HE1 H -0.886 -2.514 4.550 1.00 . A A . 7 PHE HE1 1 1 3 796 1 1 7 PHE HE2 H -3.556 0.739 5.192 1.00 . A A . 7 PHE HE2 1 1 3 797 1 1 7 PHE HZ H -3.007 -1.372 4.054 1.00 . A A . 7 PHE HZ 1 1 3 798 1 1 7 PHE N N 0.976 2.553 6.065 1.00 . A A . 7 PHE N 1 1 3 799 1 1 7 PHE O O 2.230 0.095 5.086 1.00 . A A . 7 PHE O 1 1 3 800 1 1 8 HYP C C 4.490 -1.838 5.701 1.00 . A A . 8 HYP C 1 1 3 801 1 1 8 HYP CA C 4.798 -0.386 6.089 1.00 . A A . 8 HYP CA 1 1 3 802 1 1 8 HYP CB C 5.965 -0.262 7.062 1.00 . A A . 8 HYP CB 1 1 3 803 1 1 8 HYP CD C 4.034 0.574 8.178 1.00 . A A . 8 HYP CD 1 1 3 804 1 1 8 HYP CG C 5.300 -0.209 8.393 1.00 . A A . 8 HYP CG 1 1 3 805 1 1 8 HYP HA H 5.058 0.150 5.189 1.00 . A A . 8 HYP HA 1 1 3 806 1 1 8 HYP HB2 H 6.528 0.636 6.850 1.00 . A A . 8 HYP HB2 1 1 3 807 1 1 8 HYP HB3 H 6.637 -1.103 6.975 1.00 . A A . 8 HYP HB3 1 1 3 808 1 1 8 HYP HD1 H 6.688 -0.225 9.754 1.00 . A A . 8 HYP HD1 1 1 3 809 1 1 8 HYP HD22 H 4.215 1.631 8.320 1.00 . A A . 8 HYP HD22 1 1 3 810 1 1 8 HYP HD23 H 3.263 0.229 8.854 1.00 . A A . 8 HYP HD23 1 1 3 811 1 1 8 HYP HG H 5.068 -1.210 8.730 1.00 . A A . 8 HYP HG 1 1 3 812 1 1 8 HYP N N 3.675 0.284 6.773 1.00 . A A . 8 HYP N 1 1 3 813 1 1 8 HYP O O 5.303 -2.464 5.047 1.00 . A A . 8 HYP O 1 1 3 814 1 1 8 HYP OD1 O 6.138 0.442 9.337 1.00 . A A . 8 HYP OD1 1 1 3 815 1 1 9 LYS C C 2.859 -3.843 4.254 1.00 . A A . 9 LYS C 1 1 3 816 1 1 9 LYS CA C 2.968 -3.723 5.777 1.00 . A A . 9 LYS CA 1 1 3 817 1 1 9 LYS CB C 1.610 -4.082 6.430 1.00 . A A . 9 LYS CB 1 1 3 818 1 1 9 LYS CD C -0.081 -5.969 6.819 1.00 . A A . 9 LYS CD 1 1 3 819 1 1 9 LYS CE C -1.254 -5.149 6.241 1.00 . A A . 9 LYS CE 1 1 3 820 1 1 9 LYS CG C 1.265 -5.572 6.159 1.00 . A A . 9 LYS CG 1 1 3 821 1 1 9 LYS H H 2.729 -1.763 6.635 1.00 . A A . 9 LYS H 1 1 3 822 1 1 9 LYS HA H 3.744 -4.387 6.130 1.00 . A A . 9 LYS HA 1 1 3 823 1 1 9 LYS HB2 H 1.650 -3.894 7.493 1.00 . A A . 9 LYS HB2 1 1 3 824 1 1 9 LYS HB3 H 0.839 -3.476 5.992 1.00 . A A . 9 LYS HB3 1 1 3 825 1 1 9 LYS HD2 H -0.264 -7.021 6.646 1.00 . A A . 9 LYS HD2 1 1 3 826 1 1 9 LYS HD3 H -0.022 -5.807 7.885 1.00 . A A . 9 LYS HD3 1 1 3 827 1 1 9 LYS HE2 H -1.128 -4.098 6.450 1.00 . A A . 9 LYS HE2 1 1 3 828 1 1 9 LYS HE3 H -1.326 -5.292 5.172 1.00 . A A . 9 LYS HE3 1 1 3 829 1 1 9 LYS HG2 H 1.192 -5.743 5.095 1.00 . A A . 9 LYS HG2 1 1 3 830 1 1 9 LYS HG3 H 2.052 -6.201 6.551 1.00 . A A . 9 LYS HG3 1 1 3 831 1 1 9 LYS HZ1 H -2.732 -6.571 6.587 1.00 . A A . 9 LYS HZ1 1 1 3 832 1 1 9 LYS HZ2 H -3.305 -4.973 6.549 1.00 . A A . 9 LYS HZ2 1 1 3 833 1 1 9 LYS HZ3 H -2.446 -5.535 7.903 1.00 . A A . 9 LYS HZ3 1 1 3 834 1 1 9 LYS N N 3.341 -2.320 6.112 1.00 . A A . 9 LYS N 1 1 3 835 1 1 9 LYS NZ N -2.531 -5.590 6.867 1.00 . A A . 9 LYS NZ 1 1 3 836 1 1 9 LYS O O 3.233 -4.870 3.718 1.00 . A A . 9 LYS O 1 1 3 837 1 1 10 SER C C 3.600 -2.613 1.421 1.00 . A A . 10 SER C 1 1 3 838 1 1 10 SER CA C 2.265 -2.943 2.106 1.00 . A A . 10 SER CA 1 1 3 839 1 1 10 SER CB C 1.144 -2.009 1.635 1.00 . A A . 10 SER CB 1 1 3 840 1 1 10 SER H H 2.068 -1.980 4.017 1.00 . A A . 10 SER H 1 1 3 841 1 1 10 SER HA H 1.997 -3.959 1.853 1.00 . A A . 10 SER HA 1 1 3 842 1 1 10 SER HB2 H 1.262 -1.017 2.025 1.00 . A A . 10 SER HB2 1 1 3 843 1 1 10 SER HB3 H 1.037 -1.994 0.560 1.00 . A A . 10 SER HB3 1 1 3 844 1 1 10 SER HG H -0.717 -2.566 1.573 1.00 . A A . 10 SER HG 1 1 3 845 1 1 10 SER N N 2.367 -2.817 3.589 1.00 . A A . 10 SER N 1 1 3 846 1 1 10 SER O O 3.779 -2.979 0.277 1.00 . A A . 10 SER O 1 1 3 847 1 1 10 SER OG O -0.014 -2.576 2.227 1.00 . A A . 10 SER OG 1 1 3 848 1 1 11 CYS C C 6.647 -2.820 1.019 1.00 . A A . 11 CYS C 1 1 3 849 1 1 11 CYS CA C 5.829 -1.605 1.497 1.00 . A A . 11 CYS CA 1 1 3 850 1 1 11 CYS CB C 6.711 -0.826 2.492 1.00 . A A . 11 CYS CB 1 1 3 851 1 1 11 CYS H H 4.309 -1.683 3.039 1.00 . A A . 11 CYS H 1 1 3 852 1 1 11 CYS HA H 5.650 -0.966 0.651 1.00 . A A . 11 CYS HA 1 1 3 853 1 1 11 CYS HB2 H 6.789 -1.409 3.395 1.00 . A A . 11 CYS HB2 1 1 3 854 1 1 11 CYS HB3 H 7.705 -0.755 2.077 1.00 . A A . 11 CYS HB3 1 1 3 855 1 1 11 CYS N N 4.502 -1.952 2.117 1.00 . A A . 11 CYS N 1 1 3 856 1 1 11 CYS O O 7.632 -2.653 0.325 1.00 . A A . 11 CYS O 1 1 3 857 1 1 11 CYS SG S 6.251 0.853 2.985 1.00 . A A . 11 CYS SG 1 1 3 858 1 1 12 ARG C C 6.587 -5.602 -0.478 1.00 . A A . 12 ARG C 1 1 3 859 1 1 12 ARG CA C 6.951 -5.238 0.980 1.00 . A A . 12 ARG CA 1 1 3 860 1 1 12 ARG CB C 6.548 -6.356 1.971 1.00 . A A . 12 ARG CB 1 1 3 861 1 1 12 ARG CD C 6.936 -8.730 2.719 1.00 . A A . 12 ARG CD 1 1 3 862 1 1 12 ARG CG C 7.337 -7.655 1.691 1.00 . A A . 12 ARG CG 1 1 3 863 1 1 12 ARG CZ C 7.449 -10.801 1.491 1.00 . A A . 12 ARG CZ 1 1 3 864 1 1 12 ARG H H 5.417 -4.074 1.948 1.00 . A A . 12 ARG H 1 1 3 865 1 1 12 ARG HA H 8.015 -5.061 1.044 1.00 . A A . 12 ARG HA 1 1 3 866 1 1 12 ARG HB2 H 6.754 -6.023 2.978 1.00 . A A . 12 ARG HB2 1 1 3 867 1 1 12 ARG HB3 H 5.488 -6.548 1.886 1.00 . A A . 12 ARG HB3 1 1 3 868 1 1 12 ARG HD2 H 7.148 -8.390 3.722 1.00 . A A . 12 ARG HD2 1 1 3 869 1 1 12 ARG HD3 H 5.885 -8.969 2.644 1.00 . A A . 12 ARG HD3 1 1 3 870 1 1 12 ARG HE H 8.526 -10.147 3.018 1.00 . A A . 12 ARG HE 1 1 3 871 1 1 12 ARG HG2 H 7.115 -8.021 0.700 1.00 . A A . 12 ARG HG2 1 1 3 872 1 1 12 ARG HG3 H 8.398 -7.464 1.760 1.00 . A A . 12 ARG HG3 1 1 3 873 1 1 12 ARG HH11 H 5.842 -9.784 0.851 1.00 . A A . 12 ARG HH11 1 1 3 874 1 1 12 ARG HH12 H 6.203 -11.241 -0.012 1.00 . A A . 12 ARG HH12 1 1 3 875 1 1 12 ARG HH21 H 8.999 -11.983 1.939 1.00 . A A . 12 ARG HH21 1 1 3 876 1 1 12 ARG HH22 H 8.016 -12.506 0.610 1.00 . A A . 12 ARG HH22 1 1 3 877 1 1 12 ARG N N 6.221 -3.999 1.393 1.00 . A A . 12 ARG N 1 1 3 878 1 1 12 ARG NE N 7.747 -9.962 2.454 1.00 . A A . 12 ARG NE 1 1 3 879 1 1 12 ARG NH1 N 6.417 -10.591 0.717 1.00 . A A . 12 ARG NH1 1 1 3 880 1 1 12 ARG NH2 N 8.215 -11.845 1.335 1.00 . A A . 12 ARG NH2 1 1 3 881 1 1 12 ARG O O 7.234 -6.428 -1.093 1.00 . A A . 12 ARG O 1 1 3 882 1 1 13 SER C C 5.871 -4.331 -3.369 1.00 . A A . 13 SER C 1 1 3 883 1 1 13 SER CA C 5.087 -5.202 -2.380 1.00 . A A . 13 SER CA 1 1 3 884 1 1 13 SER CB C 3.587 -4.861 -2.458 1.00 . A A . 13 SER CB 1 1 3 885 1 1 13 SER H H 5.094 -4.303 -0.431 1.00 . A A . 13 SER H 1 1 3 886 1 1 13 SER HA H 5.235 -6.243 -2.629 1.00 . A A . 13 SER HA 1 1 3 887 1 1 13 SER HB2 H 3.004 -5.488 -1.800 1.00 . A A . 13 SER HB2 1 1 3 888 1 1 13 SER HB3 H 3.407 -3.819 -2.234 1.00 . A A . 13 SER HB3 1 1 3 889 1 1 13 SER HG H 3.792 -5.802 -4.159 1.00 . A A . 13 SER HG 1 1 3 890 1 1 13 SER N N 5.561 -4.960 -0.983 1.00 . A A . 13 SER N 1 1 3 891 1 1 13 SER O O 6.218 -3.205 -3.060 1.00 . A A . 13 SER O 1 1 3 892 1 1 13 SER OG O 3.216 -5.120 -3.808 1.00 . A A . 13 SER OG 1 1 3 893 1 1 14 ARG C C 6.198 -2.828 -5.924 1.00 . A A . 14 ARG C 1 1 3 894 1 1 14 ARG CA C 6.870 -4.171 -5.601 1.00 . A A . 14 ARG CA 1 1 3 895 1 1 14 ARG CB C 6.919 -5.066 -6.866 1.00 . A A . 14 ARG CB 1 1 3 896 1 1 14 ARG CD C 9.109 -3.999 -7.668 1.00 . A A . 14 ARG CD 1 1 3 897 1 1 14 ARG CG C 7.651 -4.355 -8.042 1.00 . A A . 14 ARG CG 1 1 3 898 1 1 14 ARG CZ C 9.569 -2.033 -9.071 1.00 . A A . 14 ARG CZ 1 1 3 899 1 1 14 ARG H H 5.798 -5.805 -4.695 1.00 . A A . 14 ARG H 1 1 3 900 1 1 14 ARG HA H 7.872 -3.996 -5.249 1.00 . A A . 14 ARG HA 1 1 3 901 1 1 14 ARG HB2 H 7.434 -5.987 -6.630 1.00 . A A . 14 ARG HB2 1 1 3 902 1 1 14 ARG HB3 H 5.913 -5.312 -7.173 1.00 . A A . 14 ARG HB3 1 1 3 903 1 1 14 ARG HD2 H 9.154 -3.347 -6.809 1.00 . A A . 14 ARG HD2 1 1 3 904 1 1 14 ARG HD3 H 9.669 -4.898 -7.452 1.00 . A A . 14 ARG HD3 1 1 3 905 1 1 14 ARG HE H 10.313 -3.832 -9.444 1.00 . A A . 14 ARG HE 1 1 3 906 1 1 14 ARG HG2 H 7.661 -5.017 -8.895 1.00 . A A . 14 ARG HG2 1 1 3 907 1 1 14 ARG HG3 H 7.115 -3.460 -8.320 1.00 . A A . 14 ARG HG3 1 1 3 908 1 1 14 ARG HH11 H 8.377 -1.723 -7.493 1.00 . A A . 14 ARG HH11 1 1 3 909 1 1 14 ARG HH12 H 8.694 -0.332 -8.474 1.00 . A A . 14 ARG HH12 1 1 3 910 1 1 14 ARG HH21 H 10.730 -2.089 -10.700 1.00 . A A . 14 ARG HH21 1 1 3 911 1 1 14 ARG HH22 H 10.047 -0.543 -10.317 1.00 . A A . 14 ARG HH22 1 1 3 912 1 1 14 ARG N N 6.116 -4.894 -4.529 1.00 . A A . 14 ARG N 1 1 3 913 1 1 14 ARG NE N 9.746 -3.312 -8.836 1.00 . A A . 14 ARG NE 1 1 3 914 1 1 14 ARG NH1 N 8.822 -1.307 -8.285 1.00 . A A . 14 ARG NH1 1 1 3 915 1 1 14 ARG NH2 N 10.162 -1.514 -10.110 1.00 . A A . 14 ARG NH2 1 1 3 916 1 1 14 ARG O O 6.865 -1.831 -6.116 1.00 . A A . 14 ARG O 1 1 3 917 1 1 15 GLN C C 4.409 -0.510 -5.264 1.00 . A A . 15 GLN C 1 1 3 918 1 1 15 GLN CA C 4.090 -1.629 -6.268 1.00 . A A . 15 GLN CA 1 1 3 919 1 1 15 GLN CB C 2.598 -2.006 -6.204 1.00 . A A . 15 GLN CB 1 1 3 920 1 1 15 GLN CD C 0.240 -1.219 -6.469 1.00 . A A . 15 GLN CD 1 1 3 921 1 1 15 GLN CG C 1.709 -0.788 -6.537 1.00 . A A . 15 GLN CG 1 1 3 922 1 1 15 GLN H H 4.421 -3.701 -5.794 1.00 . A A . 15 GLN H 1 1 3 923 1 1 15 GLN HA H 4.342 -1.290 -7.263 1.00 . A A . 15 GLN HA 1 1 3 924 1 1 15 GLN HB2 H 2.399 -2.800 -6.909 1.00 . A A . 15 GLN HB2 1 1 3 925 1 1 15 GLN HB3 H 2.361 -2.365 -5.212 1.00 . A A . 15 GLN HB3 1 1 3 926 1 1 15 GLN HE21 H 0.245 -1.345 -4.488 1.00 . A A . 15 GLN HE21 1 1 3 927 1 1 15 GLN HE22 H -1.230 -1.726 -5.236 1.00 . A A . 15 GLN HE22 1 1 3 928 1 1 15 GLN HG2 H 1.864 0.010 -5.827 1.00 . A A . 15 GLN HG2 1 1 3 929 1 1 15 GLN HG3 H 1.923 -0.423 -7.532 1.00 . A A . 15 GLN HG3 1 1 3 930 1 1 15 GLN N N 4.888 -2.857 -5.966 1.00 . A A . 15 GLN N 1 1 3 931 1 1 15 GLN NE2 N -0.293 -1.449 -5.300 1.00 . A A . 15 GLN NE2 1 1 3 932 1 1 15 GLN O O 4.414 0.652 -5.620 1.00 . A A . 15 GLN O 1 1 3 933 1 1 15 GLN OE1 O -0.433 -1.349 -7.471 1.00 . A A . 15 GLN OE1 1 1 3 934 1 1 16 CYS C C 6.465 0.499 -2.903 1.00 . A A . 16 CYS C 1 1 3 935 1 1 16 CYS CA C 4.991 0.077 -2.970 1.00 . A A . 16 CYS CA 1 1 3 936 1 1 16 CYS CB C 4.619 -0.502 -1.624 1.00 . A A . 16 CYS CB 1 1 3 937 1 1 16 CYS H H 4.643 -1.863 -3.829 1.00 . A A . 16 CYS H 1 1 3 938 1 1 16 CYS HA H 4.387 0.956 -3.126 1.00 . A A . 16 CYS HA 1 1 3 939 1 1 16 CYS HB2 H 5.215 -1.371 -1.436 1.00 . A A . 16 CYS HB2 1 1 3 940 1 1 16 CYS HB3 H 4.906 0.231 -0.887 1.00 . A A . 16 CYS HB3 1 1 3 941 1 1 16 CYS N N 4.665 -0.907 -4.043 1.00 . A A . 16 CYS N 1 1 3 942 1 1 16 CYS O O 6.757 1.559 -2.382 1.00 . A A . 16 CYS O 1 1 3 943 1 1 16 CYS SG S 2.907 -0.945 -1.268 1.00 . A A . 16 CYS SG 1 1 3 944 1 1 17 LYS C C 9.141 1.455 -3.895 1.00 . A A . 17 LYS C 1 1 3 945 1 1 17 LYS CA C 8.814 0.028 -3.382 1.00 . A A . 17 LYS CA 1 1 3 946 1 1 17 LYS CB C 9.616 -0.997 -4.232 1.00 . A A . 17 LYS CB 1 1 3 947 1 1 17 LYS CD C 9.874 -2.637 -2.274 1.00 . A A . 17 LYS CD 1 1 3 948 1 1 17 LYS CE C 9.614 -4.103 -1.882 1.00 . A A . 17 LYS CE 1 1 3 949 1 1 17 LYS CG C 9.402 -2.439 -3.730 1.00 . A A . 17 LYS CG 1 1 3 950 1 1 17 LYS H H 7.054 -1.167 -3.816 1.00 . A A . 17 LYS H 1 1 3 951 1 1 17 LYS HA H 9.143 -0.029 -2.355 1.00 . A A . 17 LYS HA 1 1 3 952 1 1 17 LYS HB2 H 9.320 -0.950 -5.266 1.00 . A A . 17 LYS HB2 1 1 3 953 1 1 17 LYS HB3 H 10.669 -0.759 -4.175 1.00 . A A . 17 LYS HB3 1 1 3 954 1 1 17 LYS HD2 H 10.928 -2.414 -2.191 1.00 . A A . 17 LYS HD2 1 1 3 955 1 1 17 LYS HD3 H 9.324 -1.994 -1.603 1.00 . A A . 17 LYS HD3 1 1 3 956 1 1 17 LYS HE2 H 8.560 -4.327 -1.964 1.00 . A A . 17 LYS HE2 1 1 3 957 1 1 17 LYS HE3 H 10.166 -4.769 -2.528 1.00 . A A . 17 LYS HE3 1 1 3 958 1 1 17 LYS HG2 H 8.352 -2.665 -3.786 1.00 . A A . 17 LYS HG2 1 1 3 959 1 1 17 LYS HG3 H 9.933 -3.120 -4.379 1.00 . A A . 17 LYS HG3 1 1 3 960 1 1 17 LYS HZ1 H 9.643 -3.609 0.141 1.00 . A A . 17 LYS HZ1 1 1 3 961 1 1 17 LYS HZ2 H 11.081 -4.318 -0.422 1.00 . A A . 17 LYS HZ2 1 1 3 962 1 1 17 LYS HZ3 H 9.703 -5.278 -0.167 1.00 . A A . 17 LYS HZ3 1 1 3 963 1 1 17 LYS N N 7.351 -0.321 -3.414 1.00 . A A . 17 LYS N 1 1 3 964 1 1 17 LYS NZ N 10.043 -4.344 -0.476 1.00 . A A . 17 LYS NZ 1 1 3 965 1 1 17 LYS O O 9.859 2.162 -3.216 1.00 . A A . 17 LYS O 1 1 3 966 1 1 18 HYP C C 8.390 4.375 -4.806 1.00 . A A . 18 HYP C 1 1 3 967 1 1 18 HYP CA C 8.951 3.185 -5.615 1.00 . A A . 18 HYP CA 1 1 3 968 1 1 18 HYP CB C 8.407 3.125 -7.043 1.00 . A A . 18 HYP CB 1 1 3 969 1 1 18 HYP CD C 7.709 1.123 -5.939 1.00 . A A . 18 HYP CD 1 1 3 970 1 1 18 HYP CG C 7.297 2.137 -6.971 1.00 . A A . 18 HYP CG 1 1 3 971 1 1 18 HYP HA H 10.023 3.312 -5.683 1.00 . A A . 18 HYP HA 1 1 3 972 1 1 18 HYP HB2 H 9.190 2.809 -7.719 1.00 . A A . 18 HYP HB2 1 1 3 973 1 1 18 HYP HB3 H 8.063 4.096 -7.369 1.00 . A A . 18 HYP HB3 1 1 3 974 1 1 18 HYP HD1 H 6.960 0.576 -8.091 1.00 . A A . 18 HYP HD1 1 1 3 975 1 1 18 HYP HD22 H 8.212 0.300 -6.420 1.00 . A A . 18 HYP HD22 1 1 3 976 1 1 18 HYP HD23 H 6.835 0.779 -5.415 1.00 . A A . 18 HYP HD23 1 1 3 977 1 1 18 HYP HG H 6.385 2.632 -6.673 1.00 . A A . 18 HYP HG 1 1 3 978 1 1 18 HYP N N 8.631 1.857 -5.044 1.00 . A A . 18 HYP N 1 1 3 979 1 1 18 HYP O O 8.579 5.508 -5.208 1.00 . A A . 18 HYP O 1 1 3 980 1 1 18 HYP OD1 O 7.116 1.512 -8.235 1.00 . A A . 18 HYP OD1 1 1 3 981 1 1 19 HIS C C 8.239 5.731 -1.961 1.00 . A A . 19 HIS C 1 1 3 982 1 1 19 HIS CA C 7.154 5.169 -2.861 1.00 . A A . 19 HIS CA 1 1 3 983 1 1 19 HIS CB C 6.011 4.605 -1.990 1.00 . A A . 19 HIS CB 1 1 3 984 1 1 19 HIS CD2 C 4.863 3.366 -4.056 1.00 . A A . 19 HIS CD2 1 1 3 985 1 1 19 HIS CE1 C 2.889 3.629 -3.487 1.00 . A A . 19 HIS CE1 1 1 3 986 1 1 19 HIS CG C 4.864 4.062 -2.857 1.00 . A A . 19 HIS CG 1 1 3 987 1 1 19 HIS H H 7.613 3.157 -3.430 1.00 . A A . 19 HIS H 1 1 3 988 1 1 19 HIS HA H 6.799 5.965 -3.492 1.00 . A A . 19 HIS HA 1 1 3 989 1 1 19 HIS HB2 H 6.376 3.804 -1.364 1.00 . A A . 19 HIS HB2 1 1 3 990 1 1 19 HIS HB3 H 5.618 5.386 -1.355 1.00 . A A . 19 HIS HB3 1 1 3 991 1 1 19 HIS HD1 H 3.259 4.638 -1.773 1.00 . A A . 19 HIS HD1 1 1 3 992 1 1 19 HIS HD2 H 5.743 3.073 -4.607 1.00 . A A . 19 HIS HD2 1 1 3 993 1 1 19 HIS HE1 H 1.809 3.600 -3.475 1.00 . A A . 19 HIS HE1 1 1 3 994 1 1 19 HIS N N 7.733 4.086 -3.710 1.00 . A A . 19 HIS N 1 1 3 995 1 1 19 HIS ND1 N 3.611 4.187 -2.569 1.00 . A A . 19 HIS ND1 1 1 3 996 1 1 19 HIS NE2 N 3.628 3.105 -4.433 1.00 . A A . 19 HIS NE2 1 1 3 997 1 1 19 HIS O O 9.004 4.984 -1.389 1.00 . A A . 19 HIS O 1 1 3 998 1 1 20 ARG C C 8.969 7.470 0.461 1.00 . A A . 20 ARG C 1 1 3 999 1 1 20 ARG CA C 9.277 7.736 -1.021 1.00 . A A . 20 ARG CA 1 1 3 1000 1 1 20 ARG CB C 9.214 9.246 -1.313 1.00 . A A . 20 ARG CB 1 1 3 1001 1 1 20 ARG CD C 9.421 11.007 -3.098 1.00 . A A . 20 ARG CD 1 1 3 1002 1 1 20 ARG CG C 9.490 9.497 -2.812 1.00 . A A . 20 ARG CG 1 1 3 1003 1 1 20 ARG CZ C 8.676 11.038 -5.436 1.00 . A A . 20 ARG CZ 1 1 3 1004 1 1 20 ARG H H 7.609 7.565 -2.372 1.00 . A A . 20 ARG H 1 1 3 1005 1 1 20 ARG HA H 10.260 7.349 -1.249 1.00 . A A . 20 ARG HA 1 1 3 1006 1 1 20 ARG HB2 H 8.237 9.627 -1.052 1.00 . A A . 20 ARG HB2 1 1 3 1007 1 1 20 ARG HB3 H 9.955 9.760 -0.717 1.00 . A A . 20 ARG HB3 1 1 3 1008 1 1 20 ARG HD2 H 8.463 11.416 -2.809 1.00 . A A . 20 ARG HD2 1 1 3 1009 1 1 20 ARG HD3 H 10.200 11.524 -2.557 1.00 . A A . 20 ARG HD3 1 1 3 1010 1 1 20 ARG HE H 10.518 11.512 -4.880 1.00 . A A . 20 ARG HE 1 1 3 1011 1 1 20 ARG HG2 H 10.472 9.126 -3.072 1.00 . A A . 20 ARG HG2 1 1 3 1012 1 1 20 ARG HG3 H 8.758 8.980 -3.414 1.00 . A A . 20 ARG HG3 1 1 3 1013 1 1 20 ARG HH11 H 7.302 10.497 -4.080 1.00 . A A . 20 ARG HH11 1 1 3 1014 1 1 20 ARG HH12 H 6.763 10.517 -5.725 1.00 . A A . 20 ARG HH12 1 1 3 1015 1 1 20 ARG HH21 H 9.857 11.540 -6.971 1.00 . A A . 20 ARG HH21 1 1 3 1016 1 1 20 ARG HH22 H 8.228 11.114 -7.384 1.00 . A A . 20 ARG HH22 1 1 3 1017 1 1 20 ARG N N 8.265 7.037 -1.872 1.00 . A A . 20 ARG N 1 1 3 1018 1 1 20 ARG NE N 9.637 11.224 -4.563 1.00 . A A . 20 ARG NE 1 1 3 1019 1 1 20 ARG NH1 N 7.488 10.654 -5.050 1.00 . A A . 20 ARG NH1 1 1 3 1020 1 1 20 ARG NH2 N 8.942 11.247 -6.696 1.00 . A A . 20 ARG NH2 1 1 3 1021 1 1 20 ARG O O 9.807 7.677 1.318 1.00 . A A . 20 ARG O 1 1 3 1022 1 1 21 CYS C C 8.005 5.405 2.536 1.00 . A A . 21 CYS C 1 1 3 1023 1 1 21 CYS CA C 7.316 6.705 2.103 1.00 . A A . 21 CYS CA 1 1 3 1024 1 1 21 CYS CB C 5.813 6.492 2.125 1.00 . A A . 21 CYS CB 1 1 3 1025 1 1 21 CYS H H 7.145 6.867 -0.040 1.00 . A A . 21 CYS H 1 1 3 1026 1 1 21 CYS HA H 7.605 7.508 2.766 1.00 . A A . 21 CYS HA 1 1 3 1027 1 1 21 CYS HB2 H 5.593 5.613 1.535 1.00 . A A . 21 CYS HB2 1 1 3 1028 1 1 21 CYS HB3 H 5.535 6.268 3.145 1.00 . A A . 21 CYS HB3 1 1 3 1029 1 1 21 CYS N N 7.764 7.014 0.707 1.00 . A A . 21 CYS N 1 1 3 1030 1 1 21 CYS O O 8.323 5.210 3.693 1.00 . A A . 21 CYS O 1 1 3 1031 1 1 21 CYS SG S 4.703 7.800 1.551 1.00 . A A . 21 CYS SG 1 1 3 1032 1 1 22 . C C 10.287 3.394 1.205 1.00 . A A . 22 CY3 C 1 1 3 1033 1 1 22 . CA C 8.859 3.241 1.746 1.00 . A A . 22 CY3 CA 1 1 3 1034 1 1 22 . CB C 8.111 2.173 0.941 1.00 . A A . 22 CY3 CB 1 1 3 1035 1 1 22 . H H 7.925 4.809 0.644 1.00 . A A . 22 CY3 H 1 1 3 1036 1 1 22 . HA H 8.892 2.987 2.797 1.00 . A A . 22 CY3 HA 1 1 3 1037 1 1 22 . HB2 H 8.625 1.233 1.079 1.00 . A A . 22 CY3 HB2 1 1 3 1038 1 1 22 . HB3 H 8.202 2.430 -0.105 1.00 . A A . 22 CY3 HB3 1 1 3 1039 1 1 22 . HN11 H 9.889 5.191 0.477 1.00 . A A . 22 CY3 HN11 1 1 3 1040 1 1 22 . HN12 H 11.457 4.657 0.190 1.00 . A A . 22 CY3 HN12 1 1 3 1041 1 1 22 . N N 8.205 4.564 1.552 1.00 . A A . 22 CY3 N 1 1 3 1042 1 1 22 . N1 N 10.576 4.501 0.574 1.00 . A A . 22 CY3 N1 1 1 3 1043 1 1 22 . O O 11.127 2.527 1.335 1.00 . A A . 22 CY3 O 1 1 3 1044 1 1 22 . SG S 6.350 1.867 1.240 1.00 . A A . 22 CY3 SG 1 1 4 1045 1 1 1 PCA C C -3.845 5.464 0.298 1.00 . A A . 1 PCA C 1 1 4 1046 1 1 1 PCA CA C -5.324 5.710 -0.044 1.00 . A A . 1 PCA CA 1 1 4 1047 1 1 1 PCA CB C -5.730 5.179 -1.434 1.00 . A A . 1 PCA CB 1 1 4 1048 1 1 1 PCA CD C -5.934 7.547 -1.449 1.00 . A A . 1 PCA CD 1 1 4 1049 1 1 1 PCA CG C -5.688 6.378 -2.370 1.00 . A A . 1 PCA CG 1 1 4 1050 1 1 1 PCA HA H -5.944 5.250 0.712 1.00 . A A . 1 PCA HA 1 1 4 1051 1 1 1 PCA HB2 H -6.721 4.754 -1.383 1.00 . A A . 1 PCA HB2 1 1 4 1052 1 1 1 PCA HB3 H -5.061 4.393 -1.758 1.00 . A A . 1 PCA HB3 1 1 4 1053 1 1 1 PCA HG2 H -6.469 6.304 -3.113 1.00 . A A . 1 PCA HG2 1 1 4 1054 1 1 1 PCA HG3 H -4.718 6.459 -2.840 1.00 . A A . 1 PCA HG3 1 1 4 1055 1 1 1 PCA N N -5.619 7.157 -0.077 1.00 . A A . 1 PCA N 1 1 4 1056 1 1 1 PCA O O -3.045 5.185 -0.575 1.00 . A A . 1 PCA O 1 1 4 1057 1 1 1 PCA OE O -6.331 8.638 -1.806 1.00 . A A . 1 PCA OE 1 1 4 1058 1 1 2 ARG C C -2.004 3.957 2.633 1.00 . A A . 2 ARG C 1 1 4 1059 1 1 2 ARG CA C -2.152 5.370 2.054 1.00 . A A . 2 ARG CA 1 1 4 1060 1 1 2 ARG CB C -1.831 6.424 3.136 1.00 . A A . 2 ARG CB 1 1 4 1061 1 1 2 ARG CD C -1.581 8.884 3.612 1.00 . A A . 2 ARG CD 1 1 4 1062 1 1 2 ARG CG C -1.928 7.844 2.532 1.00 . A A . 2 ARG CG 1 1 4 1063 1 1 2 ARG CZ C 0.330 9.283 5.095 1.00 . A A . 2 ARG CZ 1 1 4 1064 1 1 2 ARG H H -4.253 5.811 2.209 1.00 . A A . 2 ARG H 1 1 4 1065 1 1 2 ARG HA H -1.458 5.483 1.233 1.00 . A A . 2 ARG HA 1 1 4 1066 1 1 2 ARG HB2 H -2.528 6.330 3.956 1.00 . A A . 2 ARG HB2 1 1 4 1067 1 1 2 ARG HB3 H -0.833 6.251 3.511 1.00 . A A . 2 ARG HB3 1 1 4 1068 1 1 2 ARG HD2 H -1.632 9.882 3.199 1.00 . A A . 2 ARG HD2 1 1 4 1069 1 1 2 ARG HD3 H -2.265 8.808 4.445 1.00 . A A . 2 ARG HD3 1 1 4 1070 1 1 2 ARG HE H 0.354 7.941 3.638 1.00 . A A . 2 ARG HE 1 1 4 1071 1 1 2 ARG HG2 H -1.242 7.941 1.702 1.00 . A A . 2 ARG HG2 1 1 4 1072 1 1 2 ARG HG3 H -2.930 8.025 2.174 1.00 . A A . 2 ARG HG3 1 1 4 1073 1 1 2 ARG HH11 H -1.298 10.405 5.427 1.00 . A A . 2 ARG HH11 1 1 4 1074 1 1 2 ARG HH12 H 0.040 10.695 6.484 1.00 . A A . 2 ARG HH12 1 1 4 1075 1 1 2 ARG HH21 H 2.059 8.285 4.961 1.00 . A A . 2 ARG HH21 1 1 4 1076 1 1 2 ARG HH22 H 1.976 9.476 6.216 1.00 . A A . 2 ARG HH22 1 1 4 1077 1 1 2 ARG N N -3.548 5.581 1.568 1.00 . A A . 2 ARG N 1 1 4 1078 1 1 2 ARG NE N -0.187 8.623 4.088 1.00 . A A . 2 ARG NE 1 1 4 1079 1 1 2 ARG NH1 N -0.364 10.198 5.716 1.00 . A A . 2 ARG NH1 1 1 4 1080 1 1 2 ARG NH2 N 1.550 8.992 5.452 1.00 . A A . 2 ARG NH2 1 1 4 1081 1 1 2 ARG O O -2.189 3.734 3.813 1.00 . A A . 2 ARG O 1 1 4 1082 1 1 3 LEU C C -0.036 1.460 2.619 1.00 . A A . 3 LEU C 1 1 4 1083 1 1 3 LEU CA C -1.497 1.620 2.195 1.00 . A A . 3 LEU CA 1 1 4 1084 1 1 3 LEU CB C -1.815 0.645 1.018 1.00 . A A . 3 LEU CB 1 1 4 1085 1 1 3 LEU CD1 C -3.767 2.018 0.002 1.00 . A A . 3 LEU CD1 1 1 4 1086 1 1 3 LEU CD2 C -3.471 -0.414 -0.557 1.00 . A A . 3 LEU CD2 1 1 4 1087 1 1 3 LEU CG C -3.305 0.649 0.552 1.00 . A A . 3 LEU CG 1 1 4 1088 1 1 3 LEU H H -1.548 3.278 0.823 1.00 . A A . 3 LEU H 1 1 4 1089 1 1 3 LEU HA H -2.135 1.420 3.036 1.00 . A A . 3 LEU HA 1 1 4 1090 1 1 3 LEU HB2 H -1.191 0.892 0.172 1.00 . A A . 3 LEU HB2 1 1 4 1091 1 1 3 LEU HB3 H -1.567 -0.356 1.333 1.00 . A A . 3 LEU HB3 1 1 4 1092 1 1 3 LEU HD11 H -3.158 2.311 -0.841 1.00 . A A . 3 LEU HD11 1 1 4 1093 1 1 3 LEU HD12 H -3.707 2.780 0.761 1.00 . A A . 3 LEU HD12 1 1 4 1094 1 1 3 LEU HD13 H -4.796 1.951 -0.319 1.00 . A A . 3 LEU HD13 1 1 4 1095 1 1 3 LEU HD21 H -4.494 -0.438 -0.903 1.00 . A A . 3 LEU HD21 1 1 4 1096 1 1 3 LEU HD22 H -3.213 -1.392 -0.179 1.00 . A A . 3 LEU HD22 1 1 4 1097 1 1 3 LEU HD23 H -2.827 -0.186 -1.396 1.00 . A A . 3 LEU HD23 1 1 4 1098 1 1 3 LEU HG H -3.933 0.379 1.388 1.00 . A A . 3 LEU HG 1 1 4 1099 1 1 3 LEU N N -1.676 3.036 1.763 1.00 . A A . 3 LEU N 1 1 4 1100 1 1 3 LEU O O 0.268 1.254 3.776 1.00 . A A . 3 LEU O 1 1 4 1101 1 1 4 CYS C C 2.848 2.424 2.804 1.00 . A A . 4 CYS C 1 1 4 1102 1 1 4 CYS CA C 2.285 1.452 1.756 1.00 . A A . 4 CYS CA 1 1 4 1103 1 1 4 CYS CB C 2.933 1.781 0.408 1.00 . A A . 4 CYS CB 1 1 4 1104 1 1 4 CYS H H 0.439 1.711 0.739 1.00 . A A . 4 CYS H 1 1 4 1105 1 1 4 CYS HA H 2.543 0.449 2.048 1.00 . A A . 4 CYS HA 1 1 4 1106 1 1 4 CYS HB2 H 2.911 2.841 0.226 1.00 . A A . 4 CYS HB2 1 1 4 1107 1 1 4 CYS HB3 H 3.976 1.520 0.497 1.00 . A A . 4 CYS HB3 1 1 4 1108 1 1 4 CYS N N 0.805 1.563 1.627 1.00 . A A . 4 CYS N 1 1 4 1109 1 1 4 CYS O O 3.470 2.022 3.768 1.00 . A A . 4 CYS O 1 1 4 1110 1 1 4 CYS SG S 2.344 1.006 -1.115 1.00 . A A . 4 CYS SG 1 1 4 1111 1 1 5 CYS C C 2.296 4.788 4.790 1.00 . A A . 5 CYS C 1 1 4 1112 1 1 5 CYS CA C 3.071 4.763 3.470 1.00 . A A . 5 CYS CA 1 1 4 1113 1 1 5 CYS CB C 2.924 6.119 2.761 1.00 . A A . 5 CYS CB 1 1 4 1114 1 1 5 CYS H H 2.055 3.912 1.769 1.00 . A A . 5 CYS H 1 1 4 1115 1 1 5 CYS HA H 4.116 4.588 3.685 1.00 . A A . 5 CYS HA 1 1 4 1116 1 1 5 CYS HB2 H 3.235 6.011 1.733 1.00 . A A . 5 CYS HB2 1 1 4 1117 1 1 5 CYS HB3 H 1.884 6.410 2.759 1.00 . A A . 5 CYS HB3 1 1 4 1118 1 1 5 CYS N N 2.585 3.684 2.561 1.00 . A A . 5 CYS N 1 1 4 1119 1 1 5 CYS O O 2.875 5.007 5.836 1.00 . A A . 5 CYS O 1 1 4 1120 1 1 5 CYS SG S 3.878 7.470 3.497 1.00 . A A . 5 CYS SG 1 1 4 1121 1 1 6 GLY C C 0.567 3.444 6.883 1.00 . A A . 6 GLY C 1 1 4 1122 1 1 6 GLY CA C 0.152 4.566 5.926 1.00 . A A . 6 GLY CA 1 1 4 1123 1 1 6 GLY H H 0.603 4.394 3.823 1.00 . A A . 6 GLY H 1 1 4 1124 1 1 6 GLY HA2 H 0.252 5.518 6.426 1.00 . A A . 6 GLY HA2 1 1 4 1125 1 1 6 GLY HA3 H -0.879 4.424 5.644 1.00 . A A . 6 GLY HA3 1 1 4 1126 1 1 6 GLY N N 1.008 4.564 4.699 1.00 . A A . 6 GLY N 1 1 4 1127 1 1 6 GLY O O 0.524 3.618 8.086 1.00 . A A . 6 GLY O 1 1 4 1128 1 1 7 PHE C C 2.246 0.127 6.367 1.00 . A A . 7 PHE C 1 1 4 1129 1 1 7 PHE CA C 1.385 1.159 7.143 1.00 . A A . 7 PHE CA 1 1 4 1130 1 1 7 PHE CB C 0.112 0.483 7.724 1.00 . A A . 7 PHE CB 1 1 4 1131 1 1 7 PHE CD1 C -0.711 -1.115 5.948 1.00 . A A . 7 PHE CD1 1 1 4 1132 1 1 7 PHE CD2 C -1.931 0.901 6.280 1.00 . A A . 7 PHE CD2 1 1 4 1133 1 1 7 PHE CE1 C -1.592 -1.490 4.955 1.00 . A A . 7 PHE CE1 1 1 4 1134 1 1 7 PHE CE2 C -2.814 0.530 5.289 1.00 . A A . 7 PHE CE2 1 1 4 1135 1 1 7 PHE CG C -0.872 0.079 6.616 1.00 . A A . 7 PHE CG 1 1 4 1136 1 1 7 PHE CZ C -2.645 -0.667 4.626 1.00 . A A . 7 PHE CZ 1 1 4 1137 1 1 7 PHE H H 0.965 2.262 5.340 1.00 . A A . 7 PHE H 1 1 4 1138 1 1 7 PHE HA H 1.968 1.549 7.963 1.00 . A A . 7 PHE HA 1 1 4 1139 1 1 7 PHE HB2 H 0.388 -0.403 8.279 1.00 . A A . 7 PHE HB2 1 1 4 1140 1 1 7 PHE HB3 H -0.388 1.160 8.402 1.00 . A A . 7 PHE HB3 1 1 4 1141 1 1 7 PHE HD1 H 0.116 -1.754 6.209 1.00 . A A . 7 PHE HD1 1 1 4 1142 1 1 7 PHE HD2 H -2.069 1.841 6.795 1.00 . A A . 7 PHE HD2 1 1 4 1143 1 1 7 PHE HE1 H -1.458 -2.429 4.440 1.00 . A A . 7 PHE HE1 1 1 4 1144 1 1 7 PHE HE2 H -3.640 1.177 5.033 1.00 . A A . 7 PHE HE2 1 1 4 1145 1 1 7 PHE HZ H -3.337 -0.959 3.849 1.00 . A A . 7 PHE HZ 1 1 4 1146 1 1 7 PHE N N 0.955 2.327 6.317 1.00 . A A . 7 PHE N 1 1 4 1147 1 1 7 PHE O O 1.979 -0.204 5.223 1.00 . A A . 7 PHE O 1 1 4 1148 1 1 8 HYP C C 3.945 -2.443 5.788 1.00 . A A . 8 HYP C 1 1 4 1149 1 1 8 HYP CA C 4.371 -1.095 6.387 1.00 . A A . 8 HYP CA 1 1 4 1150 1 1 8 HYP CB C 5.428 -1.238 7.478 1.00 . A A . 8 HYP CB 1 1 4 1151 1 1 8 HYP CD C 3.499 -0.286 8.496 1.00 . A A . 8 HYP CD 1 1 4 1152 1 1 8 HYP CG C 4.624 -1.259 8.730 1.00 . A A . 8 HYP CG 1 1 4 1153 1 1 8 HYP HA H 4.795 -0.491 5.600 1.00 . A A . 8 HYP HA 1 1 4 1154 1 1 8 HYP HB2 H 6.113 -0.403 7.444 1.00 . A A . 8 HYP HB2 1 1 4 1155 1 1 8 HYP HB3 H 6.001 -2.144 7.346 1.00 . A A . 8 HYP HB3 1 1 4 1156 1 1 8 HYP HD1 H 5.764 0.020 9.649 1.00 . A A . 8 HYP HD1 1 1 4 1157 1 1 8 HYP HD22 H 3.798 0.711 8.787 1.00 . A A . 8 HYP HD22 1 1 4 1158 1 1 8 HYP HD23 H 2.621 -0.593 9.045 1.00 . A A . 8 HYP HD23 1 1 4 1159 1 1 8 HYP HG H 4.231 -2.251 8.898 1.00 . A A . 8 HYP HG 1 1 4 1160 1 1 8 HYP N N 3.269 -0.363 7.036 1.00 . A A . 8 HYP N 1 1 4 1161 1 1 8 HYP O O 4.739 -3.075 5.116 1.00 . A A . 8 HYP O 1 1 4 1162 1 1 8 HYP OD1 O 5.419 -0.856 9.835 1.00 . A A . 8 HYP OD1 1 1 4 1163 1 1 9 LYS C C 2.213 -4.071 3.974 1.00 . A A . 9 LYS C 1 1 4 1164 1 1 9 LYS CA C 2.230 -4.133 5.502 1.00 . A A . 9 LYS CA 1 1 4 1165 1 1 9 LYS CB C 0.800 -4.421 6.035 1.00 . A A . 9 LYS CB 1 1 4 1166 1 1 9 LYS CD C 1.158 -6.958 6.014 1.00 . A A . 9 LYS CD 1 1 4 1167 1 1 9 LYS CE C 0.588 -8.293 5.504 1.00 . A A . 9 LYS CE 1 1 4 1168 1 1 9 LYS CG C 0.262 -5.790 5.531 1.00 . A A . 9 LYS CG 1 1 4 1169 1 1 9 LYS H H 2.129 -2.275 6.592 1.00 . A A . 9 LYS H 1 1 4 1170 1 1 9 LYS HA H 2.915 -4.906 5.816 1.00 . A A . 9 LYS HA 1 1 4 1171 1 1 9 LYS HB2 H 0.799 -4.399 7.114 1.00 . A A . 9 LYS HB2 1 1 4 1172 1 1 9 LYS HB3 H 0.125 -3.664 5.674 1.00 . A A . 9 LYS HB3 1 1 4 1173 1 1 9 LYS HD2 H 2.162 -6.848 5.632 1.00 . A A . 9 LYS HD2 1 1 4 1174 1 1 9 LYS HD3 H 1.197 -6.969 7.094 1.00 . A A . 9 LYS HD3 1 1 4 1175 1 1 9 LYS HE2 H 1.209 -9.112 5.838 1.00 . A A . 9 LYS HE2 1 1 4 1176 1 1 9 LYS HE3 H -0.417 -8.442 5.873 1.00 . A A . 9 LYS HE3 1 1 4 1177 1 1 9 LYS HG2 H -0.739 -5.930 5.912 1.00 . A A . 9 LYS HG2 1 1 4 1178 1 1 9 LYS HG3 H 0.212 -5.785 4.452 1.00 . A A . 9 LYS HG3 1 1 4 1179 1 1 9 LYS HZ1 H -0.308 -7.826 3.684 1.00 . A A . 9 LYS HZ1 1 1 4 1180 1 1 9 LYS HZ2 H 0.560 -9.285 3.672 1.00 . A A . 9 LYS HZ2 1 1 4 1181 1 1 9 LYS HZ3 H 1.389 -7.803 3.645 1.00 . A A . 9 LYS HZ3 1 1 4 1182 1 1 9 LYS N N 2.720 -2.833 6.047 1.00 . A A . 9 LYS N 1 1 4 1183 1 1 9 LYS NZ N 0.555 -8.303 4.013 1.00 . A A . 9 LYS NZ 1 1 4 1184 1 1 9 LYS O O 2.515 -5.066 3.342 1.00 . A A . 9 LYS O 1 1 4 1185 1 1 10 SER C C 3.252 -2.499 1.419 1.00 . A A . 10 SER C 1 1 4 1186 1 1 10 SER CA C 1.851 -2.860 1.922 1.00 . A A . 10 SER CA 1 1 4 1187 1 1 10 SER CB C 0.822 -1.808 1.510 1.00 . A A . 10 SER CB 1 1 4 1188 1 1 10 SER H H 1.631 -2.123 3.928 1.00 . A A . 10 SER H 1 1 4 1189 1 1 10 SER HA H 1.568 -3.821 1.513 1.00 . A A . 10 SER HA 1 1 4 1190 1 1 10 SER HB2 H 1.013 -0.865 1.988 1.00 . A A . 10 SER HB2 1 1 4 1191 1 1 10 SER HB3 H 0.759 -1.689 0.438 1.00 . A A . 10 SER HB3 1 1 4 1192 1 1 10 SER HG H -0.303 -2.451 2.956 1.00 . A A . 10 SER HG 1 1 4 1193 1 1 10 SER N N 1.871 -2.931 3.413 1.00 . A A . 10 SER N 1 1 4 1194 1 1 10 SER O O 3.665 -2.970 0.381 1.00 . A A . 10 SER O 1 1 4 1195 1 1 10 SER OG O -0.400 -2.330 2.009 1.00 . A A . 10 SER OG 1 1 4 1196 1 1 11 CYS C C 6.322 -2.288 1.457 1.00 . A A . 11 CYS C 1 1 4 1197 1 1 11 CYS CA C 5.322 -1.192 1.886 1.00 . A A . 11 CYS CA 1 1 4 1198 1 1 11 CYS CB C 5.804 -0.492 3.148 1.00 . A A . 11 CYS CB 1 1 4 1199 1 1 11 CYS H H 3.498 -1.365 3.008 1.00 . A A . 11 CYS H 1 1 4 1200 1 1 11 CYS HA H 5.258 -0.459 1.099 1.00 . A A . 11 CYS HA 1 1 4 1201 1 1 11 CYS HB2 H 5.067 0.252 3.406 1.00 . A A . 11 CYS HB2 1 1 4 1202 1 1 11 CYS HB3 H 5.784 -1.238 3.925 1.00 . A A . 11 CYS HB3 1 1 4 1203 1 1 11 CYS N N 3.929 -1.680 2.185 1.00 . A A . 11 CYS N 1 1 4 1204 1 1 11 CYS O O 7.335 -1.996 0.850 1.00 . A A . 11 CYS O 1 1 4 1205 1 1 11 CYS SG S 7.422 0.305 3.296 1.00 . A A . 11 CYS SG 1 1 4 1206 1 1 12 ARG C C 6.705 -5.163 -0.015 1.00 . A A . 12 ARG C 1 1 4 1207 1 1 12 ARG CA C 6.858 -4.690 1.452 1.00 . A A . 12 ARG CA 1 1 4 1208 1 1 12 ARG CB C 6.465 -5.800 2.456 1.00 . A A . 12 ARG CB 1 1 4 1209 1 1 12 ARG CD C 6.857 -8.127 3.335 1.00 . A A . 12 ARG CD 1 1 4 1210 1 1 12 ARG CG C 7.319 -7.083 2.300 1.00 . A A . 12 ARG CG 1 1 4 1211 1 1 12 ARG CZ C 6.369 -7.988 5.741 1.00 . A A . 12 ARG CZ 1 1 4 1212 1 1 12 ARG H H 5.157 -3.661 2.271 1.00 . A A . 12 ARG H 1 1 4 1213 1 1 12 ARG HA H 7.890 -4.417 1.616 1.00 . A A . 12 ARG HA 1 1 4 1214 1 1 12 ARG HB2 H 6.582 -5.411 3.458 1.00 . A A . 12 ARG HB2 1 1 4 1215 1 1 12 ARG HB3 H 5.423 -6.047 2.314 1.00 . A A . 12 ARG HB3 1 1 4 1216 1 1 12 ARG HD2 H 5.813 -8.359 3.181 1.00 . A A . 12 ARG HD2 1 1 4 1217 1 1 12 ARG HD3 H 7.441 -9.031 3.247 1.00 . A A . 12 ARG HD3 1 1 4 1218 1 1 12 ARG HE H 7.701 -6.836 4.835 1.00 . A A . 12 ARG HE 1 1 4 1219 1 1 12 ARG HG2 H 7.196 -7.505 1.315 1.00 . A A . 12 ARG HG2 1 1 4 1220 1 1 12 ARG HG3 H 8.364 -6.851 2.453 1.00 . A A . 12 ARG HG3 1 1 4 1221 1 1 12 ARG HH11 H 5.324 -9.367 4.724 1.00 . A A . 12 ARG HH11 1 1 4 1222 1 1 12 ARG HH12 H 4.981 -9.260 6.417 1.00 . A A . 12 ARG HH12 1 1 4 1223 1 1 12 ARG HH21 H 7.276 -6.697 6.971 1.00 . A A . 12 ARG HH21 1 1 4 1224 1 1 12 ARG HH22 H 6.099 -7.733 7.707 1.00 . A A . 12 ARG HH22 1 1 4 1225 1 1 12 ARG N N 5.995 -3.511 1.787 1.00 . A A . 12 ARG N 1 1 4 1226 1 1 12 ARG NE N 7.049 -7.556 4.707 1.00 . A A . 12 ARG NE 1 1 4 1227 1 1 12 ARG NH1 N 5.490 -8.947 5.616 1.00 . A A . 12 ARG NH1 1 1 4 1228 1 1 12 ARG NH2 N 6.598 -7.429 6.897 1.00 . A A . 12 ARG NH2 1 1 4 1229 1 1 12 ARG O O 7.473 -5.988 -0.473 1.00 . A A . 12 ARG O 1 1 4 1230 1 1 13 SER C C 6.297 -4.169 -3.125 1.00 . A A . 13 SER C 1 1 4 1231 1 1 13 SER CA C 5.494 -5.021 -2.139 1.00 . A A . 13 SER CA 1 1 4 1232 1 1 13 SER CB C 3.993 -4.878 -2.457 1.00 . A A . 13 SER CB 1 1 4 1233 1 1 13 SER H H 5.158 -3.959 -0.300 1.00 . A A . 13 SER H 1 1 4 1234 1 1 13 SER HA H 5.776 -6.057 -2.269 1.00 . A A . 13 SER HA 1 1 4 1235 1 1 13 SER HB2 H 3.773 -5.157 -3.478 1.00 . A A . 13 SER HB2 1 1 4 1236 1 1 13 SER HB3 H 3.389 -5.461 -1.778 1.00 . A A . 13 SER HB3 1 1 4 1237 1 1 13 SER HG H 2.954 -3.425 -1.685 1.00 . A A . 13 SER HG 1 1 4 1238 1 1 13 SER N N 5.734 -4.629 -0.712 1.00 . A A . 13 SER N 1 1 4 1239 1 1 13 SER O O 6.647 -3.041 -2.837 1.00 . A A . 13 SER O 1 1 4 1240 1 1 13 SER OG O 3.708 -3.498 -2.275 1.00 . A A . 13 SER OG 1 1 4 1241 1 1 14 ARG C C 6.546 -2.801 -5.755 1.00 . A A . 14 ARG C 1 1 4 1242 1 1 14 ARG CA C 7.326 -4.057 -5.341 1.00 . A A . 14 ARG CA 1 1 4 1243 1 1 14 ARG CB C 7.493 -5.012 -6.541 1.00 . A A . 14 ARG CB 1 1 4 1244 1 1 14 ARG CD C 8.496 -5.266 -8.857 1.00 . A A . 14 ARG CD 1 1 4 1245 1 1 14 ARG CG C 8.321 -4.321 -7.656 1.00 . A A . 14 ARG CG 1 1 4 1246 1 1 14 ARG CZ C 6.995 -6.173 -10.572 1.00 . A A . 14 ARG CZ 1 1 4 1247 1 1 14 ARG H H 6.236 -5.672 -4.422 1.00 . A A . 14 ARG H 1 1 4 1248 1 1 14 ARG HA H 8.287 -3.771 -4.948 1.00 . A A . 14 ARG HA 1 1 4 1249 1 1 14 ARG HB2 H 8.002 -5.909 -6.217 1.00 . A A . 14 ARG HB2 1 1 4 1250 1 1 14 ARG HB3 H 6.518 -5.289 -6.916 1.00 . A A . 14 ARG HB3 1 1 4 1251 1 1 14 ARG HD2 H 9.078 -4.778 -9.624 1.00 . A A . 14 ARG HD2 1 1 4 1252 1 1 14 ARG HD3 H 8.992 -6.179 -8.558 1.00 . A A . 14 ARG HD3 1 1 4 1253 1 1 14 ARG HE H 6.345 -5.386 -8.875 1.00 . A A . 14 ARG HE 1 1 4 1254 1 1 14 ARG HG2 H 7.821 -3.424 -7.991 1.00 . A A . 14 ARG HG2 1 1 4 1255 1 1 14 ARG HG3 H 9.295 -4.049 -7.273 1.00 . A A . 14 ARG HG3 1 1 4 1256 1 1 14 ARG HH11 H 8.957 -6.271 -10.979 1.00 . A A . 14 ARG HH11 1 1 4 1257 1 1 14 ARG HH12 H 7.903 -6.910 -12.195 1.00 . A A . 14 ARG HH12 1 1 4 1258 1 1 14 ARG HH21 H 5.001 -6.192 -10.399 1.00 . A A . 14 ARG HH21 1 1 4 1259 1 1 14 ARG HH22 H 5.633 -6.866 -11.864 1.00 . A A . 14 ARG HH22 1 1 4 1260 1 1 14 ARG N N 6.555 -4.759 -4.268 1.00 . A A . 14 ARG N 1 1 4 1261 1 1 14 ARG NE N 7.142 -5.600 -9.403 1.00 . A A . 14 ARG NE 1 1 4 1262 1 1 14 ARG NH1 N 8.033 -6.474 -11.305 1.00 . A A . 14 ARG NH1 1 1 4 1263 1 1 14 ARG NH2 N 5.781 -6.430 -10.976 1.00 . A A . 14 ARG NH2 1 1 4 1264 1 1 14 ARG O O 7.127 -1.797 -6.114 1.00 . A A . 14 ARG O 1 1 4 1265 1 1 15 GLN C C 4.631 -0.599 -5.131 1.00 . A A . 15 GLN C 1 1 4 1266 1 1 15 GLN CA C 4.323 -1.797 -6.041 1.00 . A A . 15 GLN CA 1 1 4 1267 1 1 15 GLN CB C 2.869 -2.314 -5.852 1.00 . A A . 15 GLN CB 1 1 4 1268 1 1 15 GLN CD C 1.805 -0.026 -5.331 1.00 . A A . 15 GLN CD 1 1 4 1269 1 1 15 GLN CG C 1.781 -1.268 -6.237 1.00 . A A . 15 GLN CG 1 1 4 1270 1 1 15 GLN H H 4.860 -3.768 -5.379 1.00 . A A . 15 GLN H 1 1 4 1271 1 1 15 GLN HA H 4.496 -1.519 -7.070 1.00 . A A . 15 GLN HA 1 1 4 1272 1 1 15 GLN HB2 H 2.733 -3.191 -6.466 1.00 . A A . 15 GLN HB2 1 1 4 1273 1 1 15 GLN HB3 H 2.729 -2.608 -4.822 1.00 . A A . 15 GLN HB3 1 1 4 1274 1 1 15 GLN HE21 H 1.867 -1.077 -3.646 1.00 . A A . 15 GLN HE21 1 1 4 1275 1 1 15 GLN HE22 H 1.864 0.609 -3.452 1.00 . A A . 15 GLN HE22 1 1 4 1276 1 1 15 GLN HG2 H 1.934 -0.952 -7.260 1.00 . A A . 15 GLN HG2 1 1 4 1277 1 1 15 GLN HG3 H 0.805 -1.723 -6.164 1.00 . A A . 15 GLN HG3 1 1 4 1278 1 1 15 GLN N N 5.243 -2.919 -5.681 1.00 . A A . 15 GLN N 1 1 4 1279 1 1 15 GLN NE2 N 1.848 -0.178 -4.036 1.00 . A A . 15 GLN NE2 1 1 4 1280 1 1 15 GLN O O 4.617 0.533 -5.575 1.00 . A A . 15 GLN O 1 1 4 1281 1 1 15 GLN OE1 O 1.784 1.096 -5.797 1.00 . A A . 15 GLN OE1 1 1 4 1282 1 1 16 CYS C C 6.664 0.669 -2.926 1.00 . A A . 16 CYS C 1 1 4 1283 1 1 16 CYS CA C 5.217 0.162 -2.890 1.00 . A A . 16 CYS CA 1 1 4 1284 1 1 16 CYS CB C 4.933 -0.354 -1.500 1.00 . A A . 16 CYS CB 1 1 4 1285 1 1 16 CYS H H 4.890 -1.839 -3.605 1.00 . A A . 16 CYS H 1 1 4 1286 1 1 16 CYS HA H 4.557 0.995 -3.066 1.00 . A A . 16 CYS HA 1 1 4 1287 1 1 16 CYS HB2 H 5.547 -1.211 -1.295 1.00 . A A . 16 CYS HB2 1 1 4 1288 1 1 16 CYS HB3 H 5.235 0.418 -0.809 1.00 . A A . 16 CYS HB3 1 1 4 1289 1 1 16 CYS N N 4.900 -0.901 -3.885 1.00 . A A . 16 CYS N 1 1 4 1290 1 1 16 CYS O O 6.910 1.777 -2.493 1.00 . A A . 16 CYS O 1 1 4 1291 1 1 16 CYS SG S 3.234 -0.799 -1.085 1.00 . A A . 16 CYS SG 1 1 4 1292 1 1 17 LYS C C 9.211 1.725 -4.140 1.00 . A A . 17 LYS C 1 1 4 1293 1 1 17 LYS CA C 9.007 0.332 -3.480 1.00 . A A . 17 LYS CA 1 1 4 1294 1 1 17 LYS CB C 9.870 -0.701 -4.249 1.00 . A A . 17 LYS CB 1 1 4 1295 1 1 17 LYS CD C 10.737 -3.147 -4.182 1.00 . A A . 17 LYS CD 1 1 4 1296 1 1 17 LYS CE C 12.247 -2.814 -4.302 1.00 . A A . 17 LYS CE 1 1 4 1297 1 1 17 LYS CG C 9.899 -2.037 -3.473 1.00 . A A . 17 LYS CG 1 1 4 1298 1 1 17 LYS H H 7.327 -1.020 -3.749 1.00 . A A . 17 LYS H 1 1 4 1299 1 1 17 LYS HA H 9.370 0.382 -2.466 1.00 . A A . 17 LYS HA 1 1 4 1300 1 1 17 LYS HB2 H 9.480 -0.863 -5.243 1.00 . A A . 17 LYS HB2 1 1 4 1301 1 1 17 LYS HB3 H 10.863 -0.292 -4.326 1.00 . A A . 17 LYS HB3 1 1 4 1302 1 1 17 LYS HD2 H 10.625 -4.072 -3.637 1.00 . A A . 17 LYS HD2 1 1 4 1303 1 1 17 LYS HD3 H 10.349 -3.298 -5.180 1.00 . A A . 17 LYS HD3 1 1 4 1304 1 1 17 LYS HE2 H 12.650 -2.586 -3.325 1.00 . A A . 17 LYS HE2 1 1 4 1305 1 1 17 LYS HE3 H 12.776 -3.666 -4.702 1.00 . A A . 17 LYS HE3 1 1 4 1306 1 1 17 LYS HG2 H 10.315 -1.865 -2.491 1.00 . A A . 17 LYS HG2 1 1 4 1307 1 1 17 LYS HG3 H 8.891 -2.394 -3.345 1.00 . A A . 17 LYS HG3 1 1 4 1308 1 1 17 LYS HZ1 H 13.310 -1.844 -5.805 1.00 . A A . 17 LYS HZ1 1 1 4 1309 1 1 17 LYS HZ2 H 12.683 -0.803 -4.619 1.00 . A A . 17 LYS HZ2 1 1 4 1310 1 1 17 LYS HZ3 H 11.652 -1.481 -5.787 1.00 . A A . 17 LYS HZ3 1 1 4 1311 1 1 17 LYS N N 7.579 -0.128 -3.423 1.00 . A A . 17 LYS N 1 1 4 1312 1 1 17 LYS NZ N 12.491 -1.647 -5.196 1.00 . A A . 17 LYS NZ 1 1 4 1313 1 1 17 LYS O O 9.930 2.532 -3.582 1.00 . A A . 17 LYS O 1 1 4 1314 1 1 18 HYP C C 8.165 4.495 -5.166 1.00 . A A . 18 HYP C 1 1 4 1315 1 1 18 HYP CA C 8.738 3.299 -5.958 1.00 . A A . 18 HYP CA 1 1 4 1316 1 1 18 HYP CB C 8.051 3.103 -7.312 1.00 . A A . 18 HYP CB 1 1 4 1317 1 1 18 HYP CD C 7.721 1.104 -6.068 1.00 . A A . 18 HYP CD 1 1 4 1318 1 1 18 HYP CG C 7.065 2.024 -7.055 1.00 . A A . 18 HYP CG 1 1 4 1319 1 1 18 HYP HA H 9.781 3.507 -6.154 1.00 . A A . 18 HYP HA 1 1 4 1320 1 1 18 HYP HB2 H 8.779 2.822 -8.059 1.00 . A A . 18 HYP HB2 1 1 4 1321 1 1 18 HYP HB3 H 7.574 4.015 -7.641 1.00 . A A . 18 HYP HB3 1 1 4 1322 1 1 18 HYP HD1 H 6.272 0.529 -8.008 1.00 . A A . 18 HYP HD1 1 1 4 1323 1 1 18 HYP HD22 H 8.294 0.345 -6.578 1.00 . A A . 18 HYP HD22 1 1 4 1324 1 1 18 HYP HD23 H 6.961 0.653 -5.460 1.00 . A A . 18 HYP HD23 1 1 4 1325 1 1 18 HYP HG H 6.165 2.448 -6.635 1.00 . A A . 18 HYP HG 1 1 4 1326 1 1 18 HYP N N 8.601 1.991 -5.279 1.00 . A A . 18 HYP N 1 1 4 1327 1 1 18 HYP O O 8.292 5.617 -5.620 1.00 . A A . 18 HYP O 1 1 4 1328 1 1 18 HYP OD1 O 6.753 1.324 -8.250 1.00 . A A . 18 HYP OD1 1 1 4 1329 1 1 19 HIS C C 8.122 5.981 -2.406 1.00 . A A . 19 HIS C 1 1 4 1330 1 1 19 HIS CA C 6.986 5.339 -3.204 1.00 . A A . 19 HIS CA 1 1 4 1331 1 1 19 HIS CB C 5.930 4.781 -2.227 1.00 . A A . 19 HIS CB 1 1 4 1332 1 1 19 HIS CD2 C 4.725 3.283 -4.073 1.00 . A A . 19 HIS CD2 1 1 4 1333 1 1 19 HIS CE1 C 2.765 3.647 -3.515 1.00 . A A . 19 HIS CE1 1 1 4 1334 1 1 19 HIS CG C 4.756 4.141 -2.986 1.00 . A A . 19 HIS CG 1 1 4 1335 1 1 19 HIS H H 7.496 3.308 -3.706 1.00 . A A . 19 HIS H 1 1 4 1336 1 1 19 HIS HA H 6.543 6.079 -3.856 1.00 . A A . 19 HIS HA 1 1 4 1337 1 1 19 HIS HB2 H 6.370 4.037 -1.581 1.00 . A A . 19 HIS HB2 1 1 4 1338 1 1 19 HIS HB3 H 5.542 5.581 -1.613 1.00 . A A . 19 HIS HB3 1 1 4 1339 1 1 19 HIS HD1 H 3.176 4.883 -1.966 1.00 . A A . 19 HIS HD1 1 1 4 1340 1 1 19 HIS HD2 H 5.595 2.907 -4.586 1.00 . A A . 19 HIS HD2 1 1 4 1341 1 1 19 HIS HE1 H 1.686 3.632 -3.481 1.00 . A A . 19 HIS HE1 1 1 4 1342 1 1 19 HIS N N 7.566 4.230 -4.028 1.00 . A A . 19 HIS N 1 1 4 1343 1 1 19 HIS ND1 N 3.509 4.320 -2.696 1.00 . A A . 19 HIS ND1 1 1 4 1344 1 1 19 HIS NE2 N 3.481 2.986 -4.389 1.00 . A A . 19 HIS NE2 1 1 4 1345 1 1 19 HIS O O 9.037 5.293 -2.003 1.00 . A A . 19 HIS O 1 1 4 1346 1 1 20 ARG C C 9.104 7.548 0.055 1.00 . A A . 20 ARG C 1 1 4 1347 1 1 20 ARG CA C 9.109 7.980 -1.421 1.00 . A A . 20 ARG CA 1 1 4 1348 1 1 20 ARG CB C 8.878 9.502 -1.519 1.00 . A A . 20 ARG CB 1 1 4 1349 1 1 20 ARG CD C 8.775 11.471 -3.081 1.00 . A A . 20 ARG CD 1 1 4 1350 1 1 20 ARG CG C 8.979 9.950 -2.993 1.00 . A A . 20 ARG CG 1 1 4 1351 1 1 20 ARG CZ C 8.977 13.129 -4.875 1.00 . A A . 20 ARG CZ 1 1 4 1352 1 1 20 ARG H H 7.277 7.774 -2.548 1.00 . A A . 20 ARG H 1 1 4 1353 1 1 20 ARG HA H 10.070 7.729 -1.849 1.00 . A A . 20 ARG HA 1 1 4 1354 1 1 20 ARG HB2 H 7.900 9.747 -1.131 1.00 . A A . 20 ARG HB2 1 1 4 1355 1 1 20 ARG HB3 H 9.623 10.021 -0.931 1.00 . A A . 20 ARG HB3 1 1 4 1356 1 1 20 ARG HD2 H 7.794 11.747 -2.721 1.00 . A A . 20 ARG HD2 1 1 4 1357 1 1 20 ARG HD3 H 9.530 11.985 -2.503 1.00 . A A . 20 ARG HD3 1 1 4 1358 1 1 20 ARG HE H 8.919 11.176 -5.207 1.00 . A A . 20 ARG HE 1 1 4 1359 1 1 20 ARG HG2 H 9.951 9.691 -3.390 1.00 . A A . 20 ARG HG2 1 1 4 1360 1 1 20 ARG HG3 H 8.222 9.452 -3.583 1.00 . A A . 20 ARG HG3 1 1 4 1361 1 1 20 ARG HH11 H 8.867 13.857 -3.009 1.00 . A A . 20 ARG HH11 1 1 4 1362 1 1 20 ARG HH12 H 9.014 15.036 -4.267 1.00 . A A . 20 ARG HH12 1 1 4 1363 1 1 20 ARG HH21 H 9.103 12.653 -6.815 1.00 . A A . 20 ARG HH21 1 1 4 1364 1 1 20 ARG HH22 H 9.148 14.348 -6.453 1.00 . A A . 20 ARG HH22 1 1 4 1365 1 1 20 ARG N N 8.040 7.270 -2.197 1.00 . A A . 20 ARG N 1 1 4 1366 1 1 20 ARG NE N 8.897 11.871 -4.517 1.00 . A A . 20 ARG NE 1 1 4 1367 1 1 20 ARG NH1 N 8.951 14.081 -3.979 1.00 . A A . 20 ARG NH1 1 1 4 1368 1 1 20 ARG NH2 N 9.084 13.398 -6.147 1.00 . A A . 20 ARG NH2 1 1 4 1369 1 1 20 ARG O O 10.077 7.743 0.758 1.00 . A A . 20 ARG O 1 1 4 1370 1 1 21 CYS C C 8.514 5.118 2.046 1.00 . A A . 21 CYS C 1 1 4 1371 1 1 21 CYS CA C 7.855 6.499 1.885 1.00 . A A . 21 CYS CA 1 1 4 1372 1 1 21 CYS CB C 6.371 6.365 2.234 1.00 . A A . 21 CYS CB 1 1 4 1373 1 1 21 CYS H H 7.262 6.845 -0.157 1.00 . A A . 21 CYS H 1 1 4 1374 1 1 21 CYS HA H 8.341 7.199 2.549 1.00 . A A . 21 CYS HA 1 1 4 1375 1 1 21 CYS HB2 H 5.964 5.561 1.636 1.00 . A A . 21 CYS HB2 1 1 4 1376 1 1 21 CYS HB3 H 6.305 6.053 3.267 1.00 . A A . 21 CYS HB3 1 1 4 1377 1 1 21 CYS N N 8.004 6.971 0.471 1.00 . A A . 21 CYS N 1 1 4 1378 1 1 21 CYS O O 8.864 4.721 3.141 1.00 . A A . 21 CYS O 1 1 4 1379 1 1 21 CYS SG S 5.248 7.771 2.041 1.00 . A A . 21 CYS SG 1 1 4 1380 1 1 22 . C C 10.168 2.939 -0.321 1.00 . A A . 22 CY3 C 1 1 4 1381 1 1 22 . CA C 9.268 3.077 0.902 1.00 . A A . 22 CY3 CA 1 1 4 1382 1 1 22 . CB C 8.084 2.084 0.909 1.00 . A A . 22 CY3 CB 1 1 4 1383 1 1 22 . H H 8.359 4.830 0.086 1.00 . A A . 22 CY3 H 1 1 4 1384 1 1 22 . HA H 9.873 2.933 1.786 1.00 . A A . 22 CY3 HA 1 1 4 1385 1 1 22 . HB2 H 8.433 1.081 0.720 1.00 . A A . 22 CY3 HB2 1 1 4 1386 1 1 22 . HB3 H 7.400 2.350 0.116 1.00 . A A . 22 CY3 HB3 1 1 4 1387 1 1 22 . HN11 H 10.743 4.831 -0.199 1.00 . A A . 22 CY3 HN11 1 1 4 1388 1 1 22 . HN12 H 11.421 3.952 -1.476 1.00 . A A . 22 CY3 HN12 1 1 4 1389 1 1 22 . N N 8.656 4.438 0.934 1.00 . A A . 22 CY3 N 1 1 4 1390 1 1 22 . N1 N 10.835 3.993 -0.699 1.00 . A A . 22 CY3 N1 1 1 4 1391 1 1 22 . O O 10.277 1.898 -0.935 1.00 . A A . 22 CY3 O 1 1 4 1392 1 1 22 . SG S 7.164 2.129 2.468 1.00 . A A . 22 CY3 SG 1 1 5 1393 1 1 1 PCA C C -3.638 5.494 0.073 1.00 . A A . 1 PCA C 1 1 5 1394 1 1 1 PCA CA C -5.156 5.706 -0.012 1.00 . A A . 1 PCA CA 1 1 5 1395 1 1 1 PCA CB C -5.941 4.548 0.623 1.00 . A A . 1 PCA CB 1 1 5 1396 1 1 1 PCA CD C -6.705 4.841 -1.613 1.00 . A A . 1 PCA CD 1 1 5 1397 1 1 1 PCA CG C -7.143 4.297 -0.278 1.00 . A A . 1 PCA CG 1 1 5 1398 1 1 1 PCA HA H -5.413 6.629 0.488 1.00 . A A . 1 PCA HA 1 1 5 1399 1 1 1 PCA HB2 H -6.247 4.820 1.623 1.00 . A A . 1 PCA HB2 1 1 5 1400 1 1 1 PCA HB3 H -5.320 3.668 0.699 1.00 . A A . 1 PCA HB3 1 1 5 1401 1 1 1 PCA HG2 H -8.008 4.833 0.087 1.00 . A A . 1 PCA HG2 1 1 5 1402 1 1 1 PCA HG3 H -7.348 3.239 -0.344 1.00 . A A . 1 PCA HG3 1 1 5 1403 1 1 1 PCA N N -5.618 5.795 -1.413 1.00 . A A . 1 PCA N 1 1 5 1404 1 1 1 PCA O O -3.065 4.867 -0.797 1.00 . A A . 1 PCA O 1 1 5 1405 1 1 1 PCA OE O -7.190 4.528 -2.683 1.00 . A A . 1 PCA OE 1 1 5 1406 1 1 2 ARG C C -1.339 4.629 2.174 1.00 . A A . 2 ARG C 1 1 5 1407 1 1 2 ARG CA C -1.581 5.898 1.333 1.00 . A A . 2 ARG CA 1 1 5 1408 1 1 2 ARG CB C -1.078 7.172 2.073 1.00 . A A . 2 ARG CB 1 1 5 1409 1 1 2 ARG CD C -0.788 8.487 -0.124 1.00 . A A . 2 ARG CD 1 1 5 1410 1 1 2 ARG CG C -1.434 8.463 1.283 1.00 . A A . 2 ARG CG 1 1 5 1411 1 1 2 ARG CZ C 1.399 9.549 0.244 1.00 . A A . 2 ARG CZ 1 1 5 1412 1 1 2 ARG H H -3.596 6.517 1.773 1.00 . A A . 2 ARG H 1 1 5 1413 1 1 2 ARG HA H -1.080 5.786 0.382 1.00 . A A . 2 ARG HA 1 1 5 1414 1 1 2 ARG HB2 H -1.536 7.229 3.051 1.00 . A A . 2 ARG HB2 1 1 5 1415 1 1 2 ARG HB3 H -0.007 7.118 2.205 1.00 . A A . 2 ARG HB3 1 1 5 1416 1 1 2 ARG HD2 H -1.100 7.632 -0.704 1.00 . A A . 2 ARG HD2 1 1 5 1417 1 1 2 ARG HD3 H -1.083 9.382 -0.652 1.00 . A A . 2 ARG HD3 1 1 5 1418 1 1 2 ARG HE H 1.178 7.607 -0.099 1.00 . A A . 2 ARG HE 1 1 5 1419 1 1 2 ARG HG2 H -2.506 8.538 1.182 1.00 . A A . 2 ARG HG2 1 1 5 1420 1 1 2 ARG HG3 H -1.092 9.321 1.841 1.00 . A A . 2 ARG HG3 1 1 5 1421 1 1 2 ARG HH11 H -0.190 10.771 0.323 1.00 . A A . 2 ARG HH11 1 1 5 1422 1 1 2 ARG HH12 H 1.350 11.522 0.567 1.00 . A A . 2 ARG HH12 1 1 5 1423 1 1 2 ARG HH21 H 3.134 8.554 0.209 1.00 . A A . 2 ARG HH21 1 1 5 1424 1 1 2 ARG HH22 H 3.253 10.252 0.512 1.00 . A A . 2 ARG HH22 1 1 5 1425 1 1 2 ARG N N -3.057 6.026 1.119 1.00 . A A . 2 ARG N 1 1 5 1426 1 1 2 ARG NE N 0.706 8.461 0.005 1.00 . A A . 2 ARG NE 1 1 5 1427 1 1 2 ARG NH1 N 0.805 10.703 0.388 1.00 . A A . 2 ARG NH1 1 1 5 1428 1 1 2 ARG NH2 N 2.697 9.444 0.328 1.00 . A A . 2 ARG NH2 1 1 5 1429 1 1 2 ARG O O -0.869 4.688 3.294 1.00 . A A . 2 ARG O 1 1 5 1430 1 1 3 LEU C C -0.040 1.905 2.648 1.00 . A A . 3 LEU C 1 1 5 1431 1 1 3 LEU CA C -1.509 2.186 2.273 1.00 . A A . 3 LEU CA 1 1 5 1432 1 1 3 LEU CB C -2.073 1.062 1.326 1.00 . A A . 3 LEU CB 1 1 5 1433 1 1 3 LEU CD1 C -2.061 -0.284 -0.814 1.00 . A A . 3 LEU CD1 1 1 5 1434 1 1 3 LEU CD2 C -1.354 2.113 -0.959 1.00 . A A . 3 LEU CD2 1 1 5 1435 1 1 3 LEU CG C -1.344 0.858 -0.056 1.00 . A A . 3 LEU CG 1 1 5 1436 1 1 3 LEU H H -2.062 3.538 0.688 1.00 . A A . 3 LEU H 1 1 5 1437 1 1 3 LEU HA H -2.092 2.211 3.181 1.00 . A A . 3 LEU HA 1 1 5 1438 1 1 3 LEU HB2 H -2.038 0.126 1.860 1.00 . A A . 3 LEU HB2 1 1 5 1439 1 1 3 LEU HB3 H -3.113 1.282 1.134 1.00 . A A . 3 LEU HB3 1 1 5 1440 1 1 3 LEU HD11 H -2.023 -1.197 -0.240 1.00 . A A . 3 LEU HD11 1 1 5 1441 1 1 3 LEU HD12 H -1.584 -0.458 -1.768 1.00 . A A . 3 LEU HD12 1 1 5 1442 1 1 3 LEU HD13 H -3.095 -0.025 -0.986 1.00 . A A . 3 LEU HD13 1 1 5 1443 1 1 3 LEU HD21 H -0.836 2.937 -0.494 1.00 . A A . 3 LEU HD21 1 1 5 1444 1 1 3 LEU HD22 H -2.369 2.412 -1.177 1.00 . A A . 3 LEU HD22 1 1 5 1445 1 1 3 LEU HD23 H -0.853 1.895 -1.892 1.00 . A A . 3 LEU HD23 1 1 5 1446 1 1 3 LEU HG H -0.324 0.555 0.110 1.00 . A A . 3 LEU HG 1 1 5 1447 1 1 3 LEU N N -1.681 3.507 1.590 1.00 . A A . 3 LEU N 1 1 5 1448 1 1 3 LEU O O 0.268 1.634 3.791 1.00 . A A . 3 LEU O 1 1 5 1449 1 1 4 CYS C C 2.884 2.611 2.918 1.00 . A A . 4 CYS C 1 1 5 1450 1 1 4 CYS CA C 2.279 1.751 1.791 1.00 . A A . 4 CYS CA 1 1 5 1451 1 1 4 CYS CB C 2.954 2.117 0.457 1.00 . A A . 4 CYS CB 1 1 5 1452 1 1 4 CYS H H 0.459 2.185 0.775 1.00 . A A . 4 CYS H 1 1 5 1453 1 1 4 CYS HA H 2.468 0.716 2.021 1.00 . A A . 4 CYS HA 1 1 5 1454 1 1 4 CYS HB2 H 3.002 3.184 0.326 1.00 . A A . 4 CYS HB2 1 1 5 1455 1 1 4 CYS HB3 H 3.977 1.783 0.537 1.00 . A A . 4 CYS HB3 1 1 5 1456 1 1 4 CYS N N 0.808 1.980 1.658 1.00 . A A . 4 CYS N 1 1 5 1457 1 1 4 CYS O O 3.412 2.101 3.888 1.00 . A A . 4 CYS O 1 1 5 1458 1 1 4 CYS SG S 2.319 1.461 -1.106 1.00 . A A . 4 CYS SG 1 1 5 1459 1 1 5 CYS C C 2.660 4.764 5.087 1.00 . A A . 5 CYS C 1 1 5 1460 1 1 5 CYS CA C 3.301 4.907 3.700 1.00 . A A . 5 CYS CA 1 1 5 1461 1 1 5 CYS CB C 3.015 6.316 3.166 1.00 . A A . 5 CYS CB 1 1 5 1462 1 1 5 CYS H H 2.319 4.215 1.916 1.00 . A A . 5 CYS H 1 1 5 1463 1 1 5 CYS HA H 4.368 4.760 3.797 1.00 . A A . 5 CYS HA 1 1 5 1464 1 1 5 CYS HB2 H 1.982 6.555 3.258 1.00 . A A . 5 CYS HB2 1 1 5 1465 1 1 5 CYS HB3 H 3.544 7.003 3.810 1.00 . A A . 5 CYS HB3 1 1 5 1466 1 1 5 CYS N N 2.771 3.901 2.727 1.00 . A A . 5 CYS N 1 1 5 1467 1 1 5 CYS O O 3.340 4.722 6.095 1.00 . A A . 5 CYS O 1 1 5 1468 1 1 5 CYS SG S 3.496 6.721 1.474 1.00 . A A . 5 CYS SG 1 1 5 1469 1 1 6 GLY C C 0.884 3.290 7.104 1.00 . A A . 6 GLY C 1 1 5 1470 1 1 6 GLY CA C 0.553 4.558 6.322 1.00 . A A . 6 GLY CA 1 1 5 1471 1 1 6 GLY H H 0.894 4.725 4.209 1.00 . A A . 6 GLY H 1 1 5 1472 1 1 6 GLY HA2 H 0.743 5.417 6.950 1.00 . A A . 6 GLY HA2 1 1 5 1473 1 1 6 GLY HA3 H -0.496 4.542 6.063 1.00 . A A . 6 GLY HA3 1 1 5 1474 1 1 6 GLY N N 1.354 4.692 5.071 1.00 . A A . 6 GLY N 1 1 5 1475 1 1 6 GLY O O 0.846 3.299 8.320 1.00 . A A . 6 GLY O 1 1 5 1476 1 1 7 PHE C C 2.329 -0.076 6.224 1.00 . A A . 7 PHE C 1 1 5 1477 1 1 7 PHE CA C 1.535 0.951 7.070 1.00 . A A . 7 PHE CA 1 1 5 1478 1 1 7 PHE CB C 0.202 0.326 7.576 1.00 . A A . 7 PHE CB 1 1 5 1479 1 1 7 PHE CD1 C -0.713 -0.810 5.508 1.00 . A A . 7 PHE CD1 1 1 5 1480 1 1 7 PHE CD2 C -1.903 1.060 6.373 1.00 . A A . 7 PHE CD2 1 1 5 1481 1 1 7 PHE CE1 C -1.645 -0.944 4.502 1.00 . A A . 7 PHE CE1 1 1 5 1482 1 1 7 PHE CE2 C -2.837 0.931 5.369 1.00 . A A . 7 PHE CE2 1 1 5 1483 1 1 7 PHE CG C -0.832 0.188 6.449 1.00 . A A . 7 PHE CG 1 1 5 1484 1 1 7 PHE CZ C -2.710 -0.072 4.433 1.00 . A A . 7 PHE CZ 1 1 5 1485 1 1 7 PHE H H 1.215 2.305 5.411 1.00 . A A . 7 PHE H 1 1 5 1486 1 1 7 PHE HA H 2.130 1.206 7.933 1.00 . A A . 7 PHE HA 1 1 5 1487 1 1 7 PHE HB2 H 0.388 -0.656 7.984 1.00 . A A . 7 PHE HB2 1 1 5 1488 1 1 7 PHE HB3 H -0.216 0.940 8.359 1.00 . A A . 7 PHE HB3 1 1 5 1489 1 1 7 PHE HD1 H 0.122 -1.486 5.565 1.00 . A A . 7 PHE HD1 1 1 5 1490 1 1 7 PHE HD2 H -2.010 1.849 7.103 1.00 . A A . 7 PHE HD2 1 1 5 1491 1 1 7 PHE HE1 H -1.542 -1.730 3.769 1.00 . A A . 7 PHE HE1 1 1 5 1492 1 1 7 PHE HE2 H -3.671 1.616 5.317 1.00 . A A . 7 PHE HE2 1 1 5 1493 1 1 7 PHE HZ H -3.444 -0.173 3.647 1.00 . A A . 7 PHE HZ 1 1 5 1494 1 1 7 PHE N N 1.198 2.238 6.389 1.00 . A A . 7 PHE N 1 1 5 1495 1 1 7 PHE O O 2.130 -0.227 5.029 1.00 . A A . 7 PHE O 1 1 5 1496 1 1 8 HYP C C 3.680 -2.815 5.524 1.00 . A A . 8 HYP C 1 1 5 1497 1 1 8 HYP CA C 4.255 -1.603 6.268 1.00 . A A . 8 HYP CA 1 1 5 1498 1 1 8 HYP CB C 5.191 -1.996 7.408 1.00 . A A . 8 HYP CB 1 1 5 1499 1 1 8 HYP CD C 3.348 -0.851 8.380 1.00 . A A . 8 HYP CD 1 1 5 1500 1 1 8 HYP CG C 4.300 -1.997 8.596 1.00 . A A . 8 HYP CG 1 1 5 1501 1 1 8 HYP HA H 4.821 -1.007 5.573 1.00 . A A . 8 HYP HA 1 1 5 1502 1 1 8 HYP HB2 H 5.991 -1.274 7.493 1.00 . A A . 8 HYP HB2 1 1 5 1503 1 1 8 HYP HB3 H 5.635 -2.966 7.232 1.00 . A A . 8 HYP HB3 1 1 5 1504 1 1 8 HYP HD1 H 5.626 -2.566 9.899 1.00 . A A . 8 HYP HD1 1 1 5 1505 1 1 8 HYP HD22 H 3.762 0.063 8.782 1.00 . A A . 8 HYP HD22 1 1 5 1506 1 1 8 HYP HD23 H 2.398 -1.073 8.844 1.00 . A A . 8 HYP HD23 1 1 5 1507 1 1 8 HYP HG H 3.755 -2.929 8.652 1.00 . A A . 8 HYP HG 1 1 5 1508 1 1 8 HYP N N 3.221 -0.770 6.906 1.00 . A A . 8 HYP N 1 1 5 1509 1 1 8 HYP O O 4.416 -3.504 4.843 1.00 . A A . 8 HYP O 1 1 5 1510 1 1 8 HYP OD1 O 5.057 -1.802 9.782 1.00 . A A . 8 HYP OD1 1 1 5 1511 1 1 9 LYS C C 1.861 -4.003 3.493 1.00 . A A . 9 LYS C 1 1 5 1512 1 1 9 LYS CA C 1.732 -4.177 5.005 1.00 . A A . 9 LYS CA 1 1 5 1513 1 1 9 LYS CB C 0.232 -4.227 5.405 1.00 . A A . 9 LYS CB 1 1 5 1514 1 1 9 LYS CD C -0.307 -6.839 5.402 1.00 . A A . 9 LYS CD 1 1 5 1515 1 1 9 LYS CE C 1.127 -7.370 5.232 1.00 . A A . 9 LYS CE 1 1 5 1516 1 1 9 LYS CG C -0.582 -5.421 4.803 1.00 . A A . 9 LYS CG 1 1 5 1517 1 1 9 LYS H H 1.864 -2.421 6.242 1.00 . A A . 9 LYS H 1 1 5 1518 1 1 9 LYS HA H 2.266 -5.062 5.294 1.00 . A A . 9 LYS HA 1 1 5 1519 1 1 9 LYS HB2 H 0.150 -4.247 6.482 1.00 . A A . 9 LYS HB2 1 1 5 1520 1 1 9 LYS HB3 H -0.250 -3.335 5.050 1.00 . A A . 9 LYS HB3 1 1 5 1521 1 1 9 LYS HD2 H -0.537 -6.813 6.458 1.00 . A A . 9 LYS HD2 1 1 5 1522 1 1 9 LYS HD3 H -0.986 -7.538 4.936 1.00 . A A . 9 LYS HD3 1 1 5 1523 1 1 9 LYS HE2 H 1.439 -7.346 4.198 1.00 . A A . 9 LYS HE2 1 1 5 1524 1 1 9 LYS HE3 H 1.813 -6.806 5.838 1.00 . A A . 9 LYS HE3 1 1 5 1525 1 1 9 LYS HG2 H -1.631 -5.205 4.945 1.00 . A A . 9 LYS HG2 1 1 5 1526 1 1 9 LYS HG3 H -0.408 -5.462 3.738 1.00 . A A . 9 LYS HG3 1 1 5 1527 1 1 9 LYS HZ1 H 0.236 -9.180 5.747 1.00 . A A . 9 LYS HZ1 1 1 5 1528 1 1 9 LYS HZ2 H 1.581 -8.773 6.699 1.00 . A A . 9 LYS HZ2 1 1 5 1529 1 1 9 LYS HZ3 H 1.803 -9.338 5.114 1.00 . A A . 9 LYS HZ3 1 1 5 1530 1 1 9 LYS N N 2.394 -3.024 5.681 1.00 . A A . 9 LYS N 1 1 5 1531 1 1 9 LYS NZ N 1.192 -8.771 5.735 1.00 . A A . 9 LYS NZ 1 1 5 1532 1 1 9 LYS O O 2.066 -4.988 2.807 1.00 . A A . 9 LYS O 1 1 5 1533 1 1 10 SER C C 3.319 -2.253 1.153 1.00 . A A . 10 SER C 1 1 5 1534 1 1 10 SER CA C 1.874 -2.612 1.526 1.00 . A A . 10 SER CA 1 1 5 1535 1 1 10 SER CB C 0.895 -1.517 1.099 1.00 . A A . 10 SER CB 1 1 5 1536 1 1 10 SER H H 1.585 -1.986 3.565 1.00 . A A . 10 SER H 1 1 5 1537 1 1 10 SER HA H 1.606 -3.531 1.024 1.00 . A A . 10 SER HA 1 1 5 1538 1 1 10 SER HB2 H 1.053 -0.599 1.636 1.00 . A A . 10 SER HB2 1 1 5 1539 1 1 10 SER HB3 H 0.915 -1.348 0.033 1.00 . A A . 10 SER HB3 1 1 5 1540 1 1 10 SER HG H -0.840 -1.360 1.958 1.00 . A A . 10 SER HG 1 1 5 1541 1 1 10 SER N N 1.747 -2.785 3.005 1.00 . A A . 10 SER N 1 1 5 1542 1 1 10 SER O O 3.795 -2.651 0.109 1.00 . A A . 10 SER O 1 1 5 1543 1 1 10 SER OG O -0.373 -2.039 1.466 1.00 . A A . 10 SER OG 1 1 5 1544 1 1 11 CYS C C 6.373 -2.229 1.535 1.00 . A A . 11 CYS C 1 1 5 1545 1 1 11 CYS CA C 5.393 -1.074 1.819 1.00 . A A . 11 CYS CA 1 1 5 1546 1 1 11 CYS CB C 5.810 -0.339 3.077 1.00 . A A . 11 CYS CB 1 1 5 1547 1 1 11 CYS H H 3.505 -1.249 2.842 1.00 . A A . 11 CYS H 1 1 5 1548 1 1 11 CYS HA H 5.423 -0.384 0.993 1.00 . A A . 11 CYS HA 1 1 5 1549 1 1 11 CYS HB2 H 5.067 0.415 3.288 1.00 . A A . 11 CYS HB2 1 1 5 1550 1 1 11 CYS HB3 H 5.756 -1.073 3.862 1.00 . A A . 11 CYS HB3 1 1 5 1551 1 1 11 CYS N N 3.968 -1.519 2.022 1.00 . A A . 11 CYS N 1 1 5 1552 1 1 11 CYS O O 7.450 -2.013 1.013 1.00 . A A . 11 CYS O 1 1 5 1553 1 1 11 CYS SG S 7.434 0.439 3.261 1.00 . A A . 11 CYS SG 1 1 5 1554 1 1 12 ARG C C 6.730 -5.145 0.226 1.00 . A A . 12 ARG C 1 1 5 1555 1 1 12 ARG CA C 6.791 -4.645 1.687 1.00 . A A . 12 ARG CA 1 1 5 1556 1 1 12 ARG CB C 6.253 -5.710 2.665 1.00 . A A . 12 ARG CB 1 1 5 1557 1 1 12 ARG CD C 6.451 -8.047 3.579 1.00 . A A . 12 ARG CD 1 1 5 1558 1 1 12 ARG CG C 7.075 -7.022 2.614 1.00 . A A . 12 ARG CG 1 1 5 1559 1 1 12 ARG CZ C 4.217 -9.046 3.809 1.00 . A A . 12 ARG CZ 1 1 5 1560 1 1 12 ARG H H 5.072 -3.508 2.300 1.00 . A A . 12 ARG H 1 1 5 1561 1 1 12 ARG HA H 7.818 -4.415 1.932 1.00 . A A . 12 ARG HA 1 1 5 1562 1 1 12 ARG HB2 H 6.292 -5.310 3.668 1.00 . A A . 12 ARG HB2 1 1 5 1563 1 1 12 ARG HB3 H 5.220 -5.914 2.425 1.00 . A A . 12 ARG HB3 1 1 5 1564 1 1 12 ARG HD2 H 7.029 -8.960 3.587 1.00 . A A . 12 ARG HD2 1 1 5 1565 1 1 12 ARG HD3 H 6.400 -7.643 4.579 1.00 . A A . 12 ARG HD3 1 1 5 1566 1 1 12 ARG HE H 4.784 -8.016 2.218 1.00 . A A . 12 ARG HE 1 1 5 1567 1 1 12 ARG HG2 H 7.065 -7.436 1.617 1.00 . A A . 12 ARG HG2 1 1 5 1568 1 1 12 ARG HG3 H 8.100 -6.828 2.899 1.00 . A A . 12 ARG HG3 1 1 5 1569 1 1 12 ARG HH11 H 5.465 -9.331 5.353 1.00 . A A . 12 ARG HH11 1 1 5 1570 1 1 12 ARG HH12 H 3.892 -10.036 5.518 1.00 . A A . 12 ARG HH12 1 1 5 1571 1 1 12 ARG HH21 H 2.807 -8.895 2.399 1.00 . A A . 12 ARG HH21 1 1 5 1572 1 1 12 ARG HH22 H 2.361 -9.793 3.812 1.00 . A A . 12 ARG HH22 1 1 5 1573 1 1 12 ARG N N 5.958 -3.418 1.889 1.00 . A A . 12 ARG N 1 1 5 1574 1 1 12 ARG NE N 5.066 -8.349 3.096 1.00 . A A . 12 ARG NE 1 1 5 1575 1 1 12 ARG NH1 N 4.551 -9.507 4.984 1.00 . A A . 12 ARG NH1 1 1 5 1576 1 1 12 ARG NH2 N 3.037 -9.262 3.301 1.00 . A A . 12 ARG NH2 1 1 5 1577 1 1 12 ARG O O 7.568 -5.916 -0.199 1.00 . A A . 12 ARG O 1 1 5 1578 1 1 13 SER C C 6.323 -4.174 -2.885 1.00 . A A . 13 SER C 1 1 5 1579 1 1 13 SER CA C 5.552 -5.081 -1.922 1.00 . A A . 13 SER CA 1 1 5 1580 1 1 13 SER CB C 4.045 -5.025 -2.240 1.00 . A A . 13 SER CB 1 1 5 1581 1 1 13 SER H H 5.113 -4.053 -0.092 1.00 . A A . 13 SER H 1 1 5 1582 1 1 13 SER HA H 5.899 -6.097 -2.048 1.00 . A A . 13 SER HA 1 1 5 1583 1 1 13 SER HB2 H 3.487 -5.714 -1.621 1.00 . A A . 13 SER HB2 1 1 5 1584 1 1 13 SER HB3 H 3.653 -4.025 -2.123 1.00 . A A . 13 SER HB3 1 1 5 1585 1 1 13 SER HG H 4.674 -5.973 -3.829 1.00 . A A . 13 SER HG 1 1 5 1586 1 1 13 SER N N 5.742 -4.682 -0.495 1.00 . A A . 13 SER N 1 1 5 1587 1 1 13 SER O O 6.540 -3.008 -2.612 1.00 . A A . 13 SER O 1 1 5 1588 1 1 13 SER OG O 3.926 -5.416 -3.603 1.00 . A A . 13 SER OG 1 1 5 1589 1 1 14 ARG C C 6.624 -2.873 -5.576 1.00 . A A . 14 ARG C 1 1 5 1590 1 1 14 ARG CA C 7.464 -4.044 -5.053 1.00 . A A . 14 ARG CA 1 1 5 1591 1 1 14 ARG CB C 7.786 -5.050 -6.184 1.00 . A A . 14 ARG CB 1 1 5 1592 1 1 14 ARG CD C 9.864 -3.740 -6.940 1.00 . A A . 14 ARG CD 1 1 5 1593 1 1 14 ARG CG C 8.529 -4.385 -7.378 1.00 . A A . 14 ARG CG 1 1 5 1594 1 1 14 ARG CZ C 11.483 -5.588 -7.062 1.00 . A A . 14 ARG CZ 1 1 5 1595 1 1 14 ARG H H 6.480 -5.714 -4.121 1.00 . A A . 14 ARG H 1 1 5 1596 1 1 14 ARG HA H 8.371 -3.658 -4.617 1.00 . A A . 14 ARG HA 1 1 5 1597 1 1 14 ARG HB2 H 8.392 -5.850 -5.785 1.00 . A A . 14 ARG HB2 1 1 5 1598 1 1 14 ARG HB3 H 6.862 -5.480 -6.544 1.00 . A A . 14 ARG HB3 1 1 5 1599 1 1 14 ARG HD2 H 10.365 -3.303 -7.791 1.00 . A A . 14 ARG HD2 1 1 5 1600 1 1 14 ARG HD3 H 9.692 -2.961 -6.213 1.00 . A A . 14 ARG HD3 1 1 5 1601 1 1 14 ARG HE H 10.771 -4.881 -5.356 1.00 . A A . 14 ARG HE 1 1 5 1602 1 1 14 ARG HG2 H 8.729 -5.139 -8.125 1.00 . A A . 14 ARG HG2 1 1 5 1603 1 1 14 ARG HG3 H 7.900 -3.632 -7.830 1.00 . A A . 14 ARG HG3 1 1 5 1604 1 1 14 ARG HH11 H 10.904 -4.821 -8.823 1.00 . A A . 14 ARG HH11 1 1 5 1605 1 1 14 ARG HH12 H 12.048 -6.116 -8.908 1.00 . A A . 14 ARG HH12 1 1 5 1606 1 1 14 ARG HH21 H 12.210 -6.520 -5.448 1.00 . A A . 14 ARG HH21 1 1 5 1607 1 1 14 ARG HH22 H 12.797 -7.094 -6.972 1.00 . A A . 14 ARG HH22 1 1 5 1608 1 1 14 ARG N N 6.703 -4.768 -3.989 1.00 . A A . 14 ARG N 1 1 5 1609 1 1 14 ARG NE N 10.744 -4.789 -6.331 1.00 . A A . 14 ARG NE 1 1 5 1610 1 1 14 ARG NH1 N 11.477 -5.500 -8.365 1.00 . A A . 14 ARG NH1 1 1 5 1611 1 1 14 ARG NH2 N 12.221 -6.470 -6.446 1.00 . A A . 14 ARG NH2 1 1 5 1612 1 1 14 ARG O O 7.156 -1.890 -6.050 1.00 . A A . 14 ARG O 1 1 5 1613 1 1 15 GLN C C 4.593 -0.703 -5.095 1.00 . A A . 15 GLN C 1 1 5 1614 1 1 15 GLN CA C 4.373 -1.978 -5.928 1.00 . A A . 15 GLN CA 1 1 5 1615 1 1 15 GLN CB C 2.943 -2.523 -5.743 1.00 . A A . 15 GLN CB 1 1 5 1616 1 1 15 GLN CD C 0.489 -2.074 -6.024 1.00 . A A . 15 GLN CD 1 1 5 1617 1 1 15 GLN CG C 1.896 -1.489 -6.211 1.00 . A A . 15 GLN CG 1 1 5 1618 1 1 15 GLN H H 4.977 -3.855 -5.075 1.00 . A A . 15 GLN H 1 1 5 1619 1 1 15 GLN HA H 4.564 -1.758 -6.969 1.00 . A A . 15 GLN HA 1 1 5 1620 1 1 15 GLN HB2 H 2.834 -3.433 -6.315 1.00 . A A . 15 GLN HB2 1 1 5 1621 1 1 15 GLN HB3 H 2.784 -2.759 -4.700 1.00 . A A . 15 GLN HB3 1 1 5 1622 1 1 15 GLN HE21 H 0.710 -2.325 -4.068 1.00 . A A . 15 GLN HE21 1 1 5 1623 1 1 15 GLN HE22 H -0.793 -2.807 -4.698 1.00 . A A . 15 GLN HE22 1 1 5 1624 1 1 15 GLN HG2 H 1.968 -0.582 -5.629 1.00 . A A . 15 GLN HG2 1 1 5 1625 1 1 15 GLN HG3 H 2.043 -1.250 -7.255 1.00 . A A . 15 GLN HG3 1 1 5 1626 1 1 15 GLN N N 5.328 -3.029 -5.468 1.00 . A A . 15 GLN N 1 1 5 1627 1 1 15 GLN NE2 N 0.103 -2.432 -4.829 1.00 . A A . 15 GLN NE2 1 1 5 1628 1 1 15 GLN O O 4.502 0.396 -5.608 1.00 . A A . 15 GLN O 1 1 5 1629 1 1 15 GLN OE1 O -0.271 -2.212 -6.962 1.00 . A A . 15 GLN OE1 1 1 5 1630 1 1 16 CYS C C 6.548 0.757 -2.851 1.00 . A A . 16 CYS C 1 1 5 1631 1 1 16 CYS CA C 5.115 0.237 -2.902 1.00 . A A . 16 CYS CA 1 1 5 1632 1 1 16 CYS CB C 4.725 -0.158 -1.504 1.00 . A A . 16 CYS CB 1 1 5 1633 1 1 16 CYS H H 4.930 -1.821 -3.490 1.00 . A A . 16 CYS H 1 1 5 1634 1 1 16 CYS HA H 4.466 1.043 -3.193 1.00 . A A . 16 CYS HA 1 1 5 1635 1 1 16 CYS HB2 H 5.260 -1.050 -1.226 1.00 . A A . 16 CYS HB2 1 1 5 1636 1 1 16 CYS HB3 H 5.053 0.628 -0.840 1.00 . A A . 16 CYS HB3 1 1 5 1637 1 1 16 CYS N N 4.876 -0.905 -3.832 1.00 . A A . 16 CYS N 1 1 5 1638 1 1 16 CYS O O 6.749 1.901 -2.497 1.00 . A A . 16 CYS O 1 1 5 1639 1 1 16 CYS SG S 2.978 -0.441 -1.154 1.00 . A A . 16 CYS SG 1 1 5 1640 1 1 17 LYS C C 9.194 1.721 -3.939 1.00 . A A . 17 LYS C 1 1 5 1641 1 1 17 LYS CA C 8.927 0.407 -3.153 1.00 . A A . 17 LYS CA 1 1 5 1642 1 1 17 LYS CB C 9.852 -0.706 -3.699 1.00 . A A . 17 LYS CB 1 1 5 1643 1 1 17 LYS CD C 10.733 -3.066 -3.203 1.00 . A A . 17 LYS CD 1 1 5 1644 1 1 17 LYS CE C 12.208 -2.616 -3.218 1.00 . A A . 17 LYS CE 1 1 5 1645 1 1 17 LYS CG C 9.792 -1.923 -2.742 1.00 . A A . 17 LYS CG 1 1 5 1646 1 1 17 LYS H H 7.291 -0.992 -3.451 1.00 . A A . 17 LYS H 1 1 5 1647 1 1 17 LYS HA H 9.180 0.583 -2.119 1.00 . A A . 17 LYS HA 1 1 5 1648 1 1 17 LYS HB2 H 9.531 -1.005 -4.686 1.00 . A A . 17 LYS HB2 1 1 5 1649 1 1 17 LYS HB3 H 10.861 -0.327 -3.761 1.00 . A A . 17 LYS HB3 1 1 5 1650 1 1 17 LYS HD2 H 10.622 -3.908 -2.535 1.00 . A A . 17 LYS HD2 1 1 5 1651 1 1 17 LYS HD3 H 10.455 -3.381 -4.194 1.00 . A A . 17 LYS HD3 1 1 5 1652 1 1 17 LYS HE2 H 12.834 -3.450 -3.500 1.00 . A A . 17 LYS HE2 1 1 5 1653 1 1 17 LYS HE3 H 12.367 -1.815 -3.924 1.00 . A A . 17 LYS HE3 1 1 5 1654 1 1 17 LYS HG2 H 10.066 -1.613 -1.743 1.00 . A A . 17 LYS HG2 1 1 5 1655 1 1 17 LYS HG3 H 8.784 -2.302 -2.709 1.00 . A A . 17 LYS HG3 1 1 5 1656 1 1 17 LYS HZ1 H 13.622 -2.402 -1.702 1.00 . A A . 17 LYS HZ1 1 1 5 1657 1 1 17 LYS HZ2 H 12.033 -2.624 -1.142 1.00 . A A . 17 LYS HZ2 1 1 5 1658 1 1 17 LYS HZ3 H 12.502 -1.127 -1.793 1.00 . A A . 17 LYS HZ3 1 1 5 1659 1 1 17 LYS N N 7.506 -0.071 -3.187 1.00 . A A . 17 LYS N 1 1 5 1660 1 1 17 LYS NZ N 12.623 -2.158 -1.861 1.00 . A A . 17 LYS NZ 1 1 5 1661 1 1 17 LYS O O 9.903 2.565 -3.428 1.00 . A A . 17 LYS O 1 1 5 1662 1 1 18 HYP C C 8.205 4.399 -5.203 1.00 . A A . 18 HYP C 1 1 5 1663 1 1 18 HYP CA C 8.807 3.153 -5.891 1.00 . A A . 18 HYP CA 1 1 5 1664 1 1 18 HYP CB C 8.170 2.863 -7.253 1.00 . A A . 18 HYP CB 1 1 5 1665 1 1 18 HYP CD C 7.839 0.932 -5.908 1.00 . A A . 18 HYP CD 1 1 5 1666 1 1 18 HYP CG C 7.198 1.776 -6.969 1.00 . A A . 18 HYP CG 1 1 5 1667 1 1 18 HYP HA H 9.856 3.352 -6.064 1.00 . A A . 18 HYP HA 1 1 5 1668 1 1 18 HYP HB2 H 8.929 2.553 -7.958 1.00 . A A . 18 HYP HB2 1 1 5 1669 1 1 18 HYP HB3 H 7.686 3.741 -7.653 1.00 . A A . 18 HYP HB3 1 1 5 1670 1 1 18 HYP HD1 H 7.664 0.383 -8.247 1.00 . A A . 18 HYP HD1 1 1 5 1671 1 1 18 HYP HD22 H 8.470 0.173 -6.348 1.00 . A A . 18 HYP HD22 1 1 5 1672 1 1 18 HYP HD23 H 7.059 0.485 -5.320 1.00 . A A . 18 HYP HD23 1 1 5 1673 1 1 18 HYP HG H 6.274 2.203 -6.602 1.00 . A A . 18 HYP HG 1 1 5 1674 1 1 18 HYP N N 8.650 1.891 -5.130 1.00 . A A . 18 HYP N 1 1 5 1675 1 1 18 HYP O O 8.353 5.490 -5.721 1.00 . A A . 18 HYP O 1 1 5 1676 1 1 18 HYP OD1 O 6.943 1.007 -8.136 1.00 . A A . 18 HYP OD1 1 1 5 1677 1 1 19 HIS C C 8.030 6.105 -2.566 1.00 . A A . 19 HIS C 1 1 5 1678 1 1 19 HIS CA C 6.946 5.369 -3.350 1.00 . A A . 19 HIS CA 1 1 5 1679 1 1 19 HIS CB C 5.866 4.890 -2.355 1.00 . A A . 19 HIS CB 1 1 5 1680 1 1 19 HIS CD2 C 4.637 3.334 -4.130 1.00 . A A . 19 HIS CD2 1 1 5 1681 1 1 19 HIS CE1 C 2.685 3.781 -3.605 1.00 . A A . 19 HIS CE1 1 1 5 1682 1 1 19 HIS CG C 4.685 4.242 -3.088 1.00 . A A . 19 HIS CG 1 1 5 1683 1 1 19 HIS H H 7.474 3.305 -3.705 1.00 . A A . 19 HIS H 1 1 5 1684 1 1 19 HIS HA H 6.509 6.048 -4.068 1.00 . A A . 19 HIS HA 1 1 5 1685 1 1 19 HIS HB2 H 6.282 4.171 -1.664 1.00 . A A . 19 HIS HB2 1 1 5 1686 1 1 19 HIS HB3 H 5.493 5.732 -1.788 1.00 . A A . 19 HIS HB3 1 1 5 1687 1 1 19 HIS HD1 H 3.126 5.081 -2.116 1.00 . A A . 19 HIS HD1 1 1 5 1688 1 1 19 HIS HD2 H 5.498 2.908 -4.614 1.00 . A A . 19 HIS HD2 1 1 5 1689 1 1 19 HIS HE1 H 1.605 3.799 -3.577 1.00 . A A . 19 HIS HE1 1 1 5 1690 1 1 19 HIS N N 7.557 4.208 -4.077 1.00 . A A . 19 HIS N 1 1 5 1691 1 1 19 HIS ND1 N 3.444 4.473 -2.816 1.00 . A A . 19 HIS ND1 1 1 5 1692 1 1 19 HIS NE2 N 3.386 3.057 -4.440 1.00 . A A . 19 HIS NE2 1 1 5 1693 1 1 19 HIS O O 9.012 5.511 -2.167 1.00 . A A . 19 HIS O 1 1 5 1694 1 1 20 ARG C C 8.863 7.757 -0.141 1.00 . A A . 20 ARG C 1 1 5 1695 1 1 20 ARG CA C 8.803 8.217 -1.610 1.00 . A A . 20 ARG CA 1 1 5 1696 1 1 20 ARG CB C 8.373 9.707 -1.677 1.00 . A A . 20 ARG CB 1 1 5 1697 1 1 20 ARG CD C 7.523 9.594 -4.128 1.00 . A A . 20 ARG CD 1 1 5 1698 1 1 20 ARG CG C 8.438 10.316 -3.117 1.00 . A A . 20 ARG CG 1 1 5 1699 1 1 20 ARG CZ C 7.269 9.751 -6.562 1.00 . A A . 20 ARG CZ 1 1 5 1700 1 1 20 ARG H H 7.000 7.791 -2.716 1.00 . A A . 20 ARG H 1 1 5 1701 1 1 20 ARG HA H 9.781 8.093 -2.054 1.00 . A A . 20 ARG HA 1 1 5 1702 1 1 20 ARG HB2 H 7.362 9.798 -1.306 1.00 . A A . 20 ARG HB2 1 1 5 1703 1 1 20 ARG HB3 H 9.016 10.288 -1.032 1.00 . A A . 20 ARG HB3 1 1 5 1704 1 1 20 ARG HD2 H 7.875 8.588 -4.295 1.00 . A A . 20 ARG HD2 1 1 5 1705 1 1 20 ARG HD3 H 6.499 9.574 -3.787 1.00 . A A . 20 ARG HD3 1 1 5 1706 1 1 20 ARG HE H 7.891 11.262 -5.438 1.00 . A A . 20 ARG HE 1 1 5 1707 1 1 20 ARG HG2 H 8.147 11.356 -3.067 1.00 . A A . 20 ARG HG2 1 1 5 1708 1 1 20 ARG HG3 H 9.457 10.272 -3.472 1.00 . A A . 20 ARG HG3 1 1 5 1709 1 1 20 ARG HH11 H 6.809 7.973 -5.746 1.00 . A A . 20 ARG HH11 1 1 5 1710 1 1 20 ARG HH12 H 6.625 8.082 -7.462 1.00 . A A . 20 ARG HH12 1 1 5 1711 1 1 20 ARG HH21 H 7.663 11.410 -7.610 1.00 . A A . 20 ARG HH21 1 1 5 1712 1 1 20 ARG HH22 H 7.116 10.051 -8.534 1.00 . A A . 20 ARG HH22 1 1 5 1713 1 1 20 ARG N N 7.818 7.380 -2.366 1.00 . A A . 20 ARG N 1 1 5 1714 1 1 20 ARG NE N 7.596 10.327 -5.430 1.00 . A A . 20 ARG NE 1 1 5 1715 1 1 20 ARG NH1 N 6.871 8.506 -6.590 1.00 . A A . 20 ARG NH1 1 1 5 1716 1 1 20 ARG NH2 N 7.356 10.459 -7.654 1.00 . A A . 20 ARG NH2 1 1 5 1717 1 1 20 ARG O O 9.809 8.042 0.566 1.00 . A A . 20 ARG O 1 1 5 1718 1 1 21 CYS C C 8.481 5.208 1.854 1.00 . A A . 21 CYS C 1 1 5 1719 1 1 21 CYS CA C 7.723 6.521 1.648 1.00 . A A . 21 CYS CA 1 1 5 1720 1 1 21 CYS CB C 6.288 6.287 1.954 1.00 . A A . 21 CYS CB 1 1 5 1721 1 1 21 CYS H H 7.113 6.862 -0.379 1.00 . A A . 21 CYS H 1 1 5 1722 1 1 21 CYS HA H 8.039 7.261 2.358 1.00 . A A . 21 CYS HA 1 1 5 1723 1 1 21 CYS HB2 H 5.910 5.536 1.276 1.00 . A A . 21 CYS HB2 1 1 5 1724 1 1 21 CYS HB3 H 6.202 5.899 2.959 1.00 . A A . 21 CYS HB3 1 1 5 1725 1 1 21 CYS N N 7.834 7.051 0.256 1.00 . A A . 21 CYS N 1 1 5 1726 1 1 21 CYS O O 8.893 4.894 2.955 1.00 . A A . 21 CYS O 1 1 5 1727 1 1 21 CYS SG S 5.203 7.722 1.835 1.00 . A A . 21 CYS SG 1 1 5 1728 1 1 22 . C C 10.301 3.064 -0.381 1.00 . A A . 22 CY3 C 1 1 5 1729 1 1 22 . CA C 9.343 3.174 0.800 1.00 . A A . 22 CY3 CA 1 1 5 1730 1 1 22 . CB C 8.219 2.119 0.806 1.00 . A A . 22 CY3 CB 1 1 5 1731 1 1 22 . H H 8.284 4.814 -0.084 1.00 . A A . 22 CY3 H 1 1 5 1732 1 1 22 . HA H 9.921 3.093 1.709 1.00 . A A . 22 CY3 HA 1 1 5 1733 1 1 22 . HB2 H 8.624 1.126 0.694 1.00 . A A . 22 CY3 HB2 1 1 5 1734 1 1 22 . HB3 H 7.555 2.302 -0.027 1.00 . A A . 22 CY3 HB3 1 1 5 1735 1 1 22 . HN11 H 10.516 5.031 -0.458 1.00 . A A . 22 CY3 HN11 1 1 5 1736 1 1 22 . HN12 H 11.401 4.172 -1.612 1.00 . A A . 22 CY3 HN12 1 1 5 1737 1 1 22 . N N 8.636 4.488 0.772 1.00 . A A . 22 CY3 N 1 1 5 1738 1 1 22 . N1 N 10.781 4.177 -0.859 1.00 . A A . 22 CY3 N1 1 1 5 1739 1 1 22 . O O 10.619 1.998 -0.866 1.00 . A A . 22 CY3 O 1 1 5 1740 1 1 22 . SG S 7.237 2.217 2.325 1.00 . A A . 22 CY3 SG 1 1 6 1741 1 1 1 PCA C C -4.099 5.999 1.835 1.00 . A A . 1 PCA C 1 1 6 1742 1 1 1 PCA CA C -5.599 6.135 1.549 1.00 . A A . 1 PCA CA 1 1 6 1743 1 1 1 PCA CB C -6.316 4.783 1.553 1.00 . A A . 1 PCA CB 1 1 6 1744 1 1 1 PCA CD C -6.411 5.678 -0.644 1.00 . A A . 1 PCA CD 1 1 6 1745 1 1 1 PCA CG C -6.391 4.359 0.092 1.00 . A A . 1 PCA CG 1 1 6 1746 1 1 1 PCA HA H -6.045 6.785 2.290 1.00 . A A . 1 PCA HA 1 1 6 1747 1 1 1 PCA HB2 H -7.298 4.892 1.986 1.00 . A A . 1 PCA HB2 1 1 6 1748 1 1 1 PCA HB3 H -5.771 4.067 2.152 1.00 . A A . 1 PCA HB3 1 1 6 1749 1 1 1 PCA HG2 H -7.293 3.794 -0.092 1.00 . A A . 1 PCA HG2 1 1 6 1750 1 1 1 PCA HG3 H -5.518 3.783 -0.180 1.00 . A A . 1 PCA HG3 1 1 6 1751 1 1 1 PCA N N -5.841 6.717 0.213 1.00 . A A . 1 PCA N 1 1 6 1752 1 1 1 PCA O O -3.315 5.902 0.909 1.00 . A A . 1 PCA O 1 1 6 1753 1 1 1 PCA OE O -6.836 5.840 -1.771 1.00 . A A . 1 PCA OE 1 1 6 1754 1 1 2 ARG C C -1.974 4.373 3.465 1.00 . A A . 2 ARG C 1 1 6 1755 1 1 2 ARG CA C -2.328 5.868 3.502 1.00 . A A . 2 ARG CA 1 1 6 1756 1 1 2 ARG CB C -2.149 6.448 4.924 1.00 . A A . 2 ARG CB 1 1 6 1757 1 1 2 ARG CD C -2.362 8.535 6.350 1.00 . A A . 2 ARG CD 1 1 6 1758 1 1 2 ARG CG C -2.584 7.930 4.946 1.00 . A A . 2 ARG CG 1 1 6 1759 1 1 2 ARG CZ C -2.690 6.831 8.107 1.00 . A A . 2 ARG CZ 1 1 6 1760 1 1 2 ARG H H -4.454 6.079 3.789 1.00 . A A . 2 ARG H 1 1 6 1761 1 1 2 ARG HA H -1.704 6.400 2.798 1.00 . A A . 2 ARG HA 1 1 6 1762 1 1 2 ARG HB2 H -2.735 5.873 5.626 1.00 . A A . 2 ARG HB2 1 1 6 1763 1 1 2 ARG HB3 H -1.108 6.389 5.201 1.00 . A A . 2 ARG HB3 1 1 6 1764 1 1 2 ARG HD2 H -1.317 8.506 6.624 1.00 . A A . 2 ARG HD2 1 1 6 1765 1 1 2 ARG HD3 H -2.686 9.566 6.350 1.00 . A A . 2 ARG HD3 1 1 6 1766 1 1 2 ARG HE H -4.131 8.020 7.458 1.00 . A A . 2 ARG HE 1 1 6 1767 1 1 2 ARG HG2 H -2.012 8.490 4.221 1.00 . A A . 2 ARG HG2 1 1 6 1768 1 1 2 ARG HG3 H -3.631 8.009 4.691 1.00 . A A . 2 ARG HG3 1 1 6 1769 1 1 2 ARG HH11 H -0.826 6.927 7.361 1.00 . A A . 2 ARG HH11 1 1 6 1770 1 1 2 ARG HH12 H -1.083 5.746 8.598 1.00 . A A . 2 ARG HH12 1 1 6 1771 1 1 2 ARG HH21 H -4.450 6.532 9.009 1.00 . A A . 2 ARG HH21 1 1 6 1772 1 1 2 ARG HH22 H -3.152 5.514 9.541 1.00 . A A . 2 ARG HH22 1 1 6 1773 1 1 2 ARG N N -3.762 5.997 3.101 1.00 . A A . 2 ARG N 1 1 6 1774 1 1 2 ARG NE N -3.186 7.787 7.356 1.00 . A A . 2 ARG NE 1 1 6 1775 1 1 2 ARG NH1 N -1.435 6.476 8.013 1.00 . A A . 2 ARG NH1 1 1 6 1776 1 1 2 ARG NH2 N -3.494 6.247 8.951 1.00 . A A . 2 ARG NH2 1 1 6 1777 1 1 2 ARG O O -1.958 3.688 4.470 1.00 . A A . 2 ARG O 1 1 6 1778 1 1 3 LEU C C 0.133 2.329 2.471 1.00 . A A . 3 LEU C 1 1 6 1779 1 1 3 LEU CA C -1.333 2.500 2.005 1.00 . A A . 3 LEU CA 1 1 6 1780 1 1 3 LEU CB C -1.554 2.291 0.474 1.00 . A A . 3 LEU CB 1 1 6 1781 1 1 3 LEU CD1 C -2.399 -0.102 0.653 1.00 . A A . 3 LEU CD1 1 1 6 1782 1 1 3 LEU CD2 C -1.509 0.761 -1.532 1.00 . A A . 3 LEU CD2 1 1 6 1783 1 1 3 LEU CG C -1.356 0.822 0.000 1.00 . A A . 3 LEU CG 1 1 6 1784 1 1 3 LEU H H -1.739 4.550 1.512 1.00 . A A . 3 LEU H 1 1 6 1785 1 1 3 LEU HA H -1.974 1.858 2.589 1.00 . A A . 3 LEU HA 1 1 6 1786 1 1 3 LEU HB2 H -2.563 2.598 0.234 1.00 . A A . 3 LEU HB2 1 1 6 1787 1 1 3 LEU HB3 H -0.880 2.936 -0.070 1.00 . A A . 3 LEU HB3 1 1 6 1788 1 1 3 LEU HD11 H -2.290 -0.079 1.725 1.00 . A A . 3 LEU HD11 1 1 6 1789 1 1 3 LEU HD12 H -2.258 -1.117 0.314 1.00 . A A . 3 LEU HD12 1 1 6 1790 1 1 3 LEU HD13 H -3.401 0.211 0.396 1.00 . A A . 3 LEU HD13 1 1 6 1791 1 1 3 LEU HD21 H -0.766 1.385 -2.007 1.00 . A A . 3 LEU HD21 1 1 6 1792 1 1 3 LEU HD22 H -2.489 1.105 -1.826 1.00 . A A . 3 LEU HD22 1 1 6 1793 1 1 3 LEU HD23 H -1.381 -0.254 -1.877 1.00 . A A . 3 LEU HD23 1 1 6 1794 1 1 3 LEU HG H -0.369 0.477 0.258 1.00 . A A . 3 LEU HG 1 1 6 1795 1 1 3 LEU N N -1.701 3.926 2.266 1.00 . A A . 3 LEU N 1 1 6 1796 1 1 3 LEU O O 0.408 2.481 3.642 1.00 . A A . 3 LEU O 1 1 6 1797 1 1 4 CYS C C 3.028 2.760 2.899 1.00 . A A . 4 CYS C 1 1 6 1798 1 1 4 CYS CA C 2.477 1.815 1.807 1.00 . A A . 4 CYS CA 1 1 6 1799 1 1 4 CYS CB C 3.216 2.068 0.483 1.00 . A A . 4 CYS CB 1 1 6 1800 1 1 4 CYS H H 0.705 1.882 0.642 1.00 . A A . 4 CYS H 1 1 6 1801 1 1 4 CYS HA H 2.643 0.800 2.125 1.00 . A A . 4 CYS HA 1 1 6 1802 1 1 4 CYS HB2 H 3.246 3.121 0.275 1.00 . A A . 4 CYS HB2 1 1 6 1803 1 1 4 CYS HB3 H 4.245 1.761 0.603 1.00 . A A . 4 CYS HB3 1 1 6 1804 1 1 4 CYS N N 1.014 2.013 1.555 1.00 . A A . 4 CYS N 1 1 6 1805 1 1 4 CYS O O 3.605 2.326 3.877 1.00 . A A . 4 CYS O 1 1 6 1806 1 1 4 CYS SG S 2.626 1.271 -1.030 1.00 . A A . 4 CYS SG 1 1 6 1807 1 1 5 CYS C C 2.633 4.977 5.027 1.00 . A A . 5 CYS C 1 1 6 1808 1 1 5 CYS CA C 3.288 5.087 3.636 1.00 . A A . 5 CYS CA 1 1 6 1809 1 1 5 CYS CB C 2.969 6.481 3.059 1.00 . A A . 5 CYS CB 1 1 6 1810 1 1 5 CYS H H 2.332 4.296 1.870 1.00 . A A . 5 CYS H 1 1 6 1811 1 1 5 CYS HA H 4.356 4.982 3.754 1.00 . A A . 5 CYS HA 1 1 6 1812 1 1 5 CYS HB2 H 1.921 6.650 3.078 1.00 . A A . 5 CYS HB2 1 1 6 1813 1 1 5 CYS HB3 H 3.409 7.209 3.725 1.00 . A A . 5 CYS HB3 1 1 6 1814 1 1 5 CYS N N 2.815 4.034 2.681 1.00 . A A . 5 CYS N 1 1 6 1815 1 1 5 CYS O O 3.296 5.143 6.033 1.00 . A A . 5 CYS O 1 1 6 1816 1 1 5 CYS SG S 3.523 6.909 1.394 1.00 . A A . 5 CYS SG 1 1 6 1817 1 1 6 GLY C C 0.921 3.312 7.130 1.00 . A A . 6 GLY C 1 1 6 1818 1 1 6 GLY CA C 0.598 4.568 6.321 1.00 . A A . 6 GLY CA 1 1 6 1819 1 1 6 GLY H H 0.882 4.565 4.187 1.00 . A A . 6 GLY H 1 1 6 1820 1 1 6 GLY HA2 H 0.806 5.436 6.929 1.00 . A A . 6 GLY HA2 1 1 6 1821 1 1 6 GLY HA3 H -0.456 4.555 6.101 1.00 . A A . 6 GLY HA3 1 1 6 1822 1 1 6 GLY N N 1.353 4.696 5.036 1.00 . A A . 6 GLY N 1 1 6 1823 1 1 6 GLY O O 1.110 3.400 8.328 1.00 . A A . 6 GLY O 1 1 6 1824 1 1 7 PHE C C 2.096 -0.118 6.333 1.00 . A A . 7 PHE C 1 1 6 1825 1 1 7 PHE CA C 1.279 0.902 7.166 1.00 . A A . 7 PHE CA 1 1 6 1826 1 1 7 PHE CB C -0.069 0.287 7.617 1.00 . A A . 7 PHE CB 1 1 6 1827 1 1 7 PHE CD1 C -0.950 -1.016 5.626 1.00 . A A . 7 PHE CD1 1 1 6 1828 1 1 7 PHE CD2 C -2.005 1.051 6.169 1.00 . A A . 7 PHE CD2 1 1 6 1829 1 1 7 PHE CE1 C -1.823 -1.187 4.572 1.00 . A A . 7 PHE CE1 1 1 6 1830 1 1 7 PHE CE2 C -2.878 0.881 5.115 1.00 . A A . 7 PHE CE2 1 1 6 1831 1 1 7 PHE CG C -1.034 0.101 6.432 1.00 . A A . 7 PHE CG 1 1 6 1832 1 1 7 PHE CZ C -2.788 -0.237 4.317 1.00 . A A . 7 PHE CZ 1 1 6 1833 1 1 7 PHE H H 0.815 2.186 5.498 1.00 . A A . 7 PHE H 1 1 6 1834 1 1 7 PHE HA H 1.845 1.147 8.051 1.00 . A A . 7 PHE HA 1 1 6 1835 1 1 7 PHE HB2 H 0.099 -0.675 8.077 1.00 . A A . 7 PHE HB2 1 1 6 1836 1 1 7 PHE HB3 H -0.535 0.933 8.347 1.00 . A A . 7 PHE HB3 1 1 6 1837 1 1 7 PHE HD1 H -0.194 -1.756 5.827 1.00 . A A . 7 PHE HD1 1 1 6 1838 1 1 7 PHE HD2 H -2.083 1.931 6.790 1.00 . A A . 7 PHE HD2 1 1 6 1839 1 1 7 PHE HE1 H -1.750 -2.064 3.948 1.00 . A A . 7 PHE HE1 1 1 6 1840 1 1 7 PHE HE2 H -3.634 1.627 4.915 1.00 . A A . 7 PHE HE2 1 1 6 1841 1 1 7 PHE HZ H -3.475 -0.369 3.494 1.00 . A A . 7 PHE HZ 1 1 6 1842 1 1 7 PHE N N 0.975 2.186 6.462 1.00 . A A . 7 PHE N 1 1 6 1843 1 1 7 PHE O O 1.899 -0.282 5.140 1.00 . A A . 7 PHE O 1 1 6 1844 1 1 8 HYP C C 3.654 -2.758 5.618 1.00 . A A . 8 HYP C 1 1 6 1845 1 1 8 HYP CA C 4.110 -1.518 6.393 1.00 . A A . 8 HYP CA 1 1 6 1846 1 1 8 HYP CB C 5.047 -1.855 7.543 1.00 . A A . 8 HYP CB 1 1 6 1847 1 1 8 HYP CD C 3.071 -0.932 8.494 1.00 . A A . 8 HYP CD 1 1 6 1848 1 1 8 HYP CG C 4.115 -2.000 8.695 1.00 . A A . 8 HYP CG 1 1 6 1849 1 1 8 HYP HA H 4.642 -0.867 5.719 1.00 . A A . 8 HYP HA 1 1 6 1850 1 1 8 HYP HB2 H 5.761 -1.058 7.689 1.00 . A A . 8 HYP HB2 1 1 6 1851 1 1 8 HYP HB3 H 5.597 -2.764 7.344 1.00 . A A . 8 HYP HB3 1 1 6 1852 1 1 8 HYP HD1 H 5.567 -1.256 9.758 1.00 . A A . 8 HYP HD1 1 1 6 1853 1 1 8 HYP HD22 H 3.386 -0.010 8.961 1.00 . A A . 8 HYP HD22 1 1 6 1854 1 1 8 HYP HD23 H 2.124 -1.257 8.899 1.00 . A A . 8 HYP HD23 1 1 6 1855 1 1 8 HYP HG H 3.654 -2.977 8.673 1.00 . A A . 8 HYP HG 1 1 6 1856 1 1 8 HYP N N 2.999 -0.784 7.022 1.00 . A A . 8 HYP N 1 1 6 1857 1 1 8 HYP O O 4.438 -3.324 4.879 1.00 . A A . 8 HYP O 1 1 6 1858 1 1 8 HYP OD1 O 4.805 -1.815 9.923 1.00 . A A . 8 HYP OD1 1 1 6 1859 1 1 9 LYS C C 1.959 -4.104 3.606 1.00 . A A . 9 LYS C 1 1 6 1860 1 1 9 LYS CA C 1.865 -4.323 5.114 1.00 . A A . 9 LYS CA 1 1 6 1861 1 1 9 LYS CB C 0.388 -4.538 5.537 1.00 . A A . 9 LYS CB 1 1 6 1862 1 1 9 LYS CD C 0.519 -7.107 5.171 1.00 . A A . 9 LYS CD 1 1 6 1863 1 1 9 LYS CE C 0.490 -7.400 6.684 1.00 . A A . 9 LYS CE 1 1 6 1864 1 1 9 LYS CG C -0.236 -5.787 4.843 1.00 . A A . 9 LYS CG 1 1 6 1865 1 1 9 LYS H H 1.838 -2.614 6.422 1.00 . A A . 9 LYS H 1 1 6 1866 1 1 9 LYS HA H 2.465 -5.179 5.389 1.00 . A A . 9 LYS HA 1 1 6 1867 1 1 9 LYS HB2 H 0.326 -4.632 6.610 1.00 . A A . 9 LYS HB2 1 1 6 1868 1 1 9 LYS HB3 H -0.197 -3.683 5.243 1.00 . A A . 9 LYS HB3 1 1 6 1869 1 1 9 LYS HD2 H 0.039 -7.922 4.649 1.00 . A A . 9 LYS HD2 1 1 6 1870 1 1 9 LYS HD3 H 1.541 -7.050 4.827 1.00 . A A . 9 LYS HD3 1 1 6 1871 1 1 9 LYS HE2 H 0.985 -6.615 7.237 1.00 . A A . 9 LYS HE2 1 1 6 1872 1 1 9 LYS HE3 H -0.528 -7.489 7.034 1.00 . A A . 9 LYS HE3 1 1 6 1873 1 1 9 LYS HG2 H -1.262 -5.885 5.167 1.00 . A A . 9 LYS HG2 1 1 6 1874 1 1 9 LYS HG3 H -0.240 -5.639 3.774 1.00 . A A . 9 LYS HG3 1 1 6 1875 1 1 9 LYS HZ1 H 0.742 -9.451 6.432 1.00 . A A . 9 LYS HZ1 1 1 6 1876 1 1 9 LYS HZ2 H 1.157 -8.886 7.980 1.00 . A A . 9 LYS HZ2 1 1 6 1877 1 1 9 LYS HZ3 H 2.192 -8.597 6.663 1.00 . A A . 9 LYS HZ3 1 1 6 1878 1 1 9 LYS N N 2.411 -3.127 5.816 1.00 . A A . 9 LYS N 1 1 6 1879 1 1 9 LYS NZ N 1.199 -8.680 6.961 1.00 . A A . 9 LYS NZ 1 1 6 1880 1 1 9 LYS O O 2.230 -5.046 2.885 1.00 . A A . 9 LYS O 1 1 6 1881 1 1 10 SER C C 3.293 -2.335 1.352 1.00 . A A . 10 SER C 1 1 6 1882 1 1 10 SER CA C 1.834 -2.644 1.697 1.00 . A A . 10 SER CA 1 1 6 1883 1 1 10 SER CB C 0.923 -1.472 1.347 1.00 . A A . 10 SER CB 1 1 6 1884 1 1 10 SER H H 1.529 -2.124 3.753 1.00 . A A . 10 SER H 1 1 6 1885 1 1 10 SER HA H 1.517 -3.526 1.156 1.00 . A A . 10 SER HA 1 1 6 1886 1 1 10 SER HB2 H 1.166 -0.585 1.908 1.00 . A A . 10 SER HB2 1 1 6 1887 1 1 10 SER HB3 H 0.932 -1.269 0.286 1.00 . A A . 10 SER HB3 1 1 6 1888 1 1 10 SER HG H -0.775 -2.348 0.985 1.00 . A A . 10 SER HG 1 1 6 1889 1 1 10 SER N N 1.744 -2.884 3.164 1.00 . A A . 10 SER N 1 1 6 1890 1 1 10 SER O O 3.850 -2.922 0.449 1.00 . A A . 10 SER O 1 1 6 1891 1 1 10 SER OG O -0.362 -1.926 1.741 1.00 . A A . 10 SER OG 1 1 6 1892 1 1 11 CYS C C 6.324 -1.997 1.597 1.00 . A A . 11 CYS C 1 1 6 1893 1 1 11 CYS CA C 5.268 -0.938 1.963 1.00 . A A . 11 CYS CA 1 1 6 1894 1 1 11 CYS CB C 5.647 -0.296 3.278 1.00 . A A . 11 CYS CB 1 1 6 1895 1 1 11 CYS H H 3.298 -1.022 2.809 1.00 . A A . 11 CYS H 1 1 6 1896 1 1 11 CYS HA H 5.284 -0.170 1.206 1.00 . A A . 11 CYS HA 1 1 6 1897 1 1 11 CYS HB2 H 4.869 0.392 3.562 1.00 . A A . 11 CYS HB2 1 1 6 1898 1 1 11 CYS HB3 H 5.656 -1.090 4.008 1.00 . A A . 11 CYS HB3 1 1 6 1899 1 1 11 CYS N N 3.849 -1.420 2.104 1.00 . A A . 11 CYS N 1 1 6 1900 1 1 11 CYS O O 7.305 -1.697 0.942 1.00 . A A . 11 CYS O 1 1 6 1901 1 1 11 CYS SG S 7.230 0.556 3.466 1.00 . A A . 11 CYS SG 1 1 6 1902 1 1 12 ARG C C 6.763 -4.976 0.385 1.00 . A A . 12 ARG C 1 1 6 1903 1 1 12 ARG CA C 6.995 -4.354 1.780 1.00 . A A . 12 ARG CA 1 1 6 1904 1 1 12 ARG CB C 6.735 -5.355 2.945 1.00 . A A . 12 ARG CB 1 1 6 1905 1 1 12 ARG CD C 9.129 -6.368 3.066 1.00 . A A . 12 ARG CD 1 1 6 1906 1 1 12 ARG CG C 7.609 -6.649 2.959 1.00 . A A . 12 ARG CG 1 1 6 1907 1 1 12 ARG CZ C 10.855 -5.261 1.726 1.00 . A A . 12 ARG CZ 1 1 6 1908 1 1 12 ARG H H 5.252 -3.356 2.541 1.00 . A A . 12 ARG H 1 1 6 1909 1 1 12 ARG HA H 8.007 -3.985 1.832 1.00 . A A . 12 ARG HA 1 1 6 1910 1 1 12 ARG HB2 H 6.883 -4.835 3.881 1.00 . A A . 12 ARG HB2 1 1 6 1911 1 1 12 ARG HB3 H 5.698 -5.656 2.905 1.00 . A A . 12 ARG HB3 1 1 6 1912 1 1 12 ARG HD2 H 9.329 -5.741 3.923 1.00 . A A . 12 ARG HD2 1 1 6 1913 1 1 12 ARG HD3 H 9.668 -7.298 3.178 1.00 . A A . 12 ARG HD3 1 1 6 1914 1 1 12 ARG HE H 9.002 -5.529 1.085 1.00 . A A . 12 ARG HE 1 1 6 1915 1 1 12 ARG HG2 H 7.318 -7.227 3.823 1.00 . A A . 12 ARG HG2 1 1 6 1916 1 1 12 ARG HG3 H 7.408 -7.255 2.089 1.00 . A A . 12 ARG HG3 1 1 6 1917 1 1 12 ARG HH11 H 11.408 -5.897 3.544 1.00 . A A . 12 ARG HH11 1 1 6 1918 1 1 12 ARG HH12 H 12.645 -5.123 2.613 1.00 . A A . 12 ARG HH12 1 1 6 1919 1 1 12 ARG HH21 H 10.542 -4.543 -0.115 1.00 . A A . 12 ARG HH21 1 1 6 1920 1 1 12 ARG HH22 H 12.146 -4.341 0.505 1.00 . A A . 12 ARG HH22 1 1 6 1921 1 1 12 ARG N N 6.074 -3.203 2.035 1.00 . A A . 12 ARG N 1 1 6 1922 1 1 12 ARG NE N 9.617 -5.676 1.832 1.00 . A A . 12 ARG NE 1 1 6 1923 1 1 12 ARG NH1 N 11.701 -5.442 2.705 1.00 . A A . 12 ARG NH1 1 1 6 1924 1 1 12 ARG NH2 N 11.209 -4.669 0.619 1.00 . A A . 12 ARG NH2 1 1 6 1925 1 1 12 ARG O O 7.225 -6.065 0.106 1.00 . A A . 12 ARG O 1 1 6 1926 1 1 13 SER C C 6.541 -4.012 -2.932 1.00 . A A . 13 SER C 1 1 6 1927 1 1 13 SER CA C 5.771 -4.770 -1.842 1.00 . A A . 13 SER CA 1 1 6 1928 1 1 13 SER CB C 4.260 -4.647 -2.139 1.00 . A A . 13 SER CB 1 1 6 1929 1 1 13 SER H H 5.720 -3.388 -0.172 1.00 . A A . 13 SER H 1 1 6 1930 1 1 13 SER HA H 6.039 -5.814 -1.904 1.00 . A A . 13 SER HA 1 1 6 1931 1 1 13 SER HB2 H 4.008 -5.060 -3.105 1.00 . A A . 13 SER HB2 1 1 6 1932 1 1 13 SER HB3 H 3.672 -5.125 -1.370 1.00 . A A . 13 SER HB3 1 1 6 1933 1 1 13 SER HG H 4.224 -2.901 -2.997 1.00 . A A . 13 SER HG 1 1 6 1934 1 1 13 SER N N 6.059 -4.261 -0.459 1.00 . A A . 13 SER N 1 1 6 1935 1 1 13 SER O O 7.011 -2.906 -2.736 1.00 . A A . 13 SER O 1 1 6 1936 1 1 13 SER OG O 3.986 -3.252 -2.136 1.00 . A A . 13 SER OG 1 1 6 1937 1 1 14 ARG C C 6.508 -2.861 -5.630 1.00 . A A . 14 ARG C 1 1 6 1938 1 1 14 ARG CA C 7.333 -4.110 -5.259 1.00 . A A . 14 ARG CA 1 1 6 1939 1 1 14 ARG CB C 7.310 -5.218 -6.354 1.00 . A A . 14 ARG CB 1 1 6 1940 1 1 14 ARG CD C 7.613 -3.678 -8.412 1.00 . A A . 14 ARG CD 1 1 6 1941 1 1 14 ARG CG C 8.127 -4.904 -7.642 1.00 . A A . 14 ARG CG 1 1 6 1942 1 1 14 ARG CZ C 8.560 -2.406 -10.287 1.00 . A A . 14 ARG CZ 1 1 6 1943 1 1 14 ARG H H 6.221 -5.558 -4.129 1.00 . A A . 14 ARG H 1 1 6 1944 1 1 14 ARG HA H 8.341 -3.826 -4.992 1.00 . A A . 14 ARG HA 1 1 6 1945 1 1 14 ARG HB2 H 7.709 -6.124 -5.922 1.00 . A A . 14 ARG HB2 1 1 6 1946 1 1 14 ARG HB3 H 6.284 -5.412 -6.632 1.00 . A A . 14 ARG HB3 1 1 6 1947 1 1 14 ARG HD2 H 6.566 -3.773 -8.661 1.00 . A A . 14 ARG HD2 1 1 6 1948 1 1 14 ARG HD3 H 7.776 -2.788 -7.832 1.00 . A A . 14 ARG HD3 1 1 6 1949 1 1 14 ARG HE H 8.849 -4.352 -10.040 1.00 . A A . 14 ARG HE 1 1 6 1950 1 1 14 ARG HG2 H 9.160 -4.737 -7.368 1.00 . A A . 14 ARG HG2 1 1 6 1951 1 1 14 ARG HG3 H 8.092 -5.766 -8.292 1.00 . A A . 14 ARG HG3 1 1 6 1952 1 1 14 ARG HH11 H 7.452 -1.350 -8.989 1.00 . A A . 14 ARG HH11 1 1 6 1953 1 1 14 ARG HH12 H 8.124 -0.453 -10.310 1.00 . A A . 14 ARG HH12 1 1 6 1954 1 1 14 ARG HH21 H 9.696 -3.234 -11.709 1.00 . A A . 14 ARG HH21 1 1 6 1955 1 1 14 ARG HH22 H 9.414 -1.533 -11.878 1.00 . A A . 14 ARG HH22 1 1 6 1956 1 1 14 ARG N N 6.630 -4.670 -4.064 1.00 . A A . 14 ARG N 1 1 6 1957 1 1 14 ARG NE N 8.416 -3.554 -9.668 1.00 . A A . 14 ARG NE 1 1 6 1958 1 1 14 ARG NH1 N 8.001 -1.318 -9.824 1.00 . A A . 14 ARG NH1 1 1 6 1959 1 1 14 ARG NH2 N 9.279 -2.388 -11.377 1.00 . A A . 14 ARG NH2 1 1 6 1960 1 1 14 ARG O O 7.045 -1.824 -5.966 1.00 . A A . 14 ARG O 1 1 6 1961 1 1 15 GLN C C 4.586 -0.672 -5.005 1.00 . A A . 15 GLN C 1 1 6 1962 1 1 15 GLN CA C 4.254 -1.911 -5.856 1.00 . A A . 15 GLN CA 1 1 6 1963 1 1 15 GLN CB C 2.827 -2.414 -5.561 1.00 . A A . 15 GLN CB 1 1 6 1964 1 1 15 GLN CD C 0.386 -1.881 -5.574 1.00 . A A . 15 GLN CD 1 1 6 1965 1 1 15 GLN CG C 1.780 -1.325 -5.880 1.00 . A A . 15 GLN CG 1 1 6 1966 1 1 15 GLN H H 4.853 -3.884 -5.255 1.00 . A A . 15 GLN H 1 1 6 1967 1 1 15 GLN HA H 4.353 -1.657 -6.903 1.00 . A A . 15 GLN HA 1 1 6 1968 1 1 15 GLN HB2 H 2.630 -3.288 -6.162 1.00 . A A . 15 GLN HB2 1 1 6 1969 1 1 15 GLN HB3 H 2.753 -2.693 -4.519 1.00 . A A . 15 GLN HB3 1 1 6 1970 1 1 15 GLN HE21 H 0.655 -1.809 -3.608 1.00 . A A . 15 GLN HE21 1 1 6 1971 1 1 15 GLN HE22 H -0.855 -2.399 -4.113 1.00 . A A . 15 GLN HE22 1 1 6 1972 1 1 15 GLN HG2 H 1.939 -0.446 -5.272 1.00 . A A . 15 GLN HG2 1 1 6 1973 1 1 15 GLN HG3 H 1.826 -1.046 -6.924 1.00 . A A . 15 GLN HG3 1 1 6 1974 1 1 15 GLN N N 5.209 -3.017 -5.539 1.00 . A A . 15 GLN N 1 1 6 1975 1 1 15 GLN NE2 N 0.032 -2.044 -4.328 1.00 . A A . 15 GLN NE2 1 1 6 1976 1 1 15 GLN O O 4.420 0.442 -5.460 1.00 . A A . 15 GLN O 1 1 6 1977 1 1 15 GLN OE1 O -0.393 -2.175 -6.459 1.00 . A A . 15 GLN OE1 1 1 6 1978 1 1 16 CYS C C 6.863 0.645 -2.997 1.00 . A A . 16 CYS C 1 1 6 1979 1 1 16 CYS CA C 5.402 0.201 -2.881 1.00 . A A . 16 CYS CA 1 1 6 1980 1 1 16 CYS CB C 5.144 -0.205 -1.444 1.00 . A A . 16 CYS CB 1 1 6 1981 1 1 16 CYS H H 5.151 -1.842 -3.500 1.00 . A A . 16 CYS H 1 1 6 1982 1 1 16 CYS HA H 4.760 1.033 -3.096 1.00 . A A . 16 CYS HA 1 1 6 1983 1 1 16 CYS HB2 H 5.743 -1.056 -1.185 1.00 . A A . 16 CYS HB2 1 1 6 1984 1 1 16 CYS HB3 H 5.475 0.612 -0.819 1.00 . A A . 16 CYS HB3 1 1 6 1985 1 1 16 CYS N N 5.043 -0.917 -3.800 1.00 . A A . 16 CYS N 1 1 6 1986 1 1 16 CYS O O 7.219 1.691 -2.492 1.00 . A A . 16 CYS O 1 1 6 1987 1 1 16 CYS SG S 3.443 -0.569 -0.961 1.00 . A A . 16 CYS SG 1 1 6 1988 1 1 17 LYS C C 9.316 1.599 -4.437 1.00 . A A . 17 LYS C 1 1 6 1989 1 1 17 LYS CA C 9.109 0.184 -3.825 1.00 . A A . 17 LYS CA 1 1 6 1990 1 1 17 LYS CB C 9.759 -0.908 -4.724 1.00 . A A . 17 LYS CB 1 1 6 1991 1 1 17 LYS CD C 12.058 -0.683 -3.621 1.00 . A A . 17 LYS CD 1 1 6 1992 1 1 17 LYS CE C 13.558 -0.462 -3.898 1.00 . A A . 17 LYS CE 1 1 6 1993 1 1 17 LYS CG C 11.272 -0.661 -4.956 1.00 . A A . 17 LYS CG 1 1 6 1994 1 1 17 LYS H H 7.310 -0.993 -4.027 1.00 . A A . 17 LYS H 1 1 6 1995 1 1 17 LYS HA H 9.569 0.157 -2.849 1.00 . A A . 17 LYS HA 1 1 6 1996 1 1 17 LYS HB2 H 9.621 -1.874 -4.258 1.00 . A A . 17 LYS HB2 1 1 6 1997 1 1 17 LYS HB3 H 9.277 -0.935 -5.687 1.00 . A A . 17 LYS HB3 1 1 6 1998 1 1 17 LYS HD2 H 11.709 0.103 -2.966 1.00 . A A . 17 LYS HD2 1 1 6 1999 1 1 17 LYS HD3 H 11.920 -1.633 -3.124 1.00 . A A . 17 LYS HD3 1 1 6 2000 1 1 17 LYS HE2 H 13.714 0.485 -4.395 1.00 . A A . 17 LYS HE2 1 1 6 2001 1 1 17 LYS HE3 H 14.109 -0.465 -2.969 1.00 . A A . 17 LYS HE3 1 1 6 2002 1 1 17 LYS HG2 H 11.647 -1.440 -5.604 1.00 . A A . 17 LYS HG2 1 1 6 2003 1 1 17 LYS HG3 H 11.418 0.286 -5.453 1.00 . A A . 17 LYS HG3 1 1 6 2004 1 1 17 LYS HZ1 H 13.785 -2.471 -4.397 1.00 . A A . 17 LYS HZ1 1 1 6 2005 1 1 17 LYS HZ2 H 15.130 -1.506 -4.778 1.00 . A A . 17 LYS HZ2 1 1 6 2006 1 1 17 LYS HZ3 H 13.729 -1.426 -5.735 1.00 . A A . 17 LYS HZ3 1 1 6 2007 1 1 17 LYS N N 7.664 -0.158 -3.652 1.00 . A A . 17 LYS N 1 1 6 2008 1 1 17 LYS NZ N 14.091 -1.550 -4.768 1.00 . A A . 17 LYS NZ 1 1 6 2009 1 1 17 LYS O O 10.132 2.340 -3.924 1.00 . A A . 17 LYS O 1 1 6 2010 1 1 18 HYP C C 8.134 4.443 -5.264 1.00 . A A . 18 HYP C 1 1 6 2011 1 1 18 HYP CA C 8.726 3.289 -6.105 1.00 . A A . 18 HYP CA 1 1 6 2012 1 1 18 HYP CB C 8.052 3.140 -7.467 1.00 . A A . 18 HYP CB 1 1 6 2013 1 1 18 HYP CD C 7.604 1.145 -6.229 1.00 . A A . 18 HYP CD 1 1 6 2014 1 1 18 HYP CG C 7.016 2.098 -7.234 1.00 . A A . 18 HYP CG 1 1 6 2015 1 1 18 HYP HA H 9.765 3.520 -6.284 1.00 . A A . 18 HYP HA 1 1 6 2016 1 1 18 HYP HB2 H 8.777 2.839 -8.210 1.00 . A A . 18 HYP HB2 1 1 6 2017 1 1 18 HYP HB3 H 7.620 4.076 -7.789 1.00 . A A . 18 HYP HB3 1 1 6 2018 1 1 18 HYP HD1 H 7.483 0.901 -8.697 1.00 . A A . 18 HYP HD1 1 1 6 2019 1 1 18 HYP HD22 H 8.076 0.324 -6.744 1.00 . A A . 18 HYP HD22 1 1 6 2020 1 1 18 HYP HD23 H 6.818 0.794 -5.584 1.00 . A A . 18 HYP HD23 1 1 6 2021 1 1 18 HYP HG H 6.121 2.555 -6.837 1.00 . A A . 18 HYP HG 1 1 6 2022 1 1 18 HYP N N 8.601 1.951 -5.489 1.00 . A A . 18 HYP N 1 1 6 2023 1 1 18 HYP O O 8.194 5.576 -5.703 1.00 . A A . 18 HYP O 1 1 6 2024 1 1 18 HYP OD1 O 6.714 1.415 -8.443 1.00 . A A . 18 HYP OD1 1 1 6 2025 1 1 19 HIS C C 8.112 5.927 -2.481 1.00 . A A . 19 HIS C 1 1 6 2026 1 1 19 HIS CA C 7.003 5.223 -3.253 1.00 . A A . 19 HIS CA 1 1 6 2027 1 1 19 HIS CB C 5.999 4.636 -2.238 1.00 . A A . 19 HIS CB 1 1 6 2028 1 1 19 HIS CD2 C 4.713 3.216 -4.080 1.00 . A A . 19 HIS CD2 1 1 6 2029 1 1 19 HIS CE1 C 2.784 3.511 -3.384 1.00 . A A . 19 HIS CE1 1 1 6 2030 1 1 19 HIS CG C 4.794 4.013 -2.953 1.00 . A A . 19 HIS CG 1 1 6 2031 1 1 19 HIS H H 7.572 3.209 -3.792 1.00 . A A . 19 HIS H 1 1 6 2032 1 1 19 HIS HA H 6.503 5.942 -3.886 1.00 . A A . 19 HIS HA 1 1 6 2033 1 1 19 HIS HB2 H 6.473 3.879 -1.632 1.00 . A A . 19 HIS HB2 1 1 6 2034 1 1 19 HIS HB3 H 5.638 5.420 -1.587 1.00 . A A . 19 HIS HB3 1 1 6 2035 1 1 19 HIS HD1 H 3.272 4.669 -1.797 1.00 . A A . 19 HIS HD1 1 1 6 2036 1 1 19 HIS HD2 H 5.556 2.883 -4.661 1.00 . A A . 19 HIS HD2 1 1 6 2037 1 1 19 HIS HE1 H 1.709 3.473 -3.284 1.00 . A A . 19 HIS HE1 1 1 6 2038 1 1 19 HIS N N 7.592 4.138 -4.107 1.00 . A A . 19 HIS N 1 1 6 2039 1 1 19 HIS ND1 N 3.566 4.153 -2.577 1.00 . A A . 19 HIS ND1 1 1 6 2040 1 1 19 HIS NE2 N 3.455 2.913 -4.335 1.00 . A A . 19 HIS NE2 1 1 6 2041 1 1 19 HIS O O 9.074 5.301 -2.087 1.00 . A A . 19 HIS O 1 1 6 2042 1 1 20 ARG C C 8.973 7.562 -0.059 1.00 . A A . 20 ARG C 1 1 6 2043 1 1 20 ARG CA C 8.976 8.000 -1.534 1.00 . A A . 20 ARG CA 1 1 6 2044 1 1 20 ARG CB C 8.631 9.495 -1.652 1.00 . A A . 20 ARG CB 1 1 6 2045 1 1 20 ARG CD C 8.304 11.384 -3.291 1.00 . A A . 20 ARG CD 1 1 6 2046 1 1 20 ARG CG C 8.665 9.897 -3.141 1.00 . A A . 20 ARG CG 1 1 6 2047 1 1 20 ARG CZ C 7.389 11.381 -5.573 1.00 . A A . 20 ARG CZ 1 1 6 2048 1 1 20 ARG H H 7.149 7.657 -2.633 1.00 . A A . 20 ARG H 1 1 6 2049 1 1 20 ARG HA H 9.951 7.803 -1.956 1.00 . A A . 20 ARG HA 1 1 6 2050 1 1 20 ARG HB2 H 7.648 9.678 -1.244 1.00 . A A . 20 ARG HB2 1 1 6 2051 1 1 20 ARG HB3 H 9.353 10.080 -1.099 1.00 . A A . 20 ARG HB3 1 1 6 2052 1 1 20 ARG HD2 H 7.318 11.588 -2.903 1.00 . A A . 20 ARG HD2 1 1 6 2053 1 1 20 ARG HD3 H 9.023 12.000 -2.770 1.00 . A A . 20 ARG HD3 1 1 6 2054 1 1 20 ARG HE H 9.112 12.236 -5.095 1.00 . A A . 20 ARG HE 1 1 6 2055 1 1 20 ARG HG2 H 9.656 9.729 -3.540 1.00 . A A . 20 ARG HG2 1 1 6 2056 1 1 20 ARG HG3 H 7.964 9.296 -3.701 1.00 . A A . 20 ARG HG3 1 1 6 2057 1 1 20 ARG HH11 H 6.277 10.457 -4.181 1.00 . A A . 20 ARG HH11 1 1 6 2058 1 1 20 ARG HH12 H 5.630 10.448 -5.786 1.00 . A A . 20 ARG HH12 1 1 6 2059 1 1 20 ARG HH21 H 8.309 12.233 -7.131 1.00 . A A . 20 ARG HH21 1 1 6 2060 1 1 20 ARG HH22 H 6.794 11.467 -7.482 1.00 . A A . 20 ARG HH22 1 1 6 2061 1 1 20 ARG N N 7.949 7.210 -2.285 1.00 . A A . 20 ARG N 1 1 6 2062 1 1 20 ARG NE N 8.346 11.732 -4.748 1.00 . A A . 20 ARG NE 1 1 6 2063 1 1 20 ARG NH1 N 6.352 10.710 -5.146 1.00 . A A . 20 ARG NH1 1 1 6 2064 1 1 20 ARG NH2 N 7.506 11.720 -6.826 1.00 . A A . 20 ARG NH2 1 1 6 2065 1 1 20 ARG O O 9.923 7.787 0.666 1.00 . A A . 20 ARG O 1 1 6 2066 1 1 21 CYS C C 8.335 5.061 1.910 1.00 . A A . 21 CYS C 1 1 6 2067 1 1 21 CYS CA C 7.700 6.438 1.714 1.00 . A A . 21 CYS CA 1 1 6 2068 1 1 21 CYS CB C 6.249 6.321 2.004 1.00 . A A . 21 CYS CB 1 1 6 2069 1 1 21 CYS H H 7.166 6.799 -0.330 1.00 . A A . 21 CYS H 1 1 6 2070 1 1 21 CYS HA H 8.066 7.142 2.432 1.00 . A A . 21 CYS HA 1 1 6 2071 1 1 21 CYS HB2 H 5.821 5.578 1.347 1.00 . A A . 21 CYS HB2 1 1 6 2072 1 1 21 CYS HB3 H 6.138 5.968 3.019 1.00 . A A . 21 CYS HB3 1 1 6 2073 1 1 21 CYS N N 7.885 6.941 0.322 1.00 . A A . 21 CYS N 1 1 6 2074 1 1 21 CYS O O 8.688 4.682 3.010 1.00 . A A . 21 CYS O 1 1 6 2075 1 1 21 CYS SG S 5.257 7.819 1.851 1.00 . A A . 21 CYS SG 1 1 6 2076 1 1 22 . C C 9.878 2.862 -0.463 1.00 . A A . 22 CY3 C 1 1 6 2077 1 1 22 . CA C 9.038 2.997 0.797 1.00 . A A . 22 CY3 CA 1 1 6 2078 1 1 22 . CB C 7.830 2.052 0.865 1.00 . A A . 22 CY3 CB 1 1 6 2079 1 1 22 . H H 8.157 4.748 -0.044 1.00 . A A . 22 CY3 H 1 1 6 2080 1 1 22 . HA H 9.677 2.862 1.658 1.00 . A A . 22 CY3 HA 1 1 6 2081 1 1 22 . HB2 H 8.144 1.029 0.735 1.00 . A A . 22 CY3 HB2 1 1 6 2082 1 1 22 . HB3 H 7.153 2.290 0.058 1.00 . A A . 22 CY3 HB3 1 1 6 2083 1 1 22 . HN11 H 10.738 4.609 -0.108 1.00 . A A . 22 CY3 HN11 1 1 6 2084 1 1 22 . HN12 H 11.255 3.833 -1.514 1.00 . A A . 22 CY3 HN12 1 1 6 2085 1 1 22 . N N 8.454 4.365 0.808 1.00 . A A . 22 CY3 N 1 1 6 2086 1 1 22 . N1 N 10.694 3.846 -0.720 1.00 . A A . 22 CY3 N1 1 1 6 2087 1 1 22 . O O 9.803 1.904 -1.204 1.00 . A A . 22 CY3 O 1 1 6 2088 1 1 22 . SG S 6.920 2.251 2.418 1.00 . A A . 22 CY3 SG 1 1 7 2089 1 1 1 PCA C C -3.168 4.513 -1.454 1.00 . A A . 1 PCA C 1 1 7 2090 1 1 1 PCA CA C -4.680 4.564 -1.707 1.00 . A A . 1 PCA CA 1 1 7 2091 1 1 1 PCA CB C -5.463 3.684 -0.729 1.00 . A A . 1 PCA CB 1 1 7 2092 1 1 1 PCA CD C -5.628 2.747 -2.926 1.00 . A A . 1 PCA CD 1 1 7 2093 1 1 1 PCA CG C -5.726 2.374 -1.462 1.00 . A A . 1 PCA CG 1 1 7 2094 1 1 1 PCA HA H -5.017 5.587 -1.620 1.00 . A A . 1 PCA HA 1 1 7 2095 1 1 1 PCA HB2 H -6.384 4.176 -0.454 1.00 . A A . 1 PCA HB2 1 1 7 2096 1 1 1 PCA HB3 H -4.896 3.524 0.177 1.00 . A A . 1 PCA HB3 1 1 7 2097 1 1 1 PCA HG2 H -6.715 2.006 -1.228 1.00 . A A . 1 PCA HG2 1 1 7 2098 1 1 1 PCA HG3 H -4.976 1.642 -1.205 1.00 . A A . 1 PCA HG3 1 1 7 2099 1 1 1 PCA N N -5.025 4.072 -3.056 1.00 . A A . 1 PCA N 1 1 7 2100 1 1 1 PCA O O -2.437 3.943 -2.242 1.00 . A A . 1 PCA O 1 1 7 2101 1 1 1 PCA OE O -5.995 2.042 -3.844 1.00 . A A . 1 PCA OE 1 1 7 2102 1 1 2 ARG C C -1.080 4.152 1.168 1.00 . A A . 2 ARG C 1 1 7 2103 1 1 2 ARG CA C -1.324 5.143 0.019 1.00 . A A . 2 ARG CA 1 1 7 2104 1 1 2 ARG CB C -0.967 6.593 0.429 1.00 . A A . 2 ARG CB 1 1 7 2105 1 1 2 ARG CD C -0.851 8.969 -0.422 1.00 . A A . 2 ARG CD 1 1 7 2106 1 1 2 ARG CG C -1.214 7.520 -0.782 1.00 . A A . 2 ARG CG 1 1 7 2107 1 1 2 ARG CZ C -2.313 10.267 -1.913 1.00 . A A . 2 ARG CZ 1 1 7 2108 1 1 2 ARG H H -3.429 5.547 0.218 1.00 . A A . 2 ARG H 1 1 7 2109 1 1 2 ARG HA H -0.717 4.840 -0.822 1.00 . A A . 2 ARG HA 1 1 7 2110 1 1 2 ARG HB2 H -1.579 6.902 1.264 1.00 . A A . 2 ARG HB2 1 1 7 2111 1 1 2 ARG HB3 H 0.071 6.645 0.723 1.00 . A A . 2 ARG HB3 1 1 7 2112 1 1 2 ARG HD2 H -1.435 9.326 0.414 1.00 . A A . 2 ARG HD2 1 1 7 2113 1 1 2 ARG HD3 H 0.198 9.041 -0.174 1.00 . A A . 2 ARG HD3 1 1 7 2114 1 1 2 ARG HE H -0.367 10.059 -2.212 1.00 . A A . 2 ARG HE 1 1 7 2115 1 1 2 ARG HG2 H -0.609 7.197 -1.617 1.00 . A A . 2 ARG HG2 1 1 7 2116 1 1 2 ARG HG3 H -2.253 7.474 -1.074 1.00 . A A . 2 ARG HG3 1 1 7 2117 1 1 2 ARG HH11 H -3.220 9.413 -0.340 1.00 . A A . 2 ARG HH11 1 1 7 2118 1 1 2 ARG HH12 H -4.245 10.327 -1.393 1.00 . A A . 2 ARG HH12 1 1 7 2119 1 1 2 ARG HH21 H -1.647 11.208 -3.547 1.00 . A A . 2 ARG HH21 1 1 7 2120 1 1 2 ARG HH22 H -3.344 11.359 -3.236 1.00 . A A . 2 ARG HH22 1 1 7 2121 1 1 2 ARG N N -2.770 5.112 -0.361 1.00 . A A . 2 ARG N 1 1 7 2122 1 1 2 ARG NE N -1.113 9.824 -1.623 1.00 . A A . 2 ARG NE 1 1 7 2123 1 1 2 ARG NH1 N -3.338 9.979 -1.155 1.00 . A A . 2 ARG NH1 1 1 7 2124 1 1 2 ARG NH2 N -2.446 11.003 -2.983 1.00 . A A . 2 ARG NH2 1 1 7 2125 1 1 2 ARG O O -0.355 4.428 2.104 1.00 . A A . 2 ARG O 1 1 7 2126 1 1 3 LEU C C -0.187 1.651 2.489 1.00 . A A . 3 LEU C 1 1 7 2127 1 1 3 LEU CA C -1.636 1.896 2.019 1.00 . A A . 3 LEU CA 1 1 7 2128 1 1 3 LEU CB C -2.240 0.618 1.342 1.00 . A A . 3 LEU CB 1 1 7 2129 1 1 3 LEU CD1 C -2.232 -1.162 -0.461 1.00 . A A . 3 LEU CD1 1 1 7 2130 1 1 3 LEU CD2 C -1.523 1.135 -1.130 1.00 . A A . 3 LEU CD2 1 1 7 2131 1 1 3 LEU CG C -1.516 0.114 0.036 1.00 . A A . 3 LEU CG 1 1 7 2132 1 1 3 LEU H H -2.284 2.903 0.236 1.00 . A A . 3 LEU H 1 1 7 2133 1 1 3 LEU HA H -2.236 2.161 2.877 1.00 . A A . 3 LEU HA 1 1 7 2134 1 1 3 LEU HB2 H -2.208 -0.188 2.057 1.00 . A A . 3 LEU HB2 1 1 7 2135 1 1 3 LEU HB3 H -3.278 0.811 1.113 1.00 . A A . 3 LEU HB3 1 1 7 2136 1 1 3 LEU HD11 H -2.195 -1.933 0.294 1.00 . A A . 3 LEU HD11 1 1 7 2137 1 1 3 LEU HD12 H -1.754 -1.535 -1.354 1.00 . A A . 3 LEU HD12 1 1 7 2138 1 1 3 LEU HD13 H -3.267 -0.947 -0.686 1.00 . A A . 3 LEU HD13 1 1 7 2139 1 1 3 LEU HD21 H -1.027 0.704 -1.988 1.00 . A A . 3 LEU HD21 1 1 7 2140 1 1 3 LEU HD22 H -0.998 2.039 -0.872 1.00 . A A . 3 LEU HD22 1 1 7 2141 1 1 3 LEU HD23 H -2.537 1.385 -1.407 1.00 . A A . 3 LEU HD23 1 1 7 2142 1 1 3 LEU HG H -0.491 -0.128 0.260 1.00 . A A . 3 LEU HG 1 1 7 2143 1 1 3 LEU N N -1.721 3.018 1.029 1.00 . A A . 3 LEU N 1 1 7 2144 1 1 3 LEU O O 0.085 1.510 3.665 1.00 . A A . 3 LEU O 1 1 7 2145 1 1 4 CYS C C 2.742 2.289 2.764 1.00 . A A . 4 CYS C 1 1 7 2146 1 1 4 CYS CA C 2.141 1.400 1.659 1.00 . A A . 4 CYS CA 1 1 7 2147 1 1 4 CYS CB C 2.804 1.734 0.318 1.00 . A A . 4 CYS CB 1 1 7 2148 1 1 4 CYS H H 0.330 1.713 0.608 1.00 . A A . 4 CYS H 1 1 7 2149 1 1 4 CYS HA H 2.340 0.374 1.909 1.00 . A A . 4 CYS HA 1 1 7 2150 1 1 4 CYS HB2 H 2.813 2.799 0.171 1.00 . A A . 4 CYS HB2 1 1 7 2151 1 1 4 CYS HB3 H 3.839 1.437 0.392 1.00 . A A . 4 CYS HB3 1 1 7 2152 1 1 4 CYS N N 0.675 1.611 1.510 1.00 . A A . 4 CYS N 1 1 7 2153 1 1 4 CYS O O 3.217 1.802 3.773 1.00 . A A . 4 CYS O 1 1 7 2154 1 1 4 CYS SG S 2.169 1.033 -1.225 1.00 . A A . 4 CYS SG 1 1 7 2155 1 1 5 CYS C C 2.420 4.628 4.782 1.00 . A A . 5 CYS C 1 1 7 2156 1 1 5 CYS CA C 3.235 4.580 3.484 1.00 . A A . 5 CYS CA 1 1 7 2157 1 1 5 CYS CB C 3.217 5.972 2.831 1.00 . A A . 5 CYS CB 1 1 7 2158 1 1 5 CYS H H 2.277 3.883 1.686 1.00 . A A . 5 CYS H 1 1 7 2159 1 1 5 CYS HA H 4.254 4.310 3.723 1.00 . A A . 5 CYS HA 1 1 7 2160 1 1 5 CYS HB2 H 3.641 5.895 1.840 1.00 . A A . 5 CYS HB2 1 1 7 2161 1 1 5 CYS HB3 H 2.193 6.301 2.725 1.00 . A A . 5 CYS HB3 1 1 7 2162 1 1 5 CYS N N 2.689 3.576 2.520 1.00 . A A . 5 CYS N 1 1 7 2163 1 1 5 CYS O O 2.975 4.735 5.859 1.00 . A A . 5 CYS O 1 1 7 2164 1 1 5 CYS SG S 4.126 7.254 3.729 1.00 . A A . 5 CYS SG 1 1 7 2165 1 1 6 GLY C C 0.531 3.479 6.800 1.00 . A A . 6 GLY C 1 1 7 2166 1 1 6 GLY CA C 0.187 4.576 5.793 1.00 . A A . 6 GLY CA 1 1 7 2167 1 1 6 GLY H H 0.759 4.456 3.724 1.00 . A A . 6 GLY H 1 1 7 2168 1 1 6 GLY HA2 H 0.255 5.540 6.276 1.00 . A A . 6 GLY HA2 1 1 7 2169 1 1 6 GLY HA3 H -0.822 4.425 5.438 1.00 . A A . 6 GLY HA3 1 1 7 2170 1 1 6 GLY N N 1.122 4.544 4.627 1.00 . A A . 6 GLY N 1 1 7 2171 1 1 6 GLY O O 0.447 3.685 7.996 1.00 . A A . 6 GLY O 1 1 7 2172 1 1 7 PHE C C 2.135 0.138 6.378 1.00 . A A . 7 PHE C 1 1 7 2173 1 1 7 PHE CA C 1.279 1.184 7.132 1.00 . A A . 7 PHE CA 1 1 7 2174 1 1 7 PHE CB C -0.028 0.544 7.674 1.00 . A A . 7 PHE CB 1 1 7 2175 1 1 7 PHE CD1 C -0.855 -1.079 5.922 1.00 . A A . 7 PHE CD1 1 1 7 2176 1 1 7 PHE CD2 C -2.000 0.996 6.148 1.00 . A A . 7 PHE CD2 1 1 7 2177 1 1 7 PHE CE1 C -1.719 -1.451 4.914 1.00 . A A . 7 PHE CE1 1 1 7 2178 1 1 7 PHE CE2 C -2.866 0.627 5.141 1.00 . A A . 7 PHE CE2 1 1 7 2179 1 1 7 PHE CG C -0.987 0.143 6.545 1.00 . A A . 7 PHE CG 1 1 7 2180 1 1 7 PHE CZ C -2.726 -0.596 4.525 1.00 . A A . 7 PHE CZ 1 1 7 2181 1 1 7 PHE H H 0.953 2.258 5.297 1.00 . A A . 7 PHE H 1 1 7 2182 1 1 7 PHE HA H 1.845 1.570 7.965 1.00 . A A . 7 PHE HA 1 1 7 2183 1 1 7 PHE HB2 H 0.212 -0.337 8.252 1.00 . A A . 7 PHE HB2 1 1 7 2184 1 1 7 PHE HB3 H -0.530 1.244 8.326 1.00 . A A . 7 PHE HB3 1 1 7 2185 1 1 7 PHE HD1 H -0.065 -1.742 6.230 1.00 . A A . 7 PHE HD1 1 1 7 2186 1 1 7 PHE HD2 H -2.115 1.958 6.626 1.00 . A A . 7 PHE HD2 1 1 7 2187 1 1 7 PHE HE1 H -1.608 -2.410 4.431 1.00 . A A . 7 PHE HE1 1 1 7 2188 1 1 7 PHE HE2 H -3.656 1.298 4.835 1.00 . A A . 7 PHE HE2 1 1 7 2189 1 1 7 PHE HZ H -3.407 -0.887 3.739 1.00 . A A . 7 PHE HZ 1 1 7 2190 1 1 7 PHE N N 0.909 2.343 6.271 1.00 . A A . 7 PHE N 1 1 7 2191 1 1 7 PHE O O 1.871 -0.209 5.238 1.00 . A A . 7 PHE O 1 1 7 2192 1 1 8 HYP C C 3.893 -2.401 5.842 1.00 . A A . 8 HYP C 1 1 7 2193 1 1 8 HYP CA C 4.284 -1.043 6.436 1.00 . A A . 8 HYP CA 1 1 7 2194 1 1 8 HYP CB C 5.323 -1.155 7.546 1.00 . A A . 8 HYP CB 1 1 7 2195 1 1 8 HYP CD C 3.339 -0.288 8.534 1.00 . A A . 8 HYP CD 1 1 7 2196 1 1 8 HYP CG C 4.490 -1.226 8.779 1.00 . A A . 8 HYP CG 1 1 7 2197 1 1 8 HYP HA H 4.703 -0.432 5.653 1.00 . A A . 8 HYP HA 1 1 7 2198 1 1 8 HYP HB2 H 5.970 -0.289 7.538 1.00 . A A . 8 HYP HB2 1 1 7 2199 1 1 8 HYP HB3 H 5.938 -2.032 7.417 1.00 . A A . 8 HYP HB3 1 1 7 2200 1 1 8 HYP HD1 H 5.657 0.028 9.701 1.00 . A A . 8 HYP HD1 1 1 7 2201 1 1 8 HYP HD22 H 3.596 0.712 8.853 1.00 . A A . 8 HYP HD22 1 1 7 2202 1 1 8 HYP HD23 H 2.456 -0.636 9.052 1.00 . A A . 8 HYP HD23 1 1 7 2203 1 1 8 HYP HG H 4.131 -2.234 8.922 1.00 . A A . 8 HYP HG 1 1 7 2204 1 1 8 HYP N N 3.150 -0.344 7.066 1.00 . A A . 8 HYP N 1 1 7 2205 1 1 8 HYP O O 4.719 -3.056 5.237 1.00 . A A . 8 HYP O 1 1 7 2206 1 1 8 HYP OD1 O 5.245 -0.814 9.910 1.00 . A A . 8 HYP OD1 1 1 7 2207 1 1 9 LYS C C 2.214 -4.034 3.980 1.00 . A A . 9 LYS C 1 1 7 2208 1 1 9 LYS CA C 2.157 -4.065 5.506 1.00 . A A . 9 LYS CA 1 1 7 2209 1 1 9 LYS CB C 0.702 -4.306 5.963 1.00 . A A . 9 LYS CB 1 1 7 2210 1 1 9 LYS CD C 1.478 -5.191 8.242 1.00 . A A . 9 LYS CD 1 1 7 2211 1 1 9 LYS CE C 1.325 -5.006 9.762 1.00 . A A . 9 LYS CE 1 1 7 2212 1 1 9 LYS CG C 0.574 -4.173 7.505 1.00 . A A . 9 LYS CG 1 1 7 2213 1 1 9 LYS H H 2.038 -2.181 6.530 1.00 . A A . 9 LYS H 1 1 7 2214 1 1 9 LYS HA H 2.803 -4.857 5.859 1.00 . A A . 9 LYS HA 1 1 7 2215 1 1 9 LYS HB2 H 0.036 -3.619 5.467 1.00 . A A . 9 LYS HB2 1 1 7 2216 1 1 9 LYS HB3 H 0.411 -5.307 5.677 1.00 . A A . 9 LYS HB3 1 1 7 2217 1 1 9 LYS HD2 H 1.199 -6.198 7.968 1.00 . A A . 9 LYS HD2 1 1 7 2218 1 1 9 LYS HD3 H 2.514 -5.036 7.978 1.00 . A A . 9 LYS HD3 1 1 7 2219 1 1 9 LYS HE2 H 0.298 -5.159 10.060 1.00 . A A . 9 LYS HE2 1 1 7 2220 1 1 9 LYS HE3 H 1.951 -5.714 10.287 1.00 . A A . 9 LYS HE3 1 1 7 2221 1 1 9 LYS HG2 H 0.836 -3.168 7.804 1.00 . A A . 9 LYS HG2 1 1 7 2222 1 1 9 LYS HG3 H -0.456 -4.347 7.784 1.00 . A A . 9 LYS HG3 1 1 7 2223 1 1 9 LYS HZ1 H 2.503 -3.302 9.533 1.00 . A A . 9 LYS HZ1 1 1 7 2224 1 1 9 LYS HZ2 H 2.070 -3.632 11.142 1.00 . A A . 9 LYS HZ2 1 1 7 2225 1 1 9 LYS HZ3 H 0.925 -2.985 10.067 1.00 . A A . 9 LYS HZ3 1 1 7 2226 1 1 9 LYS N N 2.650 -2.764 6.036 1.00 . A A . 9 LYS N 1 1 7 2227 1 1 9 LYS NZ N 1.737 -3.628 10.156 1.00 . A A . 9 LYS NZ 1 1 7 2228 1 1 9 LYS O O 2.541 -5.045 3.388 1.00 . A A . 9 LYS O 1 1 7 2229 1 1 10 SER C C 3.352 -2.395 1.421 1.00 . A A . 10 SER C 1 1 7 2230 1 1 10 SER CA C 1.967 -2.873 1.882 1.00 . A A . 10 SER CA 1 1 7 2231 1 1 10 SER CB C 0.859 -1.940 1.392 1.00 . A A . 10 SER CB 1 1 7 2232 1 1 10 SER H H 1.645 -2.078 3.848 1.00 . A A . 10 SER H 1 1 7 2233 1 1 10 SER HA H 1.795 -3.864 1.486 1.00 . A A . 10 SER HA 1 1 7 2234 1 1 10 SER HB2 H 0.918 -0.967 1.844 1.00 . A A . 10 SER HB2 1 1 7 2235 1 1 10 SER HB3 H 0.843 -1.866 0.315 1.00 . A A . 10 SER HB3 1 1 7 2236 1 1 10 SER HG H -0.683 -3.093 1.124 1.00 . A A . 10 SER HG 1 1 7 2237 1 1 10 SER N N 1.909 -2.904 3.374 1.00 . A A . 10 SER N 1 1 7 2238 1 1 10 SER O O 3.773 -2.714 0.331 1.00 . A A . 10 SER O 1 1 7 2239 1 1 10 SER OG O -0.332 -2.566 1.846 1.00 . A A . 10 SER OG 1 1 7 2240 1 1 11 CYS C C 6.428 -2.122 1.498 1.00 . A A . 11 CYS C 1 1 7 2241 1 1 11 CYS CA C 5.386 -1.095 1.991 1.00 . A A . 11 CYS CA 1 1 7 2242 1 1 11 CYS CB C 5.854 -0.439 3.283 1.00 . A A . 11 CYS CB 1 1 7 2243 1 1 11 CYS H H 3.598 -1.452 3.136 1.00 . A A . 11 CYS H 1 1 7 2244 1 1 11 CYS HA H 5.285 -0.330 1.236 1.00 . A A . 11 CYS HA 1 1 7 2245 1 1 11 CYS HB2 H 5.108 0.288 3.563 1.00 . A A . 11 CYS HB2 1 1 7 2246 1 1 11 CYS HB3 H 5.847 -1.208 4.040 1.00 . A A . 11 CYS HB3 1 1 7 2247 1 1 11 CYS N N 4.016 -1.652 2.272 1.00 . A A . 11 CYS N 1 1 7 2248 1 1 11 CYS O O 7.397 -1.753 0.865 1.00 . A A . 11 CYS O 1 1 7 2249 1 1 11 CYS SG S 7.460 0.382 3.431 1.00 . A A . 11 CYS SG 1 1 7 2250 1 1 12 ARG C C 6.918 -4.886 -0.085 1.00 . A A . 12 ARG C 1 1 7 2251 1 1 12 ARG CA C 7.125 -4.480 1.390 1.00 . A A . 12 ARG CA 1 1 7 2252 1 1 12 ARG CB C 6.859 -5.675 2.341 1.00 . A A . 12 ARG CB 1 1 7 2253 1 1 12 ARG CD C 7.449 -8.035 2.997 1.00 . A A . 12 ARG CD 1 1 7 2254 1 1 12 ARG CG C 7.767 -6.887 2.018 1.00 . A A . 12 ARG CG 1 1 7 2255 1 1 12 ARG CZ C 8.031 -10.003 1.650 1.00 . A A . 12 ARG CZ 1 1 7 2256 1 1 12 ARG H H 5.388 -3.596 2.314 1.00 . A A . 12 ARG H 1 1 7 2257 1 1 12 ARG HA H 8.143 -4.141 1.516 1.00 . A A . 12 ARG HA 1 1 7 2258 1 1 12 ARG HB2 H 7.033 -5.359 3.359 1.00 . A A . 12 ARG HB2 1 1 7 2259 1 1 12 ARG HB3 H 5.823 -5.971 2.252 1.00 . A A . 12 ARG HB3 1 1 7 2260 1 1 12 ARG HD2 H 7.666 -7.734 4.012 1.00 . A A . 12 ARG HD2 1 1 7 2261 1 1 12 ARG HD3 H 6.409 -8.323 2.932 1.00 . A A . 12 ARG HD3 1 1 7 2262 1 1 12 ARG HE H 9.114 -9.385 3.190 1.00 . A A . 12 ARG HE 1 1 7 2263 1 1 12 ARG HG2 H 7.590 -7.234 1.012 1.00 . A A . 12 ARG HG2 1 1 7 2264 1 1 12 ARG HG3 H 8.806 -6.606 2.113 1.00 . A A . 12 ARG HG3 1 1 7 2265 1 1 12 ARG HH11 H 6.367 -9.027 1.103 1.00 . A A . 12 ARG HH11 1 1 7 2266 1 1 12 ARG HH12 H 6.771 -10.413 0.148 1.00 . A A . 12 ARG HH12 1 1 7 2267 1 1 12 ARG HH21 H 9.641 -11.143 1.992 1.00 . A A . 12 ARG HH21 1 1 7 2268 1 1 12 ARG HH22 H 8.650 -11.627 0.657 1.00 . A A . 12 ARG HH22 1 1 7 2269 1 1 12 ARG N N 6.194 -3.374 1.803 1.00 . A A . 12 ARG N 1 1 7 2270 1 1 12 ARG NE N 8.314 -9.207 2.652 1.00 . A A . 12 ARG NE 1 1 7 2271 1 1 12 ARG NH1 N 6.974 -9.797 0.910 1.00 . A A . 12 ARG NH1 1 1 7 2272 1 1 12 ARG NH2 N 8.837 -11.003 1.414 1.00 . A A . 12 ARG NH2 1 1 7 2273 1 1 12 ARG O O 7.745 -5.558 -0.670 1.00 . A A . 12 ARG O 1 1 7 2274 1 1 13 SER C C 6.346 -4.028 -3.068 1.00 . A A . 13 SER C 1 1 7 2275 1 1 13 SER CA C 5.467 -4.766 -2.055 1.00 . A A . 13 SER CA 1 1 7 2276 1 1 13 SER CB C 3.984 -4.394 -2.279 1.00 . A A . 13 SER CB 1 1 7 2277 1 1 13 SER H H 5.208 -3.906 -0.110 1.00 . A A . 13 SER H 1 1 7 2278 1 1 13 SER HA H 5.586 -5.830 -2.205 1.00 . A A . 13 SER HA 1 1 7 2279 1 1 13 SER HB2 H 3.335 -4.961 -1.629 1.00 . A A . 13 SER HB2 1 1 7 2280 1 1 13 SER HB3 H 3.820 -3.337 -2.132 1.00 . A A . 13 SER HB3 1 1 7 2281 1 1 13 SER HG H 4.364 -5.330 -3.956 1.00 . A A . 13 SER HG 1 1 7 2282 1 1 13 SER N N 5.816 -4.454 -0.639 1.00 . A A . 13 SER N 1 1 7 2283 1 1 13 SER O O 6.870 -2.963 -2.806 1.00 . A A . 13 SER O 1 1 7 2284 1 1 13 SER OG O 3.697 -4.719 -3.634 1.00 . A A . 13 SER OG 1 1 7 2285 1 1 14 ARG C C 6.534 -2.851 -5.778 1.00 . A A . 14 ARG C 1 1 7 2286 1 1 14 ARG CA C 7.257 -4.135 -5.351 1.00 . A A . 14 ARG CA 1 1 7 2287 1 1 14 ARG CB C 7.251 -5.238 -6.439 1.00 . A A . 14 ARG CB 1 1 7 2288 1 1 14 ARG CD C 7.474 -3.703 -8.519 1.00 . A A . 14 ARG CD 1 1 7 2289 1 1 14 ARG CG C 8.039 -4.913 -7.744 1.00 . A A . 14 ARG CG 1 1 7 2290 1 1 14 ARG CZ C 5.253 -2.989 -9.276 1.00 . A A . 14 ARG CZ 1 1 7 2291 1 1 14 ARG H H 5.994 -5.521 -4.312 1.00 . A A . 14 ARG H 1 1 7 2292 1 1 14 ARG HA H 8.259 -3.903 -5.018 1.00 . A A . 14 ARG HA 1 1 7 2293 1 1 14 ARG HB2 H 7.689 -6.126 -6.007 1.00 . A A . 14 ARG HB2 1 1 7 2294 1 1 14 ARG HB3 H 6.228 -5.474 -6.692 1.00 . A A . 14 ARG HB3 1 1 7 2295 1 1 14 ARG HD2 H 7.647 -2.769 -8.013 1.00 . A A . 14 ARG HD2 1 1 7 2296 1 1 14 ARG HD3 H 7.953 -3.655 -9.486 1.00 . A A . 14 ARG HD3 1 1 7 2297 1 1 14 ARG HE H 5.602 -4.765 -8.471 1.00 . A A . 14 ARG HE 1 1 7 2298 1 1 14 ARG HG2 H 9.070 -4.712 -7.489 1.00 . A A . 14 ARG HG2 1 1 7 2299 1 1 14 ARG HG3 H 8.016 -5.780 -8.388 1.00 . A A . 14 ARG HG3 1 1 7 2300 1 1 14 ARG HH11 H 6.739 -1.661 -9.524 1.00 . A A . 14 ARG HH11 1 1 7 2301 1 1 14 ARG HH12 H 5.174 -1.145 -10.053 1.00 . A A . 14 ARG HH12 1 1 7 2302 1 1 14 ARG HH21 H 3.613 -4.127 -9.132 1.00 . A A . 14 ARG HH21 1 1 7 2303 1 1 14 ARG HH22 H 3.377 -2.559 -9.828 1.00 . A A . 14 ARG HH22 1 1 7 2304 1 1 14 ARG N N 6.457 -4.663 -4.207 1.00 . A A . 14 ARG N 1 1 7 2305 1 1 14 ARG NE N 6.009 -3.914 -8.739 1.00 . A A . 14 ARG NE 1 1 7 2306 1 1 14 ARG NH1 N 5.764 -1.842 -9.646 1.00 . A A . 14 ARG NH1 1 1 7 2307 1 1 14 ARG NH2 N 3.982 -3.245 -9.424 1.00 . A A . 14 ARG NH2 1 1 7 2308 1 1 14 ARG O O 7.152 -1.827 -5.986 1.00 . A A . 14 ARG O 1 1 7 2309 1 1 15 GLN C C 4.565 -0.631 -5.307 1.00 . A A . 15 GLN C 1 1 7 2310 1 1 15 GLN CA C 4.381 -1.803 -6.289 1.00 . A A . 15 GLN CA 1 1 7 2311 1 1 15 GLN CB C 2.924 -2.298 -6.315 1.00 . A A . 15 GLN CB 1 1 7 2312 1 1 15 GLN CD C 0.550 -1.723 -6.811 1.00 . A A . 15 GLN CD 1 1 7 2313 1 1 15 GLN CG C 1.978 -1.173 -6.775 1.00 . A A . 15 GLN CG 1 1 7 2314 1 1 15 GLN H H 4.810 -3.824 -5.695 1.00 . A A . 15 GLN H 1 1 7 2315 1 1 15 GLN HA H 4.680 -1.477 -7.273 1.00 . A A . 15 GLN HA 1 1 7 2316 1 1 15 GLN HB2 H 2.847 -3.134 -6.993 1.00 . A A . 15 GLN HB2 1 1 7 2317 1 1 15 GLN HB3 H 2.639 -2.634 -5.328 1.00 . A A . 15 GLN HB3 1 1 7 2318 1 1 15 GLN HE21 H 0.366 -1.709 -4.835 1.00 . A A . 15 GLN HE21 1 1 7 2319 1 1 15 GLN HE22 H -0.991 -2.270 -5.686 1.00 . A A . 15 GLN HE22 1 1 7 2320 1 1 15 GLN HG2 H 2.008 -0.340 -6.087 1.00 . A A . 15 GLN HG2 1 1 7 2321 1 1 15 GLN HG3 H 2.250 -0.828 -7.762 1.00 . A A . 15 GLN HG3 1 1 7 2322 1 1 15 GLN N N 5.234 -2.962 -5.885 1.00 . A A . 15 GLN N 1 1 7 2323 1 1 15 GLN NE2 N -0.078 -1.917 -5.683 1.00 . A A . 15 GLN NE2 1 1 7 2324 1 1 15 GLN O O 4.470 0.516 -5.701 1.00 . A A . 15 GLN O 1 1 7 2325 1 1 15 GLN OE1 O -0.007 -1.980 -7.860 1.00 . A A . 15 GLN OE1 1 1 7 2326 1 1 16 CYS C C 6.468 0.605 -2.955 1.00 . A A . 16 CYS C 1 1 7 2327 1 1 16 CYS CA C 5.027 0.096 -3.022 1.00 . A A . 16 CYS CA 1 1 7 2328 1 1 16 CYS CB C 4.662 -0.439 -1.651 1.00 . A A . 16 CYS CB 1 1 7 2329 1 1 16 CYS H H 4.882 -1.901 -3.810 1.00 . A A . 16 CYS H 1 1 7 2330 1 1 16 CYS HA H 4.372 0.920 -3.242 1.00 . A A . 16 CYS HA 1 1 7 2331 1 1 16 CYS HB2 H 5.236 -1.328 -1.458 1.00 . A A . 16 CYS HB2 1 1 7 2332 1 1 16 CYS HB3 H 4.976 0.291 -0.921 1.00 . A A . 16 CYS HB3 1 1 7 2333 1 1 16 CYS N N 4.823 -0.958 -4.063 1.00 . A A . 16 CYS N 1 1 7 2334 1 1 16 CYS O O 6.711 1.690 -2.464 1.00 . A A . 16 CYS O 1 1 7 2335 1 1 16 CYS SG S 2.936 -0.828 -1.296 1.00 . A A . 16 CYS SG 1 1 7 2336 1 1 17 LYS C C 9.090 1.598 -4.053 1.00 . A A . 17 LYS C 1 1 7 2337 1 1 17 LYS CA C 8.823 0.192 -3.438 1.00 . A A . 17 LYS CA 1 1 7 2338 1 1 17 LYS CB C 9.597 -0.908 -4.201 1.00 . A A . 17 LYS CB 1 1 7 2339 1 1 17 LYS CD C 11.891 -1.748 -4.930 1.00 . A A . 17 LYS CD 1 1 7 2340 1 1 17 LYS CE C 11.446 -1.907 -6.401 1.00 . A A . 17 LYS CE 1 1 7 2341 1 1 17 LYS CG C 11.117 -0.607 -4.221 1.00 . A A . 17 LYS CG 1 1 7 2342 1 1 17 LYS H H 7.106 -1.062 -3.813 1.00 . A A . 17 LYS H 1 1 7 2343 1 1 17 LYS HA H 9.155 0.197 -2.410 1.00 . A A . 17 LYS HA 1 1 7 2344 1 1 17 LYS HB2 H 9.423 -1.861 -3.725 1.00 . A A . 17 LYS HB2 1 1 7 2345 1 1 17 LYS HB3 H 9.231 -0.961 -5.212 1.00 . A A . 17 LYS HB3 1 1 7 2346 1 1 17 LYS HD2 H 12.948 -1.528 -4.901 1.00 . A A . 17 LYS HD2 1 1 7 2347 1 1 17 LYS HD3 H 11.724 -2.676 -4.402 1.00 . A A . 17 LYS HD3 1 1 7 2348 1 1 17 LYS HE2 H 10.401 -2.173 -6.463 1.00 . A A . 17 LYS HE2 1 1 7 2349 1 1 17 LYS HE3 H 11.610 -0.992 -6.950 1.00 . A A . 17 LYS HE3 1 1 7 2350 1 1 17 LYS HG2 H 11.304 0.322 -4.739 1.00 . A A . 17 LYS HG2 1 1 7 2351 1 1 17 LYS HG3 H 11.478 -0.510 -3.207 1.00 . A A . 17 LYS HG3 1 1 7 2352 1 1 17 LYS HZ1 H 12.054 -2.998 -8.067 1.00 . A A . 17 LYS HZ1 1 1 7 2353 1 1 17 LYS HZ2 H 11.950 -3.911 -6.638 1.00 . A A . 17 LYS HZ2 1 1 7 2354 1 1 17 LYS HZ3 H 13.247 -2.838 -6.868 1.00 . A A . 17 LYS HZ3 1 1 7 2355 1 1 17 LYS N N 7.379 -0.195 -3.444 1.00 . A A . 17 LYS N 1 1 7 2356 1 1 17 LYS NZ N 12.234 -2.995 -7.043 1.00 . A A . 17 LYS NZ 1 1 7 2357 1 1 17 LYS O O 9.802 2.373 -3.444 1.00 . A A . 17 LYS O 1 1 7 2358 1 1 18 HYP C C 8.155 4.425 -5.033 1.00 . A A . 18 HYP C 1 1 7 2359 1 1 18 HYP CA C 8.731 3.239 -5.840 1.00 . A A . 18 HYP CA 1 1 7 2360 1 1 18 HYP CB C 8.091 3.100 -7.224 1.00 . A A . 18 HYP CB 1 1 7 2361 1 1 18 HYP CD C 7.687 1.068 -6.076 1.00 . A A . 18 HYP CD 1 1 7 2362 1 1 18 HYP CG C 7.069 2.041 -7.031 1.00 . A A . 18 HYP CG 1 1 7 2363 1 1 18 HYP HA H 9.784 3.429 -5.991 1.00 . A A . 18 HYP HA 1 1 7 2364 1 1 18 HYP HB2 H 8.839 2.817 -7.950 1.00 . A A . 18 HYP HB2 1 1 7 2365 1 1 18 HYP HB3 H 7.653 4.034 -7.549 1.00 . A A . 18 HYP HB3 1 1 7 2366 1 1 18 HYP HD1 H 6.118 0.708 -8.081 1.00 . A A . 18 HYP HD1 1 1 7 2367 1 1 18 HYP HD22 H 8.282 0.343 -6.612 1.00 . A A . 18 HYP HD22 1 1 7 2368 1 1 18 HYP HD23 H 6.906 0.584 -5.519 1.00 . A A . 18 HYP HD23 1 1 7 2369 1 1 18 HYP HG H 6.173 2.469 -6.606 1.00 . A A . 18 HYP HG 1 1 7 2370 1 1 18 HYP N N 8.541 1.911 -5.212 1.00 . A A . 18 HYP N 1 1 7 2371 1 1 18 HYP O O 8.310 5.554 -5.459 1.00 . A A . 18 HYP O 1 1 7 2372 1 1 18 HYP OD1 O 6.761 1.398 -8.261 1.00 . A A . 18 HYP OD1 1 1 7 2373 1 1 19 HIS C C 8.062 5.989 -2.345 1.00 . A A . 19 HIS C 1 1 7 2374 1 1 19 HIS CA C 6.945 5.254 -3.086 1.00 . A A . 19 HIS CA 1 1 7 2375 1 1 19 HIS CB C 5.947 4.680 -2.057 1.00 . A A . 19 HIS CB 1 1 7 2376 1 1 19 HIS CD2 C 4.619 3.354 -3.954 1.00 . A A . 19 HIS CD2 1 1 7 2377 1 1 19 HIS CE1 C 2.726 3.492 -3.126 1.00 . A A . 19 HIS CE1 1 1 7 2378 1 1 19 HIS CG C 4.735 4.055 -2.764 1.00 . A A . 19 HIS CG 1 1 7 2379 1 1 19 HIS H H 7.433 3.218 -3.617 1.00 . A A . 19 HIS H 1 1 7 2380 1 1 19 HIS HA H 6.436 5.952 -3.737 1.00 . A A . 19 HIS HA 1 1 7 2381 1 1 19 HIS HB2 H 6.424 3.925 -1.451 1.00 . A A . 19 HIS HB2 1 1 7 2382 1 1 19 HIS HB3 H 5.594 5.468 -1.408 1.00 . A A . 19 HIS HB3 1 1 7 2383 1 1 19 HIS HD1 H 3.254 4.531 -1.473 1.00 . A A . 19 HIS HD1 1 1 7 2384 1 1 19 HIS HD2 H 5.437 3.115 -4.615 1.00 . A A . 19 HIS HD2 1 1 7 2385 1 1 19 HIS HE1 H 1.662 3.393 -2.970 1.00 . A A . 19 HIS HE1 1 1 7 2386 1 1 19 HIS N N 7.525 4.148 -3.916 1.00 . A A . 19 HIS N 1 1 7 2387 1 1 19 HIS ND1 N 3.526 4.101 -2.310 1.00 . A A . 19 HIS ND1 1 1 7 2388 1 1 19 HIS NE2 N 3.364 3.012 -4.164 1.00 . A A . 19 HIS NE2 1 1 7 2389 1 1 19 HIS O O 9.070 5.399 -2.013 1.00 . A A . 19 HIS O 1 1 7 2390 1 1 20 ARG C C 9.041 7.639 0.073 1.00 . A A . 20 ARG C 1 1 7 2391 1 1 20 ARG CA C 8.872 8.086 -1.389 1.00 . A A . 20 ARG CA 1 1 7 2392 1 1 20 ARG CB C 8.430 9.566 -1.425 1.00 . A A . 20 ARG CB 1 1 7 2393 1 1 20 ARG CD C 9.612 10.035 -3.642 1.00 . A A . 20 ARG CD 1 1 7 2394 1 1 20 ARG CG C 8.273 10.085 -2.878 1.00 . A A . 20 ARG CG 1 1 7 2395 1 1 20 ARG CZ C 10.361 10.819 -5.841 1.00 . A A . 20 ARG CZ 1 1 7 2396 1 1 20 ARG H H 7.012 7.671 -2.403 1.00 . A A . 20 ARG H 1 1 7 2397 1 1 20 ARG HA H 9.824 7.968 -1.886 1.00 . A A . 20 ARG HA 1 1 7 2398 1 1 20 ARG HB2 H 7.485 9.670 -0.910 1.00 . A A . 20 ARG HB2 1 1 7 2399 1 1 20 ARG HB3 H 9.162 10.171 -0.910 1.00 . A A . 20 ARG HB3 1 1 7 2400 1 1 20 ARG HD2 H 10.350 10.649 -3.147 1.00 . A A . 20 ARG HD2 1 1 7 2401 1 1 20 ARG HD3 H 9.980 9.024 -3.725 1.00 . A A . 20 ARG HD3 1 1 7 2402 1 1 20 ARG HE H 8.453 10.733 -5.316 1.00 . A A . 20 ARG HE 1 1 7 2403 1 1 20 ARG HG2 H 7.540 9.486 -3.401 1.00 . A A . 20 ARG HG2 1 1 7 2404 1 1 20 ARG HG3 H 7.917 11.105 -2.850 1.00 . A A . 20 ARG HG3 1 1 7 2405 1 1 20 ARG HH11 H 11.804 10.254 -4.565 1.00 . A A . 20 ARG HH11 1 1 7 2406 1 1 20 ARG HH12 H 12.345 10.807 -6.115 1.00 . A A . 20 ARG HH12 1 1 7 2407 1 1 20 ARG HH21 H 9.115 11.432 -7.282 1.00 . A A . 20 ARG HH21 1 1 7 2408 1 1 20 ARG HH22 H 10.802 11.482 -7.676 1.00 . A A . 20 ARG HH22 1 1 7 2409 1 1 20 ARG N N 7.850 7.256 -2.108 1.00 . A A . 20 ARG N 1 1 7 2410 1 1 20 ARG NE N 9.372 10.567 -5.019 1.00 . A A . 20 ARG NE 1 1 7 2411 1 1 20 ARG NH1 N 11.600 10.609 -5.478 1.00 . A A . 20 ARG NH1 1 1 7 2412 1 1 20 ARG NH2 N 10.070 11.281 -7.025 1.00 . A A . 20 ARG NH2 1 1 7 2413 1 1 20 ARG O O 10.028 7.963 0.704 1.00 . A A . 20 ARG O 1 1 7 2414 1 1 21 CYS C C 8.732 5.002 2.048 1.00 . A A . 21 CYS C 1 1 7 2415 1 1 21 CYS CA C 8.104 6.403 1.972 1.00 . A A . 21 CYS CA 1 1 7 2416 1 1 21 CYS CB C 6.684 6.302 2.515 1.00 . A A . 21 CYS CB 1 1 7 2417 1 1 21 CYS H H 7.307 6.678 -0.010 1.00 . A A . 21 CYS H 1 1 7 2418 1 1 21 CYS HA H 8.689 7.077 2.578 1.00 . A A . 21 CYS HA 1 1 7 2419 1 1 21 CYS HB2 H 6.194 5.478 2.018 1.00 . A A . 21 CYS HB2 1 1 7 2420 1 1 21 CYS HB3 H 6.752 6.045 3.563 1.00 . A A . 21 CYS HB3 1 1 7 2421 1 1 21 CYS N N 8.071 6.905 0.561 1.00 . A A . 21 CYS N 1 1 7 2422 1 1 21 CYS O O 9.158 4.582 3.107 1.00 . A A . 21 CYS O 1 1 7 2423 1 1 21 CYS SG S 5.569 7.721 2.395 1.00 . A A . 21 CYS SG 1 1 7 2424 1 1 22 . C C 10.192 2.762 -0.387 1.00 . A A . 22 CY3 C 1 1 7 2425 1 1 22 . CA C 9.339 2.949 0.864 1.00 . A A . 22 CY3 CA 1 1 7 2426 1 1 22 . CB C 8.124 2.003 0.924 1.00 . A A . 22 CY3 CB 1 1 7 2427 1 1 22 . H H 8.421 4.728 0.100 1.00 . A A . 22 CY3 H 1 1 7 2428 1 1 22 . HA H 9.971 2.782 1.724 1.00 . A A . 22 CY3 HA 1 1 7 2429 1 1 22 . HB2 H 8.437 0.981 0.783 1.00 . A A . 22 CY3 HB2 1 1 7 2430 1 1 22 . HB3 H 7.444 2.253 0.122 1.00 . A A . 22 CY3 HB3 1 1 7 2431 1 1 22 . HN11 H 10.628 4.692 -0.473 1.00 . A A . 22 CY3 HN11 1 1 7 2432 1 1 22 . HN12 H 11.314 3.746 -1.696 1.00 . A A . 22 CY3 HN12 1 1 7 2433 1 1 22 . N N 8.767 4.327 0.926 1.00 . A A . 22 CY3 N 1 1 7 2434 1 1 22 . N1 N 10.760 3.817 -0.896 1.00 . A A . 22 CY3 N1 1 1 7 2435 1 1 22 . O O 10.351 1.675 -0.907 1.00 . A A . 22 CY3 O 1 1 7 2436 1 1 22 . SG S 7.215 2.149 2.484 1.00 . A A . 22 CY3 SG 1 1 8 2437 1 1 1 PCA C C -4.470 4.983 0.937 1.00 . A A . 1 PCA C 1 1 8 2438 1 1 1 PCA CA C -5.781 5.660 1.357 1.00 . A A . 1 PCA CA 1 1 8 2439 1 1 1 PCA CB C -6.320 5.114 2.685 1.00 . A A . 1 PCA CB 1 1 8 2440 1 1 1 PCA CD C -7.887 4.602 0.967 1.00 . A A . 1 PCA CD 1 1 8 2441 1 1 1 PCA CG C -7.417 4.123 2.318 1.00 . A A . 1 PCA CG 1 1 8 2442 1 1 1 PCA HA H -5.622 6.725 1.444 1.00 . A A . 1 PCA HA 1 1 8 2443 1 1 1 PCA HB2 H -6.705 5.927 3.283 1.00 . A A . 1 PCA HB2 1 1 8 2444 1 1 1 PCA HB3 H -5.529 4.641 3.249 1.00 . A A . 1 PCA HB3 1 1 8 2445 1 1 1 PCA HG2 H -8.218 4.162 3.042 1.00 . A A . 1 PCA HG2 1 1 8 2446 1 1 1 PCA HG3 H -7.014 3.123 2.249 1.00 . A A . 1 PCA HG3 1 1 8 2447 1 1 1 PCA N N -6.847 5.430 0.360 1.00 . A A . 1 PCA N 1 1 8 2448 1 1 1 PCA O O -4.495 3.878 0.430 1.00 . A A . 1 PCA O 1 1 8 2449 1 1 1 PCA OE O -8.962 4.333 0.471 1.00 . A A . 1 PCA OE 1 1 8 2450 1 1 2 ARG C C -1.682 3.982 1.764 1.00 . A A . 2 ARG C 1 1 8 2451 1 1 2 ARG CA C -2.040 5.126 0.802 1.00 . A A . 2 ARG CA 1 1 8 2452 1 1 2 ARG CB C -1.006 6.277 0.885 1.00 . A A . 2 ARG CB 1 1 8 2453 1 1 2 ARG CD C 0.501 5.193 -0.880 1.00 . A A . 2 ARG CD 1 1 8 2454 1 1 2 ARG CG C 0.424 5.780 0.541 1.00 . A A . 2 ARG CG 1 1 8 2455 1 1 2 ARG CZ C -0.236 5.958 -3.090 1.00 . A A . 2 ARG CZ 1 1 8 2456 1 1 2 ARG H H -3.447 6.561 1.578 1.00 . A A . 2 ARG H 1 1 8 2457 1 1 2 ARG HA H -2.093 4.743 -0.208 1.00 . A A . 2 ARG HA 1 1 8 2458 1 1 2 ARG HB2 H -1.291 7.065 0.204 1.00 . A A . 2 ARG HB2 1 1 8 2459 1 1 2 ARG HB3 H -1.004 6.684 1.886 1.00 . A A . 2 ARG HB3 1 1 8 2460 1 1 2 ARG HD2 H 1.516 4.891 -1.093 1.00 . A A . 2 ARG HD2 1 1 8 2461 1 1 2 ARG HD3 H -0.148 4.336 -0.981 1.00 . A A . 2 ARG HD3 1 1 8 2462 1 1 2 ARG HE H 0.089 7.188 -1.571 1.00 . A A . 2 ARG HE 1 1 8 2463 1 1 2 ARG HG2 H 1.110 6.612 0.610 1.00 . A A . 2 ARG HG2 1 1 8 2464 1 1 2 ARG HG3 H 0.727 5.030 1.254 1.00 . A A . 2 ARG HG3 1 1 8 2465 1 1 2 ARG HH11 H 0.028 3.981 -2.885 1.00 . A A . 2 ARG HH11 1 1 8 2466 1 1 2 ARG HH12 H -0.492 4.510 -4.449 1.00 . A A . 2 ARG HH12 1 1 8 2467 1 1 2 ARG HH21 H -0.568 7.878 -3.544 1.00 . A A . 2 ARG HH21 1 1 8 2468 1 1 2 ARG HH22 H -0.835 6.746 -4.828 1.00 . A A . 2 ARG HH22 1 1 8 2469 1 1 2 ARG N N -3.381 5.676 1.165 1.00 . A A . 2 ARG N 1 1 8 2470 1 1 2 ARG NE N 0.100 6.252 -1.858 1.00 . A A . 2 ARG NE 1 1 8 2471 1 1 2 ARG NH1 N -0.232 4.719 -3.506 1.00 . A A . 2 ARG NH1 1 1 8 2472 1 1 2 ARG NH2 N -0.573 6.937 -3.883 1.00 . A A . 2 ARG NH2 1 1 8 2473 1 1 2 ARG O O -1.283 4.207 2.890 1.00 . A A . 2 ARG O 1 1 8 2474 1 1 3 LEU C C -0.069 1.437 2.457 1.00 . A A . 3 LEU C 1 1 8 2475 1 1 3 LEU CA C -1.550 1.556 2.060 1.00 . A A . 3 LEU CA 1 1 8 2476 1 1 3 LEU CB C -2.010 0.309 1.219 1.00 . A A . 3 LEU CB 1 1 8 2477 1 1 3 LEU CD1 C -1.880 -1.188 -0.821 1.00 . A A . 3 LEU CD1 1 1 8 2478 1 1 3 LEU CD2 C -1.376 1.245 -1.156 1.00 . A A . 3 LEU CD2 1 1 8 2479 1 1 3 LEU CG C -1.273 0.067 -0.156 1.00 . A A . 3 LEU CG 1 1 8 2480 1 1 3 LEU H H -2.183 2.699 0.351 1.00 . A A . 3 LEU H 1 1 8 2481 1 1 3 LEU HA H -2.128 1.611 2.966 1.00 . A A . 3 LEU HA 1 1 8 2482 1 1 3 LEU HB2 H -1.877 -0.571 1.829 1.00 . A A . 3 LEU HB2 1 1 8 2483 1 1 3 LEU HB3 H -3.068 0.410 1.027 1.00 . A A . 3 LEU HB3 1 1 8 2484 1 1 3 LEU HD11 H -1.751 -2.050 -0.186 1.00 . A A . 3 LEU HD11 1 1 8 2485 1 1 3 LEU HD12 H -1.395 -1.384 -1.767 1.00 . A A . 3 LEU HD12 1 1 8 2486 1 1 3 LEU HD13 H -2.937 -1.044 -0.997 1.00 . A A . 3 LEU HD13 1 1 8 2487 1 1 3 LEU HD21 H -0.916 2.135 -0.761 1.00 . A A . 3 LEU HD21 1 1 8 2488 1 1 3 LEU HD22 H -2.409 1.454 -1.390 1.00 . A A . 3 LEU HD22 1 1 8 2489 1 1 3 LEU HD23 H -0.860 0.988 -2.071 1.00 . A A . 3 LEU HD23 1 1 8 2490 1 1 3 LEU HG H -0.228 -0.131 0.022 1.00 . A A . 3 LEU HG 1 1 8 2491 1 1 3 LEU N N -1.849 2.785 1.267 1.00 . A A . 3 LEU N 1 1 8 2492 1 1 3 LEU O O 0.249 1.292 3.619 1.00 . A A . 3 LEU O 1 1 8 2493 1 1 4 CYS C C 2.823 2.360 2.688 1.00 . A A . 4 CYS C 1 1 8 2494 1 1 4 CYS CA C 2.256 1.405 1.625 1.00 . A A . 4 CYS CA 1 1 8 2495 1 1 4 CYS CB C 2.913 1.724 0.282 1.00 . A A . 4 CYS CB 1 1 8 2496 1 1 4 CYS H H 0.420 1.595 0.567 1.00 . A A . 4 CYS H 1 1 8 2497 1 1 4 CYS HA H 2.515 0.400 1.909 1.00 . A A . 4 CYS HA 1 1 8 2498 1 1 4 CYS HB2 H 2.827 2.771 0.060 1.00 . A A . 4 CYS HB2 1 1 8 2499 1 1 4 CYS HB3 H 3.969 1.533 0.389 1.00 . A A . 4 CYS HB3 1 1 8 2500 1 1 4 CYS N N 0.777 1.497 1.466 1.00 . A A . 4 CYS N 1 1 8 2501 1 1 4 CYS O O 3.390 1.929 3.674 1.00 . A A . 4 CYS O 1 1 8 2502 1 1 4 CYS SG S 2.386 0.849 -1.210 1.00 . A A . 4 CYS SG 1 1 8 2503 1 1 5 CYS C C 2.325 4.719 4.674 1.00 . A A . 5 CYS C 1 1 8 2504 1 1 5 CYS CA C 3.146 4.681 3.382 1.00 . A A . 5 CYS CA 1 1 8 2505 1 1 5 CYS CB C 3.076 6.061 2.704 1.00 . A A . 5 CYS CB 1 1 8 2506 1 1 5 CYS H H 2.154 3.888 1.630 1.00 . A A . 5 CYS H 1 1 8 2507 1 1 5 CYS HA H 4.174 4.457 3.629 1.00 . A A . 5 CYS HA 1 1 8 2508 1 1 5 CYS HB2 H 3.453 5.976 1.695 1.00 . A A . 5 CYS HB2 1 1 8 2509 1 1 5 CYS HB3 H 2.043 6.370 2.646 1.00 . A A . 5 CYS HB3 1 1 8 2510 1 1 5 CYS N N 2.638 3.632 2.441 1.00 . A A . 5 CYS N 1 1 8 2511 1 1 5 CYS O O 2.867 4.920 5.744 1.00 . A A . 5 CYS O 1 1 8 2512 1 1 5 CYS SG S 3.987 7.382 3.541 1.00 . A A . 5 CYS SG 1 1 8 2513 1 1 6 GLY C C 0.474 3.436 6.708 1.00 . A A . 6 GLY C 1 1 8 2514 1 1 6 GLY CA C 0.116 4.536 5.705 1.00 . A A . 6 GLY CA 1 1 8 2515 1 1 6 GLY H H 0.676 4.366 3.630 1.00 . A A . 6 GLY H 1 1 8 2516 1 1 6 GLY HA2 H 0.181 5.498 6.194 1.00 . A A . 6 GLY HA2 1 1 8 2517 1 1 6 GLY HA3 H -0.896 4.380 5.364 1.00 . A A . 6 GLY HA3 1 1 8 2518 1 1 6 GLY N N 1.038 4.524 4.528 1.00 . A A . 6 GLY N 1 1 8 2519 1 1 6 GLY O O 0.373 3.636 7.903 1.00 . A A . 6 GLY O 1 1 8 2520 1 1 7 PHE C C 2.151 0.099 6.333 1.00 . A A . 7 PHE C 1 1 8 2521 1 1 7 PHE CA C 1.262 1.151 7.046 1.00 . A A . 7 PHE CA 1 1 8 2522 1 1 7 PHE CB C -0.046 0.500 7.579 1.00 . A A . 7 PHE CB 1 1 8 2523 1 1 7 PHE CD1 C -0.809 -1.013 5.694 1.00 . A A . 7 PHE CD1 1 1 8 2524 1 1 7 PHE CD2 C -2.119 0.911 6.183 1.00 . A A . 7 PHE CD2 1 1 8 2525 1 1 7 PHE CE1 C -1.685 -1.359 4.688 1.00 . A A . 7 PHE CE1 1 1 8 2526 1 1 7 PHE CE2 C -2.998 0.569 5.178 1.00 . A A . 7 PHE CE2 1 1 8 2527 1 1 7 PHE CG C -1.016 0.120 6.448 1.00 . A A . 7 PHE CG 1 1 8 2528 1 1 7 PHE CZ C -2.782 -0.567 4.430 1.00 . A A . 7 PHE CZ 1 1 8 2529 1 1 7 PHE H H 0.940 2.224 5.209 1.00 . A A . 7 PHE H 1 1 8 2530 1 1 7 PHE HA H 1.808 1.552 7.886 1.00 . A A . 7 PHE HA 1 1 8 2531 1 1 7 PHE HB2 H 0.195 -0.396 8.133 1.00 . A A . 7 PHE HB2 1 1 8 2532 1 1 7 PHE HB3 H -0.545 1.184 8.250 1.00 . A A . 7 PHE HB3 1 1 8 2533 1 1 7 PHE HD1 H 0.051 -1.629 5.898 1.00 . A A . 7 PHE HD1 1 1 8 2534 1 1 7 PHE HD2 H -2.296 1.803 6.765 1.00 . A A . 7 PHE HD2 1 1 8 2535 1 1 7 PHE HE1 H -1.515 -2.250 4.103 1.00 . A A . 7 PHE HE1 1 1 8 2536 1 1 7 PHE HE2 H -3.858 1.191 4.977 1.00 . A A . 7 PHE HE2 1 1 8 2537 1 1 7 PHE HZ H -3.472 -0.835 3.642 1.00 . A A . 7 PHE HZ 1 1 8 2538 1 1 7 PHE N N 0.882 2.307 6.182 1.00 . A A . 7 PHE N 1 1 8 2539 1 1 7 PHE O O 1.962 -0.226 5.171 1.00 . A A . 7 PHE O 1 1 8 2540 1 1 8 HYP C C 3.791 -2.532 5.915 1.00 . A A . 8 HYP C 1 1 8 2541 1 1 8 HYP CA C 4.228 -1.194 6.523 1.00 . A A . 8 HYP CA 1 1 8 2542 1 1 8 HYP CB C 5.197 -1.358 7.690 1.00 . A A . 8 HYP CB 1 1 8 2543 1 1 8 HYP CD C 3.242 -0.310 8.551 1.00 . A A . 8 HYP CD 1 1 8 2544 1 1 8 HYP CG C 4.309 -1.315 8.884 1.00 . A A . 8 HYP CG 1 1 8 2545 1 1 8 HYP HA H 4.733 -0.623 5.761 1.00 . A A . 8 HYP HA 1 1 8 2546 1 1 8 HYP HB2 H 5.921 -0.556 7.687 1.00 . A A . 8 HYP HB2 1 1 8 2547 1 1 8 HYP HB3 H 5.738 -2.291 7.621 1.00 . A A . 8 HYP HB3 1 1 8 2548 1 1 8 HYP HD1 H 4.444 -0.908 10.779 1.00 . A A . 8 HYP HD1 1 1 8 2549 1 1 8 HYP HD22 H 3.555 0.683 8.842 1.00 . A A . 8 HYP HD22 1 1 8 2550 1 1 8 HYP HD23 H 2.317 -0.574 9.043 1.00 . A A . 8 HYP HD23 1 1 8 2551 1 1 8 HYP HG H 3.869 -2.288 9.052 1.00 . A A . 8 HYP HG 1 1 8 2552 1 1 8 HYP N N 3.110 -0.411 7.079 1.00 . A A . 8 HYP N 1 1 8 2553 1 1 8 HYP O O 4.607 -3.212 5.321 1.00 . A A . 8 HYP O 1 1 8 2554 1 1 8 HYP OD1 O 5.044 -0.908 10.029 1.00 . A A . 8 HYP OD1 1 1 8 2555 1 1 9 LYS C C 2.141 -4.122 4.006 1.00 . A A . 9 LYS C 1 1 8 2556 1 1 9 LYS CA C 2.014 -4.141 5.528 1.00 . A A . 9 LYS CA 1 1 8 2557 1 1 9 LYS CB C 0.528 -4.327 5.931 1.00 . A A . 9 LYS CB 1 1 8 2558 1 1 9 LYS CD C 0.720 -6.910 5.980 1.00 . A A . 9 LYS CD 1 1 8 2559 1 1 9 LYS CE C 0.658 -6.948 7.521 1.00 . A A . 9 LYS CE 1 1 8 2560 1 1 9 LYS CG C -0.050 -5.682 5.423 1.00 . A A . 9 LYS CG 1 1 8 2561 1 1 9 LYS H H 1.927 -2.259 6.567 1.00 . A A . 9 LYS H 1 1 8 2562 1 1 9 LYS HA H 2.616 -4.947 5.922 1.00 . A A . 9 LYS HA 1 1 8 2563 1 1 9 LYS HB2 H 0.416 -4.241 7.002 1.00 . A A . 9 LYS HB2 1 1 8 2564 1 1 9 LYS HB3 H -0.062 -3.554 5.468 1.00 . A A . 9 LYS HB3 1 1 8 2565 1 1 9 LYS HD2 H 0.266 -7.809 5.590 1.00 . A A . 9 LYS HD2 1 1 8 2566 1 1 9 LYS HD3 H 1.750 -6.888 5.653 1.00 . A A . 9 LYS HD3 1 1 8 2567 1 1 9 LYS HE2 H 1.131 -6.075 7.944 1.00 . A A . 9 LYS HE2 1 1 8 2568 1 1 9 LYS HE3 H -0.367 -6.993 7.858 1.00 . A A . 9 LYS HE3 1 1 8 2569 1 1 9 LYS HG2 H -1.085 -5.752 5.725 1.00 . A A . 9 LYS HG2 1 1 8 2570 1 1 9 LYS HG3 H -0.020 -5.707 4.343 1.00 . A A . 9 LYS HG3 1 1 8 2571 1 1 9 LYS HZ1 H 2.334 -7.878 8.334 1.00 . A A . 9 LYS HZ1 1 1 8 2572 1 1 9 LYS HZ2 H 1.448 -8.860 7.267 1.00 . A A . 9 LYS HZ2 1 1 8 2573 1 1 9 LYS HZ3 H 0.856 -8.554 8.829 1.00 . A A . 9 LYS HZ3 1 1 8 2574 1 1 9 LYS N N 2.531 -2.858 6.083 1.00 . A A . 9 LYS N 1 1 8 2575 1 1 9 LYS NZ N 1.379 -8.152 8.026 1.00 . A A . 9 LYS NZ 1 1 8 2576 1 1 9 LYS O O 2.445 -5.150 3.430 1.00 . A A . 9 LYS O 1 1 8 2577 1 1 10 SER C C 3.454 -2.521 1.494 1.00 . A A . 10 SER C 1 1 8 2578 1 1 10 SER CA C 2.042 -2.954 1.902 1.00 . A A . 10 SER CA 1 1 8 2579 1 1 10 SER CB C 0.992 -1.989 1.356 1.00 . A A . 10 SER CB 1 1 8 2580 1 1 10 SER H H 1.675 -2.146 3.859 1.00 . A A . 10 SER H 1 1 8 2581 1 1 10 SER HA H 1.853 -3.939 1.498 1.00 . A A . 10 SER HA 1 1 8 2582 1 1 10 SER HB2 H 1.077 -1.012 1.798 1.00 . A A . 10 SER HB2 1 1 8 2583 1 1 10 SER HB3 H 1.025 -1.928 0.278 1.00 . A A . 10 SER HB3 1 1 8 2584 1 1 10 SER HG H -0.227 -2.648 2.720 1.00 . A A . 10 SER HG 1 1 8 2585 1 1 10 SER N N 1.918 -2.980 3.389 1.00 . A A . 10 SER N 1 1 8 2586 1 1 10 SER O O 3.983 -3.016 0.523 1.00 . A A . 10 SER O 1 1 8 2587 1 1 10 SER OG O -0.241 -2.564 1.764 1.00 . A A . 10 SER OG 1 1 8 2588 1 1 11 CYS C C 6.473 -1.998 1.487 1.00 . A A . 11 CYS C 1 1 8 2589 1 1 11 CYS CA C 5.387 -1.050 2.040 1.00 . A A . 11 CYS CA 1 1 8 2590 1 1 11 CYS CB C 5.840 -0.481 3.377 1.00 . A A . 11 CYS CB 1 1 8 2591 1 1 11 CYS H H 3.493 -1.289 3.026 1.00 . A A . 11 CYS H 1 1 8 2592 1 1 11 CYS HA H 5.288 -0.224 1.353 1.00 . A A . 11 CYS HA 1 1 8 2593 1 1 11 CYS HB2 H 5.082 0.206 3.719 1.00 . A A . 11 CYS HB2 1 1 8 2594 1 1 11 CYS HB3 H 5.861 -1.305 4.075 1.00 . A A . 11 CYS HB3 1 1 8 2595 1 1 11 CYS N N 4.010 -1.617 2.260 1.00 . A A . 11 CYS N 1 1 8 2596 1 1 11 CYS O O 7.335 -1.562 0.747 1.00 . A A . 11 CYS O 1 1 8 2597 1 1 11 CYS SG S 7.431 0.362 3.546 1.00 . A A . 11 CYS SG 1 1 8 2598 1 1 12 ARG C C 6.941 -4.931 0.067 1.00 . A A . 12 ARG C 1 1 8 2599 1 1 12 ARG CA C 7.412 -4.261 1.379 1.00 . A A . 12 ARG CA 1 1 8 2600 1 1 12 ARG CB C 7.593 -5.270 2.551 1.00 . A A . 12 ARG CB 1 1 8 2601 1 1 12 ARG CD C 8.920 -7.210 3.494 1.00 . A A . 12 ARG CD 1 1 8 2602 1 1 12 ARG CG C 8.727 -6.294 2.272 1.00 . A A . 12 ARG CG 1 1 8 2603 1 1 12 ARG CZ C 9.767 -6.898 5.774 1.00 . A A . 12 ARG CZ 1 1 8 2604 1 1 12 ARG H H 5.676 -3.542 2.441 1.00 . A A . 12 ARG H 1 1 8 2605 1 1 12 ARG HA H 8.352 -3.761 1.190 1.00 . A A . 12 ARG HA 1 1 8 2606 1 1 12 ARG HB2 H 7.819 -4.714 3.450 1.00 . A A . 12 ARG HB2 1 1 8 2607 1 1 12 ARG HB3 H 6.664 -5.800 2.709 1.00 . A A . 12 ARG HB3 1 1 8 2608 1 1 12 ARG HD2 H 8.003 -7.728 3.732 1.00 . A A . 12 ARG HD2 1 1 8 2609 1 1 12 ARG HD3 H 9.696 -7.934 3.291 1.00 . A A . 12 ARG HD3 1 1 8 2610 1 1 12 ARG HE H 9.258 -5.391 4.595 1.00 . A A . 12 ARG HE 1 1 8 2611 1 1 12 ARG HG2 H 8.488 -6.927 1.433 1.00 . A A . 12 ARG HG2 1 1 8 2612 1 1 12 ARG HG3 H 9.649 -5.773 2.061 1.00 . A A . 12 ARG HG3 1 1 8 2613 1 1 12 ARG HH11 H 9.609 -8.796 5.144 1.00 . A A . 12 ARG HH11 1 1 8 2614 1 1 12 ARG HH12 H 10.209 -8.587 6.755 1.00 . A A . 12 ARG HH12 1 1 8 2615 1 1 12 ARG HH21 H 10.012 -5.103 6.624 1.00 . A A . 12 ARG HH21 1 1 8 2616 1 1 12 ARG HH22 H 10.441 -6.463 7.608 1.00 . A A . 12 ARG HH22 1 1 8 2617 1 1 12 ARG N N 6.403 -3.255 1.853 1.00 . A A . 12 ARG N 1 1 8 2618 1 1 12 ARG NE N 9.325 -6.367 4.662 1.00 . A A . 12 ARG NE 1 1 8 2619 1 1 12 ARG NH1 N 9.869 -8.195 5.900 1.00 . A A . 12 ARG NH1 1 1 8 2620 1 1 12 ARG NH2 N 10.100 -6.093 6.745 1.00 . A A . 12 ARG NH2 1 1 8 2621 1 1 12 ARG O O 7.354 -6.019 -0.283 1.00 . A A . 12 ARG O 1 1 8 2622 1 1 13 SER C C 6.230 -4.047 -3.090 1.00 . A A . 13 SER C 1 1 8 2623 1 1 13 SER CA C 5.522 -4.744 -1.928 1.00 . A A . 13 SER CA 1 1 8 2624 1 1 13 SER CB C 4.015 -4.446 -1.991 1.00 . A A . 13 SER CB 1 1 8 2625 1 1 13 SER H H 5.792 -3.367 -0.287 1.00 . A A . 13 SER H 1 1 8 2626 1 1 13 SER HA H 5.685 -5.810 -2.003 1.00 . A A . 13 SER HA 1 1 8 2627 1 1 13 SER HB2 H 3.474 -4.964 -1.212 1.00 . A A . 13 SER HB2 1 1 8 2628 1 1 13 SER HB3 H 3.816 -3.386 -1.944 1.00 . A A . 13 SER HB3 1 1 8 2629 1 1 13 SER HG H 3.897 -4.320 -3.928 1.00 . A A . 13 SER HG 1 1 8 2630 1 1 13 SER N N 6.077 -4.238 -0.630 1.00 . A A . 13 SER N 1 1 8 2631 1 1 13 SER O O 6.655 -2.914 -2.960 1.00 . A A . 13 SER O 1 1 8 2632 1 1 13 SER OG O 3.601 -4.942 -3.258 1.00 . A A . 13 SER OG 1 1 8 2633 1 1 14 ARG C C 6.289 -2.897 -5.818 1.00 . A A . 14 ARG C 1 1 8 2634 1 1 14 ARG CA C 6.993 -4.201 -5.410 1.00 . A A . 14 ARG CA 1 1 8 2635 1 1 14 ARG CB C 6.902 -5.254 -6.537 1.00 . A A . 14 ARG CB 1 1 8 2636 1 1 14 ARG CD C 9.054 -4.395 -7.638 1.00 . A A . 14 ARG CD 1 1 8 2637 1 1 14 ARG CG C 7.565 -4.751 -7.853 1.00 . A A . 14 ARG CG 1 1 8 2638 1 1 14 ARG CZ C 10.945 -5.517 -6.550 1.00 . A A . 14 ARG CZ 1 1 8 2639 1 1 14 ARG H H 5.961 -5.663 -4.211 1.00 . A A . 14 ARG H 1 1 8 2640 1 1 14 ARG HA H 8.025 -3.999 -5.174 1.00 . A A . 14 ARG HA 1 1 8 2641 1 1 14 ARG HB2 H 7.384 -6.164 -6.215 1.00 . A A . 14 ARG HB2 1 1 8 2642 1 1 14 ARG HB3 H 5.862 -5.477 -6.731 1.00 . A A . 14 ARG HB3 1 1 8 2643 1 1 14 ARG HD2 H 9.501 -4.105 -8.577 1.00 . A A . 14 ARG HD2 1 1 8 2644 1 1 14 ARG HD3 H 9.158 -3.583 -6.935 1.00 . A A . 14 ARG HD3 1 1 8 2645 1 1 14 ARG HE H 9.349 -6.487 -7.215 1.00 . A A . 14 ARG HE 1 1 8 2646 1 1 14 ARG HG2 H 7.492 -5.526 -8.602 1.00 . A A . 14 ARG HG2 1 1 8 2647 1 1 14 ARG HG3 H 7.038 -3.882 -8.220 1.00 . A A . 14 ARG HG3 1 1 8 2648 1 1 14 ARG HH11 H 11.092 -3.525 -6.744 1.00 . A A . 14 ARG HH11 1 1 8 2649 1 1 14 ARG HH12 H 12.430 -4.306 -5.971 1.00 . A A . 14 ARG HH12 1 1 8 2650 1 1 14 ARG HH21 H 11.036 -7.491 -6.241 1.00 . A A . 14 ARG HH21 1 1 8 2651 1 1 14 ARG HH22 H 12.400 -6.580 -5.683 1.00 . A A . 14 ARG HH22 1 1 8 2652 1 1 14 ARG N N 6.329 -4.755 -4.189 1.00 . A A . 14 ARG N 1 1 8 2653 1 1 14 ARG NE N 9.769 -5.605 -7.123 1.00 . A A . 14 ARG NE 1 1 8 2654 1 1 14 ARG NH1 N 11.533 -4.358 -6.412 1.00 . A A . 14 ARG NH1 1 1 8 2655 1 1 14 ARG NH2 N 11.504 -6.615 -6.126 1.00 . A A . 14 ARG NH2 1 1 8 2656 1 1 14 ARG O O 6.917 -1.958 -6.266 1.00 . A A . 14 ARG O 1 1 8 2657 1 1 15 GLN C C 4.512 -0.547 -5.057 1.00 . A A . 15 GLN C 1 1 8 2658 1 1 15 GLN CA C 4.142 -1.724 -5.971 1.00 . A A . 15 GLN CA 1 1 8 2659 1 1 15 GLN CB C 2.669 -2.126 -5.774 1.00 . A A . 15 GLN CB 1 1 8 2660 1 1 15 GLN CD C 0.279 -1.401 -5.876 1.00 . A A . 15 GLN CD 1 1 8 2661 1 1 15 GLN CG C 1.725 -0.952 -6.111 1.00 . A A . 15 GLN CG 1 1 8 2662 1 1 15 GLN H H 4.566 -3.708 -5.266 1.00 . A A . 15 GLN H 1 1 8 2663 1 1 15 GLN HA H 4.323 -1.446 -7.000 1.00 . A A . 15 GLN HA 1 1 8 2664 1 1 15 GLN HB2 H 2.442 -2.964 -6.417 1.00 . A A . 15 GLN HB2 1 1 8 2665 1 1 15 GLN HB3 H 2.515 -2.433 -4.749 1.00 . A A . 15 GLN HB3 1 1 8 2666 1 1 15 GLN HE21 H 0.445 -1.299 -3.900 1.00 . A A . 15 GLN HE21 1 1 8 2667 1 1 15 GLN HE22 H -1.073 -1.796 -4.477 1.00 . A A . 15 GLN HE22 1 1 8 2668 1 1 15 GLN HG2 H 1.924 -0.099 -5.479 1.00 . A A . 15 GLN HG2 1 1 8 2669 1 1 15 GLN HG3 H 1.838 -0.659 -7.146 1.00 . A A . 15 GLN HG3 1 1 8 2670 1 1 15 GLN N N 4.992 -2.906 -5.635 1.00 . A A . 15 GLN N 1 1 8 2671 1 1 15 GLN NE2 N -0.152 -1.507 -4.649 1.00 . A A . 15 GLN NE2 1 1 8 2672 1 1 15 GLN O O 4.425 0.599 -5.457 1.00 . A A . 15 GLN O 1 1 8 2673 1 1 15 GLN OE1 O -0.467 -1.659 -6.800 1.00 . A A . 15 GLN OE1 1 1 8 2674 1 1 16 CYS C C 6.767 0.606 -2.958 1.00 . A A . 16 CYS C 1 1 8 2675 1 1 16 CYS CA C 5.304 0.155 -2.856 1.00 . A A . 16 CYS CA 1 1 8 2676 1 1 16 CYS CB C 5.058 -0.386 -1.463 1.00 . A A . 16 CYS CB 1 1 8 2677 1 1 16 CYS H H 4.956 -1.826 -3.607 1.00 . A A . 16 CYS H 1 1 8 2678 1 1 16 CYS HA H 4.667 1.012 -2.990 1.00 . A A . 16 CYS HA 1 1 8 2679 1 1 16 CYS HB2 H 5.701 -1.222 -1.271 1.00 . A A . 16 CYS HB2 1 1 8 2680 1 1 16 CYS HB3 H 5.340 0.387 -0.766 1.00 . A A . 16 CYS HB3 1 1 8 2681 1 1 16 CYS N N 4.913 -0.881 -3.855 1.00 . A A . 16 CYS N 1 1 8 2682 1 1 16 CYS O O 7.116 1.631 -2.403 1.00 . A A . 16 CYS O 1 1 8 2683 1 1 16 CYS SG S 3.377 -0.893 -1.039 1.00 . A A . 16 CYS SG 1 1 8 2684 1 1 17 LYS C C 9.216 1.655 -4.373 1.00 . A A . 17 LYS C 1 1 8 2685 1 1 17 LYS CA C 9.027 0.234 -3.785 1.00 . A A . 17 LYS CA 1 1 8 2686 1 1 17 LYS CB C 9.761 -0.791 -4.693 1.00 . A A . 17 LYS CB 1 1 8 2687 1 1 17 LYS CD C 10.457 -2.269 -2.719 1.00 . A A . 17 LYS CD 1 1 8 2688 1 1 17 LYS CE C 10.439 -3.710 -2.175 1.00 . A A . 17 LYS CE 1 1 8 2689 1 1 17 LYS CG C 9.730 -2.212 -4.086 1.00 . A A . 17 LYS CG 1 1 8 2690 1 1 17 LYS H H 7.252 -0.974 -4.068 1.00 . A A . 17 LYS H 1 1 8 2691 1 1 17 LYS HA H 9.472 0.217 -2.805 1.00 . A A . 17 LYS HA 1 1 8 2692 1 1 17 LYS HB2 H 9.300 -0.826 -5.667 1.00 . A A . 17 LYS HB2 1 1 8 2693 1 1 17 LYS HB3 H 10.790 -0.484 -4.819 1.00 . A A . 17 LYS HB3 1 1 8 2694 1 1 17 LYS HD2 H 11.479 -1.938 -2.831 1.00 . A A . 17 LYS HD2 1 1 8 2695 1 1 17 LYS HD3 H 9.961 -1.632 -2.003 1.00 . A A . 17 LYS HD3 1 1 8 2696 1 1 17 LYS HE2 H 10.926 -4.381 -2.865 1.00 . A A . 17 LYS HE2 1 1 8 2697 1 1 17 LYS HE3 H 10.955 -3.750 -1.227 1.00 . A A . 17 LYS HE3 1 1 8 2698 1 1 17 LYS HG2 H 8.705 -2.504 -3.954 1.00 . A A . 17 LYS HG2 1 1 8 2699 1 1 17 LYS HG3 H 10.196 -2.903 -4.773 1.00 . A A . 17 LYS HG3 1 1 8 2700 1 1 17 LYS HZ1 H 8.613 -4.420 -2.886 1.00 . A A . 17 LYS HZ1 1 1 8 2701 1 1 17 LYS HZ2 H 8.481 -3.423 -1.517 1.00 . A A . 17 LYS HZ2 1 1 8 2702 1 1 17 LYS HZ3 H 9.042 -5.016 -1.355 1.00 . A A . 17 LYS HZ3 1 1 8 2703 1 1 17 LYS N N 7.585 -0.154 -3.647 1.00 . A A . 17 LYS N 1 1 8 2704 1 1 17 LYS NZ N 9.039 -4.177 -1.967 1.00 . A A . 17 LYS NZ 1 1 8 2705 1 1 17 LYS O O 10.007 2.405 -3.835 1.00 . A A . 17 LYS O 1 1 8 2706 1 1 18 HYP C C 8.067 4.489 -5.128 1.00 . A A . 18 HYP C 1 1 8 2707 1 1 18 HYP CA C 8.616 3.358 -6.025 1.00 . A A . 18 HYP CA 1 1 8 2708 1 1 18 HYP CB C 7.878 3.245 -7.360 1.00 . A A . 18 HYP CB 1 1 8 2709 1 1 18 HYP CD C 7.554 1.185 -6.207 1.00 . A A . 18 HYP CD 1 1 8 2710 1 1 18 HYP CG C 6.883 2.168 -7.124 1.00 . A A . 18 HYP CG 1 1 8 2711 1 1 18 HYP HA H 9.649 3.589 -6.246 1.00 . A A . 18 HYP HA 1 1 8 2712 1 1 18 HYP HB2 H 8.575 2.988 -8.145 1.00 . A A . 18 HYP HB2 1 1 8 2713 1 1 18 HYP HB3 H 7.408 4.181 -7.626 1.00 . A A . 18 HYP HB3 1 1 8 2714 1 1 18 HYP HD1 H 6.004 0.761 -8.135 1.00 . A A . 18 HYP HD1 1 1 8 2715 1 1 18 HYP HD22 H 8.067 0.429 -6.784 1.00 . A A . 18 HYP HD22 1 1 8 2716 1 1 18 HYP HD23 H 6.808 0.738 -5.576 1.00 . A A . 18 HYP HD23 1 1 8 2717 1 1 18 HYP HG H 6.002 2.581 -6.654 1.00 . A A . 18 HYP HG 1 1 8 2718 1 1 18 HYP N N 8.514 2.005 -5.434 1.00 . A A . 18 HYP N 1 1 8 2719 1 1 18 HYP O O 8.090 5.632 -5.544 1.00 . A A . 18 HYP O 1 1 8 2720 1 1 18 HYP OD1 O 6.523 1.540 -8.346 1.00 . A A . 18 HYP OD1 1 1 8 2721 1 1 19 HIS C C 8.212 5.876 -2.300 1.00 . A A . 19 HIS C 1 1 8 2722 1 1 19 HIS CA C 7.055 5.207 -3.034 1.00 . A A . 19 HIS CA 1 1 8 2723 1 1 19 HIS CB C 6.097 4.575 -2.004 1.00 . A A . 19 HIS CB 1 1 8 2724 1 1 19 HIS CD2 C 4.734 3.341 -3.935 1.00 . A A . 19 HIS CD2 1 1 8 2725 1 1 19 HIS CE1 C 2.873 3.357 -3.029 1.00 . A A . 19 HIS CE1 1 1 8 2726 1 1 19 HIS CG C 4.875 3.962 -2.704 1.00 . A A . 19 HIS CG 1 1 8 2727 1 1 19 HIS H H 7.607 3.218 -3.651 1.00 . A A . 19 HIS H 1 1 8 2728 1 1 19 HIS HA H 6.528 5.951 -3.617 1.00 . A A . 19 HIS HA 1 1 8 2729 1 1 19 HIS HB2 H 6.601 3.804 -1.443 1.00 . A A . 19 HIS HB2 1 1 8 2730 1 1 19 HIS HB3 H 5.751 5.331 -1.312 1.00 . A A . 19 HIS HB3 1 1 8 2731 1 1 19 HIS HD1 H 3.435 4.297 -1.328 1.00 . A A . 19 HIS HD1 1 1 8 2732 1 1 19 HIS HD2 H 5.530 3.177 -4.641 1.00 . A A . 19 HIS HD2 1 1 8 2733 1 1 19 HIS HE1 H 1.821 3.209 -2.842 1.00 . A A . 19 HIS HE1 1 1 8 2734 1 1 19 HIS N N 7.601 4.154 -3.948 1.00 . A A . 19 HIS N 1 1 8 2735 1 1 19 HIS ND1 N 3.685 3.935 -2.203 1.00 . A A . 19 HIS ND1 1 1 8 2736 1 1 19 HIS NE2 N 3.483 2.971 -4.121 1.00 . A A . 19 HIS NE2 1 1 8 2737 1 1 19 HIS O O 9.176 5.224 -1.956 1.00 . A A . 19 HIS O 1 1 8 2738 1 1 20 ARG C C 9.189 7.524 0.120 1.00 . A A . 20 ARG C 1 1 8 2739 1 1 20 ARG CA C 9.157 7.918 -1.367 1.00 . A A . 20 ARG CA 1 1 8 2740 1 1 20 ARG CB C 8.882 9.436 -1.514 1.00 . A A . 20 ARG CB 1 1 8 2741 1 1 20 ARG CD C 8.185 9.244 -4.023 1.00 . A A . 20 ARG CD 1 1 8 2742 1 1 20 ARG CG C 9.082 9.948 -2.976 1.00 . A A . 20 ARG CG 1 1 8 2743 1 1 20 ARG CZ C 6.080 10.501 -3.866 1.00 . A A . 20 ARG CZ 1 1 8 2744 1 1 20 ARG H H 7.281 7.624 -2.388 1.00 . A A . 20 ARG H 1 1 8 2745 1 1 20 ARG HA H 10.114 7.675 -1.809 1.00 . A A . 20 ARG HA 1 1 8 2746 1 1 20 ARG HB2 H 7.870 9.646 -1.200 1.00 . A A . 20 ARG HB2 1 1 8 2747 1 1 20 ARG HB3 H 9.553 9.982 -0.866 1.00 . A A . 20 ARG HB3 1 1 8 2748 1 1 20 ARG HD2 H 8.335 9.697 -4.992 1.00 . A A . 20 ARG HD2 1 1 8 2749 1 1 20 ARG HD3 H 8.422 8.197 -4.110 1.00 . A A . 20 ARG HD3 1 1 8 2750 1 1 20 ARG HE H 6.293 8.651 -3.193 1.00 . A A . 20 ARG HE 1 1 8 2751 1 1 20 ARG HG2 H 8.880 11.009 -2.997 1.00 . A A . 20 ARG HG2 1 1 8 2752 1 1 20 ARG HG3 H 10.116 9.806 -3.257 1.00 . A A . 20 ARG HG3 1 1 8 2753 1 1 20 ARG HH11 H 7.613 11.466 -4.727 1.00 . A A . 20 ARG HH11 1 1 8 2754 1 1 20 ARG HH12 H 6.131 12.353 -4.625 1.00 . A A . 20 ARG HH12 1 1 8 2755 1 1 20 ARG HH21 H 4.409 9.760 -3.051 1.00 . A A . 20 ARG HH21 1 1 8 2756 1 1 20 ARG HH22 H 4.293 11.378 -3.662 1.00 . A A . 20 ARG HH22 1 1 8 2757 1 1 20 ARG N N 8.085 7.158 -2.081 1.00 . A A . 20 ARG N 1 1 8 2758 1 1 20 ARG NE N 6.747 9.398 -3.633 1.00 . A A . 20 ARG NE 1 1 8 2759 1 1 20 ARG NH1 N 6.653 11.519 -4.453 1.00 . A A . 20 ARG NH1 1 1 8 2760 1 1 20 ARG NH2 N 4.830 10.550 -3.498 1.00 . A A . 20 ARG NH2 1 1 8 2761 1 1 20 ARG O O 10.150 7.792 0.812 1.00 . A A . 20 ARG O 1 1 8 2762 1 1 21 CYS C C 8.585 5.025 2.104 1.00 . A A . 21 CYS C 1 1 8 2763 1 1 21 CYS CA C 7.999 6.441 1.971 1.00 . A A . 21 CYS CA 1 1 8 2764 1 1 21 CYS CB C 6.530 6.365 2.382 1.00 . A A . 21 CYS CB 1 1 8 2765 1 1 21 CYS H H 7.390 6.713 -0.073 1.00 . A A . 21 CYS H 1 1 8 2766 1 1 21 CYS HA H 8.554 7.110 2.612 1.00 . A A . 21 CYS HA 1 1 8 2767 1 1 21 CYS HB2 H 6.078 5.549 1.837 1.00 . A A . 21 CYS HB2 1 1 8 2768 1 1 21 CYS HB3 H 6.502 6.097 3.428 1.00 . A A . 21 CYS HB3 1 1 8 2769 1 1 21 CYS N N 8.124 6.894 0.550 1.00 . A A . 21 CYS N 1 1 8 2770 1 1 21 CYS O O 8.952 4.603 3.185 1.00 . A A . 21 CYS O 1 1 8 2771 1 1 21 CYS SG S 5.427 7.784 2.182 1.00 . A A . 21 CYS SG 1 1 8 2772 1 1 22 . C C 9.933 2.788 -0.378 1.00 . A A . 22 CY3 C 1 1 8 2773 1 1 22 . CA C 9.175 2.954 0.928 1.00 . A A . 22 CY3 CA 1 1 8 2774 1 1 22 . CB C 7.948 2.029 1.048 1.00 . A A . 22 CY3 CB 1 1 8 2775 1 1 22 . H H 8.346 4.754 0.147 1.00 . A A . 22 CY3 H 1 1 8 2776 1 1 22 . HA H 9.858 2.790 1.750 1.00 . A A . 22 CY3 HA 1 1 8 2777 1 1 22 . HB2 H 8.236 1.008 0.851 1.00 . A A . 22 CY3 HB2 1 1 8 2778 1 1 22 . HB3 H 7.230 2.312 0.292 1.00 . A A . 22 CY3 HB3 1 1 8 2779 1 1 22 . HN11 H 10.944 4.462 -0.058 1.00 . A A . 22 CY3 HN11 1 1 8 2780 1 1 22 . HN12 H 11.311 3.663 -1.502 1.00 . A A . 22 CY3 HN12 1 1 8 2781 1 1 22 . N N 8.646 4.346 0.986 1.00 . A A . 22 CY3 N 1 1 8 2782 1 1 22 . N1 N 10.803 3.712 -0.673 1.00 . A A . 22 CY3 N1 1 1 8 2783 1 1 22 . O O 9.750 1.853 -1.128 1.00 . A A . 22 CY3 O 1 1 8 2784 1 1 22 . SG S 7.122 2.147 2.655 1.00 . A A . 22 CY3 SG 1 1 9 2785 1 1 1 PCA C C -3.412 5.745 0.657 1.00 . A A . 1 PCA C 1 1 9 2786 1 1 1 PCA CA C -4.675 5.830 -0.210 1.00 . A A . 1 PCA CA 1 1 9 2787 1 1 1 PCA CB C -4.815 4.628 -1.157 1.00 . A A . 1 PCA CB 1 1 9 2788 1 1 1 PCA CD C -4.896 6.618 -2.453 1.00 . A A . 1 PCA CD 1 1 9 2789 1 1 1 PCA CG C -5.350 5.182 -2.470 1.00 . A A . 1 PCA CG 1 1 9 2790 1 1 1 PCA HA H -5.543 5.883 0.432 1.00 . A A . 1 PCA HA 1 1 9 2791 1 1 1 PCA HB2 H -5.490 3.900 -0.728 1.00 . A A . 1 PCA HB2 1 1 9 2792 1 1 1 PCA HB3 H -3.860 4.142 -1.297 1.00 . A A . 1 PCA HB3 1 1 9 2793 1 1 1 PCA HG2 H -6.429 5.123 -2.494 1.00 . A A . 1 PCA HG2 1 1 9 2794 1 1 1 PCA HG3 H -4.920 4.651 -3.306 1.00 . A A . 1 PCA HG3 1 1 9 2795 1 1 1 PCA N N -4.662 7.030 -1.072 1.00 . A A . 1 PCA N 1 1 9 2796 1 1 1 PCA O O -2.329 6.023 0.178 1.00 . A A . 1 PCA O 1 1 9 2797 1 1 1 PCA OE O -4.751 7.312 -3.439 1.00 . A A . 1 PCA OE 1 1 9 2798 1 1 2 ARG C C -2.197 3.758 3.164 1.00 . A A . 2 ARG C 1 1 9 2799 1 1 2 ARG CA C -2.470 5.238 2.859 1.00 . A A . 2 ARG CA 1 1 9 2800 1 1 2 ARG CB C -2.838 6.018 4.153 1.00 . A A . 2 ARG CB 1 1 9 2801 1 1 2 ARG CD C -1.737 8.164 3.343 1.00 . A A . 2 ARG CD 1 1 9 2802 1 1 2 ARG CG C -3.042 7.529 3.876 1.00 . A A . 2 ARG CG 1 1 9 2803 1 1 2 ARG CZ C -1.825 10.485 4.145 1.00 . A A . 2 ARG CZ 1 1 9 2804 1 1 2 ARG H H -4.517 5.161 2.198 1.00 . A A . 2 ARG H 1 1 9 2805 1 1 2 ARG HA H -1.573 5.651 2.421 1.00 . A A . 2 ARG HA 1 1 9 2806 1 1 2 ARG HB2 H -3.747 5.612 4.571 1.00 . A A . 2 ARG HB2 1 1 9 2807 1 1 2 ARG HB3 H -2.050 5.907 4.882 1.00 . A A . 2 ARG HB3 1 1 9 2808 1 1 2 ARG HD2 H -0.916 8.005 4.027 1.00 . A A . 2 ARG HD2 1 1 9 2809 1 1 2 ARG HD3 H -1.478 7.747 2.382 1.00 . A A . 2 ARG HD3 1 1 9 2810 1 1 2 ARG HE H -2.218 9.967 2.273 1.00 . A A . 2 ARG HE 1 1 9 2811 1 1 2 ARG HG2 H -3.831 7.665 3.152 1.00 . A A . 2 ARG HG2 1 1 9 2812 1 1 2 ARG HG3 H -3.335 8.020 4.793 1.00 . A A . 2 ARG HG3 1 1 9 2813 1 1 2 ARG HH11 H -1.325 9.106 5.516 1.00 . A A . 2 ARG HH11 1 1 9 2814 1 1 2 ARG HH12 H -1.383 10.741 6.080 1.00 . A A . 2 ARG HH12 1 1 9 2815 1 1 2 ARG HH21 H -2.298 12.041 2.978 1.00 . A A . 2 ARG HH21 1 1 9 2816 1 1 2 ARG HH22 H -1.941 12.423 4.629 1.00 . A A . 2 ARG HH22 1 1 9 2817 1 1 2 ARG N N -3.608 5.366 1.896 1.00 . A A . 2 ARG N 1 1 9 2818 1 1 2 ARG NE N -1.962 9.632 3.157 1.00 . A A . 2 ARG NE 1 1 9 2819 1 1 2 ARG NH1 N -1.484 10.078 5.339 1.00 . A A . 2 ARG NH1 1 1 9 2820 1 1 2 ARG NH2 N -2.037 11.748 3.898 1.00 . A A . 2 ARG NH2 1 1 9 2821 1 1 2 ARG O O -2.349 3.293 4.279 1.00 . A A . 2 ARG O 1 1 9 2822 1 1 3 LEU C C 0.018 1.528 2.574 1.00 . A A . 3 LEU C 1 1 9 2823 1 1 3 LEU CA C -1.485 1.602 2.271 1.00 . A A . 3 LEU CA 1 1 9 2824 1 1 3 LEU CB C -1.818 0.868 0.940 1.00 . A A . 3 LEU CB 1 1 9 2825 1 1 3 LEU CD1 C -3.529 0.277 -0.794 1.00 . A A . 3 LEU CD1 1 1 9 2826 1 1 3 LEU CD2 C -4.214 0.353 1.622 1.00 . A A . 3 LEU CD2 1 1 9 2827 1 1 3 LEU CG C -3.310 1.006 0.553 1.00 . A A . 3 LEU CG 1 1 9 2828 1 1 3 LEU H H -1.701 3.492 1.261 1.00 . A A . 3 LEU H 1 1 9 2829 1 1 3 LEU HA H -2.038 1.183 3.095 1.00 . A A . 3 LEU HA 1 1 9 2830 1 1 3 LEU HB2 H -1.228 1.279 0.132 1.00 . A A . 3 LEU HB2 1 1 9 2831 1 1 3 LEU HB3 H -1.567 -0.178 1.041 1.00 . A A . 3 LEU HB3 1 1 9 2832 1 1 3 LEU HD11 H -4.561 0.356 -1.099 1.00 . A A . 3 LEU HD11 1 1 9 2833 1 1 3 LEU HD12 H -3.272 -0.769 -0.704 1.00 . A A . 3 LEU HD12 1 1 9 2834 1 1 3 LEU HD13 H -2.907 0.719 -1.561 1.00 . A A . 3 LEU HD13 1 1 9 2835 1 1 3 LEU HD21 H -4.079 0.831 2.580 1.00 . A A . 3 LEU HD21 1 1 9 2836 1 1 3 LEU HD22 H -3.978 -0.697 1.722 1.00 . A A . 3 LEU HD22 1 1 9 2837 1 1 3 LEU HD23 H -5.250 0.450 1.333 1.00 . A A . 3 LEU HD23 1 1 9 2838 1 1 3 LEU HG H -3.567 2.049 0.441 1.00 . A A . 3 LEU HG 1 1 9 2839 1 1 3 LEU N N -1.797 3.058 2.134 1.00 . A A . 3 LEU N 1 1 9 2840 1 1 3 LEU O O 0.424 1.309 3.696 1.00 . A A . 3 LEU O 1 1 9 2841 1 1 4 CYS C C 2.782 2.762 2.519 1.00 . A A . 4 CYS C 1 1 9 2842 1 1 4 CYS CA C 2.263 1.707 1.537 1.00 . A A . 4 CYS CA 1 1 9 2843 1 1 4 CYS CB C 2.782 2.046 0.134 1.00 . A A . 4 CYS CB 1 1 9 2844 1 1 4 CYS H H 0.338 1.871 0.673 1.00 . A A . 4 CYS H 1 1 9 2845 1 1 4 CYS HA H 2.634 0.745 1.847 1.00 . A A . 4 CYS HA 1 1 9 2846 1 1 4 CYS HB2 H 2.786 3.105 -0.049 1.00 . A A . 4 CYS HB2 1 1 9 2847 1 1 4 CYS HB3 H 3.821 1.760 0.142 1.00 . A A . 4 CYS HB3 1 1 9 2848 1 1 4 CYS N N 0.775 1.720 1.525 1.00 . A A . 4 CYS N 1 1 9 2849 1 1 4 CYS O O 3.546 2.469 3.417 1.00 . A A . 4 CYS O 1 1 9 2850 1 1 4 CYS SG S 2.059 1.293 -1.342 1.00 . A A . 4 CYS SG 1 1 9 2851 1 1 5 CYS C C 2.135 5.037 4.550 1.00 . A A . 5 CYS C 1 1 9 2852 1 1 5 CYS CA C 2.735 5.116 3.144 1.00 . A A . 5 CYS CA 1 1 9 2853 1 1 5 CYS CB C 2.292 6.423 2.468 1.00 . A A . 5 CYS CB 1 1 9 2854 1 1 5 CYS H H 1.699 4.112 1.550 1.00 . A A . 5 CYS H 1 1 9 2855 1 1 5 CYS HA H 3.810 5.102 3.233 1.00 . A A . 5 CYS HA 1 1 9 2856 1 1 5 CYS HB2 H 2.503 6.366 1.411 1.00 . A A . 5 CYS HB2 1 1 9 2857 1 1 5 CYS HB3 H 1.225 6.549 2.589 1.00 . A A . 5 CYS HB3 1 1 9 2858 1 1 5 CYS N N 2.323 3.967 2.291 1.00 . A A . 5 CYS N 1 1 9 2859 1 1 5 CYS O O 2.826 5.269 5.523 1.00 . A A . 5 CYS O 1 1 9 2860 1 1 5 CYS SG S 3.108 7.896 3.126 1.00 . A A . 5 CYS SG 1 1 9 2861 1 1 6 GLY C C 0.806 3.518 6.812 1.00 . A A . 6 GLY C 1 1 9 2862 1 1 6 GLY CA C 0.180 4.605 5.937 1.00 . A A . 6 GLY CA 1 1 9 2863 1 1 6 GLY H H 0.367 4.537 3.790 1.00 . A A . 6 GLY H 1 1 9 2864 1 1 6 GLY HA2 H 0.248 5.556 6.448 1.00 . A A . 6 GLY HA2 1 1 9 2865 1 1 6 GLY HA3 H -0.858 4.365 5.781 1.00 . A A . 6 GLY HA3 1 1 9 2866 1 1 6 GLY N N 0.867 4.711 4.615 1.00 . A A . 6 GLY N 1 1 9 2867 1 1 6 GLY O O 0.865 3.662 8.019 1.00 . A A . 6 GLY O 1 1 9 2868 1 1 7 PHE C C 2.776 0.412 6.053 1.00 . A A . 7 PHE C 1 1 9 2869 1 1 7 PHE CA C 1.887 1.335 6.926 1.00 . A A . 7 PHE CA 1 1 9 2870 1 1 7 PHE CB C 0.749 0.523 7.605 1.00 . A A . 7 PHE CB 1 1 9 2871 1 1 7 PHE CD1 C -0.081 -1.022 5.783 1.00 . A A . 7 PHE CD1 1 1 9 2872 1 1 7 PHE CD2 C -1.511 0.750 6.468 1.00 . A A . 7 PHE CD2 1 1 9 2873 1 1 7 PHE CE1 C -1.026 -1.441 4.873 1.00 . A A . 7 PHE CE1 1 1 9 2874 1 1 7 PHE CE2 C -2.461 0.334 5.558 1.00 . A A . 7 PHE CE2 1 1 9 2875 1 1 7 PHE CG C -0.310 0.071 6.586 1.00 . A A . 7 PHE CG 1 1 9 2876 1 1 7 PHE CZ C -2.218 -0.763 4.759 1.00 . A A . 7 PHE CZ 1 1 9 2877 1 1 7 PHE H H 1.178 2.417 5.202 1.00 . A A . 7 PHE H 1 1 9 2878 1 1 7 PHE HA H 2.500 1.773 7.699 1.00 . A A . 7 PHE HA 1 1 9 2879 1 1 7 PHE HB2 H 1.161 -0.357 8.081 1.00 . A A . 7 PHE HB2 1 1 9 2880 1 1 7 PHE HB3 H 0.270 1.122 8.365 1.00 . A A . 7 PHE HB3 1 1 9 2881 1 1 7 PHE HD1 H 0.855 -1.548 5.869 1.00 . A A . 7 PHE HD1 1 1 9 2882 1 1 7 PHE HD2 H -1.707 1.611 7.090 1.00 . A A . 7 PHE HD2 1 1 9 2883 1 1 7 PHE HE1 H -0.833 -2.301 4.252 1.00 . A A . 7 PHE HE1 1 1 9 2884 1 1 7 PHE HE2 H -3.396 0.869 5.471 1.00 . A A . 7 PHE HE2 1 1 9 2885 1 1 7 PHE HZ H -2.961 -1.090 4.047 1.00 . A A . 7 PHE HZ 1 1 9 2886 1 1 7 PHE N N 1.255 2.463 6.177 1.00 . A A . 7 PHE N 1 1 9 2887 1 1 7 PHE O O 2.461 0.115 4.913 1.00 . A A . 7 PHE O 1 1 9 2888 1 1 8 HYP C C 4.480 -2.123 5.393 1.00 . A A . 8 HYP C 1 1 9 2889 1 1 8 HYP CA C 4.934 -0.749 5.898 1.00 . A A . 8 HYP CA 1 1 9 2890 1 1 8 HYP CB C 6.091 -0.830 6.886 1.00 . A A . 8 HYP CB 1 1 9 2891 1 1 8 HYP CD C 4.246 0.103 8.058 1.00 . A A . 8 HYP CD 1 1 9 2892 1 1 8 HYP CG C 5.405 -0.842 8.208 1.00 . A A . 8 HYP CG 1 1 9 2893 1 1 8 HYP HA H 5.261 -0.168 5.048 1.00 . A A . 8 HYP HA 1 1 9 2894 1 1 8 HYP HB2 H 6.742 0.025 6.769 1.00 . A A . 8 HYP HB2 1 1 9 2895 1 1 8 HYP HB3 H 6.680 -1.722 6.724 1.00 . A A . 8 HYP HB3 1 1 9 2896 1 1 8 HYP HD1 H 6.589 -1.176 9.712 1.00 . A A . 8 HYP HD1 1 1 9 2897 1 1 8 HYP HD22 H 4.550 1.116 8.287 1.00 . A A . 8 HYP HD22 1 1 9 2898 1 1 8 HYP HD23 H 3.434 -0.202 8.702 1.00 . A A . 8 HYP HD23 1 1 9 2899 1 1 8 HYP HG H 5.049 -1.839 8.430 1.00 . A A . 8 HYP HG 1 1 9 2900 1 1 8 HYP N N 3.875 -0.027 6.631 1.00 . A A . 8 HYP N 1 1 9 2901 1 1 8 HYP O O 5.214 -2.765 4.665 1.00 . A A . 8 HYP O 1 1 9 2902 1 1 8 HYP OD1 O 6.289 -0.403 9.229 1.00 . A A . 8 HYP OD1 1 1 9 2903 1 1 9 LYS C C 2.647 -3.815 3.828 1.00 . A A . 9 LYS C 1 1 9 2904 1 1 9 LYS CA C 2.771 -3.847 5.351 1.00 . A A . 9 LYS CA 1 1 9 2905 1 1 9 LYS CB C 1.379 -4.120 5.972 1.00 . A A . 9 LYS CB 1 1 9 2906 1 1 9 LYS CD C 2.404 -4.917 8.175 1.00 . A A . 9 LYS CD 1 1 9 2907 1 1 9 LYS CE C 2.433 -4.667 9.692 1.00 . A A . 9 LYS CE 1 1 9 2908 1 1 9 LYS CG C 1.412 -3.934 7.509 1.00 . A A . 9 LYS CG 1 1 9 2909 1 1 9 LYS H H 2.756 -1.952 6.378 1.00 . A A . 9 LYS H 1 1 9 2910 1 1 9 LYS HA H 3.475 -4.618 5.628 1.00 . A A . 9 LYS HA 1 1 9 2911 1 1 9 LYS HB2 H 0.623 -3.501 5.523 1.00 . A A . 9 LYS HB2 1 1 9 2912 1 1 9 LYS HB3 H 1.115 -5.148 5.764 1.00 . A A . 9 LYS HB3 1 1 9 2913 1 1 9 LYS HD2 H 2.098 -5.934 7.984 1.00 . A A . 9 LYS HD2 1 1 9 2914 1 1 9 LYS HD3 H 3.400 -4.775 7.782 1.00 . A A . 9 LYS HD3 1 1 9 2915 1 1 9 LYS HE2 H 1.447 -4.795 10.114 1.00 . A A . 9 LYS HE2 1 1 9 2916 1 1 9 LYS HE3 H 3.109 -5.360 10.168 1.00 . A A . 9 LYS HE3 1 1 9 2917 1 1 9 LYS HG2 H 1.689 -2.916 7.743 1.00 . A A . 9 LYS HG2 1 1 9 2918 1 1 9 LYS HG3 H 0.419 -4.109 7.901 1.00 . A A . 9 LYS HG3 1 1 9 2919 1 1 9 LYS HZ1 H 3.502 -3.280 10.820 1.00 . A A . 9 LYS HZ1 1 1 9 2920 1 1 9 LYS HZ2 H 2.073 -2.664 10.140 1.00 . A A . 9 LYS HZ2 1 1 9 2921 1 1 9 LYS HZ3 H 3.437 -2.918 9.163 1.00 . A A . 9 LYS HZ3 1 1 9 2922 1 1 9 LYS N N 3.296 -2.521 5.792 1.00 . A A . 9 LYS N 1 1 9 2923 1 1 9 LYS NZ N 2.897 -3.277 9.975 1.00 . A A . 9 LYS NZ 1 1 9 2924 1 1 9 LYS O O 2.933 -4.813 3.193 1.00 . A A . 9 LYS O 1 1 9 2925 1 1 10 SER C C 3.503 -2.366 1.187 1.00 . A A . 10 SER C 1 1 9 2926 1 1 10 SER CA C 2.118 -2.655 1.790 1.00 . A A . 10 SER CA 1 1 9 2927 1 1 10 SER CB C 1.093 -1.574 1.427 1.00 . A A . 10 SER CB 1 1 9 2928 1 1 10 SER H H 2.005 -1.878 3.779 1.00 . A A . 10 SER H 1 1 9 2929 1 1 10 SER HA H 1.773 -3.613 1.428 1.00 . A A . 10 SER HA 1 1 9 2930 1 1 10 SER HB2 H 1.324 -0.648 1.913 1.00 . A A . 10 SER HB2 1 1 9 2931 1 1 10 SER HB3 H 0.981 -1.436 0.362 1.00 . A A . 10 SER HB3 1 1 9 2932 1 1 10 SER HG H -0.364 -2.859 1.499 1.00 . A A . 10 SER HG 1 1 9 2933 1 1 10 SER N N 2.236 -2.692 3.271 1.00 . A A . 10 SER N 1 1 9 2934 1 1 10 SER O O 3.746 -2.756 0.064 1.00 . A A . 10 SER O 1 1 9 2935 1 1 10 SER OG O -0.123 -2.060 1.974 1.00 . A A . 10 SER OG 1 1 9 2936 1 1 11 CYS C C 6.568 -2.640 1.023 1.00 . A A . 11 CYS C 1 1 9 2937 1 1 11 CYS CA C 5.749 -1.397 1.406 1.00 . A A . 11 CYS CA 1 1 9 2938 1 1 11 CYS CB C 6.581 -0.614 2.443 1.00 . A A . 11 CYS CB 1 1 9 2939 1 1 11 CYS H H 4.120 -1.422 2.833 1.00 . A A . 11 CYS H 1 1 9 2940 1 1 11 CYS HA H 5.651 -0.775 0.534 1.00 . A A . 11 CYS HA 1 1 9 2941 1 1 11 CYS HB2 H 6.588 -1.185 3.359 1.00 . A A . 11 CYS HB2 1 1 9 2942 1 1 11 CYS HB3 H 7.603 -0.576 2.093 1.00 . A A . 11 CYS HB3 1 1 9 2943 1 1 11 CYS N N 4.372 -1.709 1.931 1.00 . A A . 11 CYS N 1 1 9 2944 1 1 11 CYS O O 7.588 -2.517 0.371 1.00 . A A . 11 CYS O 1 1 9 2945 1 1 11 CYS SG S 6.138 1.083 2.884 1.00 . A A . 11 CYS SG 1 1 9 2946 1 1 12 ARG C C 6.537 -5.470 -0.353 1.00 . A A . 12 ARG C 1 1 9 2947 1 1 12 ARG CA C 6.837 -5.061 1.104 1.00 . A A . 12 ARG CA 1 1 9 2948 1 1 12 ARG CB C 6.363 -6.144 2.106 1.00 . A A . 12 ARG CB 1 1 9 2949 1 1 12 ARG CD C 8.631 -7.298 2.202 1.00 . A A . 12 ARG CD 1 1 9 2950 1 1 12 ARG CG C 7.120 -7.487 1.929 1.00 . A A . 12 ARG CG 1 1 9 2951 1 1 12 ARG CZ C 9.708 -9.059 0.869 1.00 . A A . 12 ARG CZ 1 1 9 2952 1 1 12 ARG H H 5.274 -3.832 1.946 1.00 . A A . 12 ARG H 1 1 9 2953 1 1 12 ARG HA H 7.897 -4.883 1.207 1.00 . A A . 12 ARG HA 1 1 9 2954 1 1 12 ARG HB2 H 6.512 -5.782 3.113 1.00 . A A . 12 ARG HB2 1 1 9 2955 1 1 12 ARG HB3 H 5.305 -6.316 1.968 1.00 . A A . 12 ARG HB3 1 1 9 2956 1 1 12 ARG HD2 H 9.077 -6.585 1.524 1.00 . A A . 12 ARG HD2 1 1 9 2957 1 1 12 ARG HD3 H 8.785 -6.956 3.216 1.00 . A A . 12 ARG HD3 1 1 9 2958 1 1 12 ARG HE H 9.476 -9.173 2.832 1.00 . A A . 12 ARG HE 1 1 9 2959 1 1 12 ARG HG2 H 6.725 -8.206 2.630 1.00 . A A . 12 ARG HG2 1 1 9 2960 1 1 12 ARG HG3 H 6.971 -7.875 0.932 1.00 . A A . 12 ARG HG3 1 1 9 2961 1 1 12 ARG HH11 H 9.057 -7.464 -0.160 1.00 . A A . 12 ARG HH11 1 1 9 2962 1 1 12 ARG HH12 H 9.820 -8.704 -1.097 1.00 . A A . 12 ARG HH12 1 1 9 2963 1 1 12 ARG HH21 H 10.438 -10.742 1.665 1.00 . A A . 12 ARG HH21 1 1 9 2964 1 1 12 ARG HH22 H 10.613 -10.588 -0.051 1.00 . A A . 12 ARG HH22 1 1 9 2965 1 1 12 ARG N N 6.105 -3.795 1.427 1.00 . A A . 12 ARG N 1 1 9 2966 1 1 12 ARG NE N 9.314 -8.619 2.040 1.00 . A A . 12 ARG NE 1 1 9 2967 1 1 12 ARG NH1 N 9.513 -8.353 -0.213 1.00 . A A . 12 ARG NH1 1 1 9 2968 1 1 12 ARG NH2 N 10.299 -10.221 0.824 1.00 . A A . 12 ARG NH2 1 1 9 2969 1 1 12 ARG O O 7.242 -6.274 -0.932 1.00 . A A . 12 ARG O 1 1 9 2970 1 1 13 SER C C 5.949 -4.394 -3.285 1.00 . A A . 13 SER C 1 1 9 2971 1 1 13 SER CA C 5.070 -5.172 -2.296 1.00 . A A . 13 SER CA 1 1 9 2972 1 1 13 SER CB C 3.597 -4.749 -2.464 1.00 . A A . 13 SER CB 1 1 9 2973 1 1 13 SER H H 4.982 -4.250 -0.360 1.00 . A A . 13 SER H 1 1 9 2974 1 1 13 SER HA H 5.171 -6.231 -2.487 1.00 . A A . 13 SER HA 1 1 9 2975 1 1 13 SER HB2 H 2.946 -5.293 -1.795 1.00 . A A . 13 SER HB2 1 1 9 2976 1 1 13 SER HB3 H 3.477 -3.685 -2.319 1.00 . A A . 13 SER HB3 1 1 9 2977 1 1 13 SER HG H 3.769 -5.852 -4.063 1.00 . A A . 13 SER HG 1 1 9 2978 1 1 13 SER N N 5.495 -4.888 -0.892 1.00 . A A . 13 SER N 1 1 9 2979 1 1 13 SER O O 6.445 -3.328 -2.973 1.00 . A A . 13 SER O 1 1 9 2980 1 1 13 SER OG O 3.270 -5.072 -3.810 1.00 . A A . 13 SER OG 1 1 9 2981 1 1 14 ARG C C 6.260 -3.018 -5.953 1.00 . A A . 14 ARG C 1 1 9 2982 1 1 14 ARG CA C 6.929 -4.337 -5.529 1.00 . A A . 14 ARG CA 1 1 9 2983 1 1 14 ARG CB C 7.012 -5.321 -6.712 1.00 . A A . 14 ARG CB 1 1 9 2984 1 1 14 ARG CD C 7.920 -5.721 -9.056 1.00 . A A . 14 ARG CD 1 1 9 2985 1 1 14 ARG CG C 7.872 -4.738 -7.863 1.00 . A A . 14 ARG CG 1 1 9 2986 1 1 14 ARG CZ C 7.848 -8.058 -8.257 1.00 . A A . 14 ARG CZ 1 1 9 2987 1 1 14 ARG H H 5.669 -5.830 -4.621 1.00 . A A . 14 ARG H 1 1 9 2988 1 1 14 ARG HA H 7.916 -4.128 -5.139 1.00 . A A . 14 ARG HA 1 1 9 2989 1 1 14 ARG HB2 H 7.455 -6.240 -6.359 1.00 . A A . 14 ARG HB2 1 1 9 2990 1 1 14 ARG HB3 H 6.016 -5.538 -7.071 1.00 . A A . 14 ARG HB3 1 1 9 2991 1 1 14 ARG HD2 H 6.931 -5.904 -9.448 1.00 . A A . 14 ARG HD2 1 1 9 2992 1 1 14 ARG HD3 H 8.526 -5.299 -9.844 1.00 . A A . 14 ARG HD3 1 1 9 2993 1 1 14 ARG HE H 9.528 -7.082 -8.618 1.00 . A A . 14 ARG HE 1 1 9 2994 1 1 14 ARG HG2 H 7.450 -3.804 -8.203 1.00 . A A . 14 ARG HG2 1 1 9 2995 1 1 14 ARG HG3 H 8.876 -4.552 -7.510 1.00 . A A . 14 ARG HG3 1 1 9 2996 1 1 14 ARG HH11 H 6.053 -7.195 -8.516 1.00 . A A . 14 ARG HH11 1 1 9 2997 1 1 14 ARG HH12 H 6.028 -8.834 -7.964 1.00 . A A . 14 ARG HH12 1 1 9 2998 1 1 14 ARG HH21 H 9.496 -9.142 -7.922 1.00 . A A . 14 ARG HH21 1 1 9 2999 1 1 14 ARG HH22 H 7.992 -9.948 -7.619 1.00 . A A . 14 ARG HH22 1 1 9 3000 1 1 14 ARG N N 6.104 -4.969 -4.451 1.00 . A A . 14 ARG N 1 1 9 3001 1 1 14 ARG NE N 8.551 -7.012 -8.624 1.00 . A A . 14 ARG NE 1 1 9 3002 1 1 14 ARG NH1 N 6.541 -8.024 -8.246 1.00 . A A . 14 ARG NH1 1 1 9 3003 1 1 14 ARG NH2 N 8.497 -9.133 -7.905 1.00 . A A . 14 ARG NH2 1 1 9 3004 1 1 14 ARG O O 6.924 -2.075 -6.334 1.00 . A A . 14 ARG O 1 1 9 3005 1 1 15 GLN C C 4.527 -0.656 -5.308 1.00 . A A . 15 GLN C 1 1 9 3006 1 1 15 GLN CA C 4.143 -1.812 -6.240 1.00 . A A . 15 GLN CA 1 1 9 3007 1 1 15 GLN CB C 2.644 -2.198 -6.100 1.00 . A A . 15 GLN CB 1 1 9 3008 1 1 15 GLN CD C 1.793 0.171 -5.567 1.00 . A A . 15 GLN CD 1 1 9 3009 1 1 15 GLN CG C 1.673 -1.048 -6.497 1.00 . A A . 15 GLN CG 1 1 9 3010 1 1 15 GLN H H 4.493 -3.818 -5.549 1.00 . A A . 15 GLN H 1 1 9 3011 1 1 15 GLN HA H 4.370 -1.539 -7.261 1.00 . A A . 15 GLN HA 1 1 9 3012 1 1 15 GLN HB2 H 2.446 -3.048 -6.736 1.00 . A A . 15 GLN HB2 1 1 9 3013 1 1 15 GLN HB3 H 2.447 -2.494 -5.080 1.00 . A A . 15 GLN HB3 1 1 9 3014 1 1 15 GLN HE21 H 1.605 -0.904 -3.908 1.00 . A A . 15 GLN HE21 1 1 9 3015 1 1 15 GLN HE22 H 1.802 0.766 -3.674 1.00 . A A . 15 GLN HE22 1 1 9 3016 1 1 15 GLN HG2 H 1.881 -0.731 -7.510 1.00 . A A . 15 GLN HG2 1 1 9 3017 1 1 15 GLN HG3 H 0.656 -1.408 -6.455 1.00 . A A . 15 GLN HG3 1 1 9 3018 1 1 15 GLN N N 4.952 -3.014 -5.867 1.00 . A A . 15 GLN N 1 1 9 3019 1 1 15 GLN NE2 N 1.728 -0.003 -4.275 1.00 . A A . 15 GLN NE2 1 1 9 3020 1 1 15 GLN O O 4.766 0.448 -5.757 1.00 . A A . 15 GLN O 1 1 9 3021 1 1 15 GLN OE1 O 1.951 1.292 -6.007 1.00 . A A . 15 GLN OE1 1 1 9 3022 1 1 16 CYS C C 6.427 0.331 -2.853 1.00 . A A . 16 CYS C 1 1 9 3023 1 1 16 CYS CA C 4.923 0.060 -3.006 1.00 . A A . 16 CYS CA 1 1 9 3024 1 1 16 CYS CB C 4.434 -0.375 -1.656 1.00 . A A . 16 CYS CB 1 1 9 3025 1 1 16 CYS H H 4.351 -1.873 -3.747 1.00 . A A . 16 CYS H 1 1 9 3026 1 1 16 CYS HA H 4.431 0.985 -3.255 1.00 . A A . 16 CYS HA 1 1 9 3027 1 1 16 CYS HB2 H 4.930 -1.294 -1.409 1.00 . A A . 16 CYS HB2 1 1 9 3028 1 1 16 CYS HB3 H 4.780 0.362 -0.951 1.00 . A A . 16 CYS HB3 1 1 9 3029 1 1 16 CYS N N 4.565 -0.960 -4.036 1.00 . A A . 16 CYS N 1 1 9 3030 1 1 16 CYS O O 6.801 1.336 -2.279 1.00 . A A . 16 CYS O 1 1 9 3031 1 1 16 CYS SG S 2.682 -0.620 -1.309 1.00 . A A . 16 CYS SG 1 1 9 3032 1 1 17 LYS C C 9.270 1.014 -3.594 1.00 . A A . 17 LYS C 1 1 9 3033 1 1 17 LYS CA C 8.725 -0.402 -3.264 1.00 . A A . 17 LYS CA 1 1 9 3034 1 1 17 LYS CB C 9.380 -1.463 -4.199 1.00 . A A . 17 LYS CB 1 1 9 3035 1 1 17 LYS CD C 11.431 -1.727 -2.696 1.00 . A A . 17 LYS CD 1 1 9 3036 1 1 17 LYS CE C 12.966 -1.668 -2.655 1.00 . A A . 17 LYS CE 1 1 9 3037 1 1 17 LYS CG C 10.932 -1.416 -4.132 1.00 . A A . 17 LYS CG 1 1 9 3038 1 1 17 LYS H H 6.865 -1.345 -3.820 1.00 . A A . 17 LYS H 1 1 9 3039 1 1 17 LYS HA H 8.990 -0.628 -2.243 1.00 . A A . 17 LYS HA 1 1 9 3040 1 1 17 LYS HB2 H 9.045 -2.446 -3.903 1.00 . A A . 17 LYS HB2 1 1 9 3041 1 1 17 LYS HB3 H 9.077 -1.302 -5.222 1.00 . A A . 17 LYS HB3 1 1 9 3042 1 1 17 LYS HD2 H 11.043 -1.004 -1.995 1.00 . A A . 17 LYS HD2 1 1 9 3043 1 1 17 LYS HD3 H 11.096 -2.710 -2.398 1.00 . A A . 17 LYS HD3 1 1 9 3044 1 1 17 LYS HE2 H 13.319 -1.904 -1.660 1.00 . A A . 17 LYS HE2 1 1 9 3045 1 1 17 LYS HE3 H 13.392 -2.374 -3.353 1.00 . A A . 17 LYS HE3 1 1 9 3046 1 1 17 LYS HG2 H 11.329 -2.154 -4.812 1.00 . A A . 17 LYS HG2 1 1 9 3047 1 1 17 LYS HG3 H 11.283 -0.444 -4.447 1.00 . A A . 17 LYS HG3 1 1 9 3048 1 1 17 LYS HZ1 H 13.517 -0.222 -4.046 1.00 . A A . 17 LYS HZ1 1 1 9 3049 1 1 17 LYS HZ2 H 14.364 -0.124 -2.577 1.00 . A A . 17 LYS HZ2 1 1 9 3050 1 1 17 LYS HZ3 H 12.750 0.402 -2.664 1.00 . A A . 17 LYS HZ3 1 1 9 3051 1 1 17 LYS N N 7.238 -0.561 -3.365 1.00 . A A . 17 LYS N 1 1 9 3052 1 1 17 LYS NZ N 13.435 -0.299 -3.013 1.00 . A A . 17 LYS NZ 1 1 9 3053 1 1 17 LYS O O 10.096 1.506 -2.849 1.00 . A A . 17 LYS O 1 1 9 3054 1 1 18 HYP C C 8.734 4.161 -4.506 1.00 . A A . 18 HYP C 1 1 9 3055 1 1 18 HYP CA C 9.388 2.911 -5.133 1.00 . A A . 18 HYP CA 1 1 9 3056 1 1 18 HYP CB C 9.229 2.819 -6.642 1.00 . A A . 18 HYP CB 1 1 9 3057 1 1 18 HYP CD C 7.728 1.228 -5.567 1.00 . A A . 18 HYP CD 1 1 9 3058 1 1 18 HYP CG C 7.971 2.023 -6.835 1.00 . A A . 18 HYP CG 1 1 9 3059 1 1 18 HYP HA H 10.448 2.955 -4.923 1.00 . A A . 18 HYP HA 1 1 9 3060 1 1 18 HYP HB2 H 10.091 2.328 -7.071 1.00 . A A . 18 HYP HB2 1 1 9 3061 1 1 18 HYP HB3 H 9.160 3.803 -7.084 1.00 . A A . 18 HYP HB3 1 1 9 3062 1 1 18 HYP HD1 H 8.747 0.467 -7.705 1.00 . A A . 18 HYP HD1 1 1 9 3063 1 1 18 HYP HD22 H 7.756 0.172 -5.774 1.00 . A A . 18 HYP HD22 1 1 9 3064 1 1 18 HYP HD23 H 6.776 1.500 -5.144 1.00 . A A . 18 HYP HD23 1 1 9 3065 1 1 18 HYP HG H 7.145 2.697 -7.009 1.00 . A A . 18 HYP HG 1 1 9 3066 1 1 18 HYP N N 8.821 1.635 -4.663 1.00 . A A . 18 HYP N 1 1 9 3067 1 1 18 HYP O O 9.042 5.262 -4.923 1.00 . A A . 18 HYP O 1 1 9 3068 1 1 18 HYP OD1 O 8.113 1.148 -7.945 1.00 . A A . 18 HYP OD1 1 1 9 3069 1 1 19 HIS C C 8.163 5.926 -2.031 1.00 . A A . 19 HIS C 1 1 9 3070 1 1 19 HIS CA C 7.191 5.125 -2.885 1.00 . A A . 19 HIS CA 1 1 9 3071 1 1 19 HIS CB C 6.028 4.626 -1.992 1.00 . A A . 19 HIS CB 1 1 9 3072 1 1 19 HIS CD2 C 4.910 3.421 -4.091 1.00 . A A . 19 HIS CD2 1 1 9 3073 1 1 19 HIS CE1 C 2.965 3.360 -3.388 1.00 . A A . 19 HIS CE1 1 1 9 3074 1 1 19 HIS CG C 4.905 4.004 -2.835 1.00 . A A . 19 HIS CG 1 1 9 3075 1 1 19 HIS H H 7.656 3.056 -3.238 1.00 . A A . 19 HIS H 1 1 9 3076 1 1 19 HIS HA H 6.814 5.777 -3.653 1.00 . A A . 19 HIS HA 1 1 9 3077 1 1 19 HIS HB2 H 6.389 3.881 -1.298 1.00 . A A . 19 HIS HB2 1 1 9 3078 1 1 19 HIS HB3 H 5.614 5.451 -1.428 1.00 . A A . 19 HIS HB3 1 1 9 3079 1 1 19 HIS HD1 H 3.320 4.256 -1.609 1.00 . A A . 19 HIS HD1 1 1 9 3080 1 1 19 HIS HD2 H 5.780 3.307 -4.711 1.00 . A A . 19 HIS HD2 1 1 9 3081 1 1 19 HIS HE1 H 1.901 3.181 -3.319 1.00 . A A . 19 HIS HE1 1 1 9 3082 1 1 19 HIS N N 7.867 3.962 -3.540 1.00 . A A . 19 HIS N 1 1 9 3083 1 1 19 HIS ND1 N 3.669 3.929 -2.464 1.00 . A A . 19 HIS ND1 1 1 9 3084 1 1 19 HIS NE2 N 3.697 3.027 -4.421 1.00 . A A . 19 HIS NE2 1 1 9 3085 1 1 19 HIS O O 9.066 5.372 -1.442 1.00 . A A . 19 HIS O 1 1 9 3086 1 1 20 ARG C C 8.607 7.874 0.298 1.00 . A A . 20 ARG C 1 1 9 3087 1 1 20 ARG CA C 8.803 8.137 -1.204 1.00 . A A . 20 ARG CA 1 1 9 3088 1 1 20 ARG CB C 8.420 9.593 -1.525 1.00 . A A . 20 ARG CB 1 1 9 3089 1 1 20 ARG CD C 8.198 11.334 -3.317 1.00 . A A . 20 ARG CD 1 1 9 3090 1 1 20 ARG CG C 8.604 9.876 -3.030 1.00 . A A . 20 ARG CG 1 1 9 3091 1 1 20 ARG CZ C 7.482 11.200 -5.663 1.00 . A A . 20 ARG CZ 1 1 9 3092 1 1 20 ARG H H 7.182 7.582 -2.509 1.00 . A A . 20 ARG H 1 1 9 3093 1 1 20 ARG HA H 9.837 7.956 -1.460 1.00 . A A . 20 ARG HA 1 1 9 3094 1 1 20 ARG HB2 H 7.391 9.767 -1.245 1.00 . A A . 20 ARG HB2 1 1 9 3095 1 1 20 ARG HB3 H 9.049 10.262 -0.955 1.00 . A A . 20 ARG HB3 1 1 9 3096 1 1 20 ARG HD2 H 7.171 11.514 -3.032 1.00 . A A . 20 ARG HD2 1 1 9 3097 1 1 20 ARG HD3 H 8.835 12.013 -2.770 1.00 . A A . 20 ARG HD3 1 1 9 3098 1 1 20 ARG HE H 9.147 12.106 -5.087 1.00 . A A . 20 ARG HE 1 1 9 3099 1 1 20 ARG HG2 H 9.637 9.726 -3.311 1.00 . A A . 20 ARG HG2 1 1 9 3100 1 1 20 ARG HG3 H 7.986 9.206 -3.610 1.00 . A A . 20 ARG HG3 1 1 9 3101 1 1 20 ARG HH11 H 6.271 10.321 -4.327 1.00 . A A . 20 ARG HH11 1 1 9 3102 1 1 20 ARG HH12 H 5.759 10.230 -5.979 1.00 . A A . 20 ARG HH12 1 1 9 3103 1 1 20 ARG HH21 H 8.517 11.998 -7.178 1.00 . A A . 20 ARG HH21 1 1 9 3104 1 1 20 ARG HH22 H 7.048 11.189 -7.617 1.00 . A A . 20 ARG HH22 1 1 9 3105 1 1 20 ARG N N 7.935 7.214 -2.001 1.00 . A A . 20 ARG N 1 1 9 3106 1 1 20 ARG NE N 8.361 11.606 -4.779 1.00 . A A . 20 ARG NE 1 1 9 3107 1 1 20 ARG NH1 N 6.422 10.532 -5.293 1.00 . A A . 20 ARG NH1 1 1 9 3108 1 1 20 ARG NH2 N 7.699 11.485 -6.918 1.00 . A A . 20 ARG NH2 1 1 9 3109 1 1 20 ARG O O 9.430 8.256 1.108 1.00 . A A . 20 ARG O 1 1 9 3110 1 1 21 CYS C C 7.868 5.575 2.423 1.00 . A A . 21 CYS C 1 1 9 3111 1 1 21 CYS CA C 7.182 6.894 2.032 1.00 . A A . 21 CYS CA 1 1 9 3112 1 1 21 CYS CB C 5.679 6.726 2.178 1.00 . A A . 21 CYS CB 1 1 9 3113 1 1 21 CYS H H 6.903 6.940 -0.104 1.00 . A A . 21 CYS H 1 1 9 3114 1 1 21 CYS HA H 7.534 7.685 2.679 1.00 . A A . 21 CYS HA 1 1 9 3115 1 1 21 CYS HB2 H 5.382 5.866 1.594 1.00 . A A . 21 CYS HB2 1 1 9 3116 1 1 21 CYS HB3 H 5.485 6.491 3.214 1.00 . A A . 21 CYS HB3 1 1 9 3117 1 1 21 CYS N N 7.514 7.223 0.611 1.00 . A A . 21 CYS N 1 1 9 3118 1 1 21 CYS O O 8.140 5.338 3.584 1.00 . A A . 21 CYS O 1 1 9 3119 1 1 21 CYS SG S 4.557 8.073 1.730 1.00 . A A . 21 CYS SG 1 1 9 3120 1 1 22 . C C 10.206 3.584 1.075 1.00 . A A . 22 CY3 C 1 1 9 3121 1 1 22 . CA C 8.780 3.442 1.624 1.00 . A A . 22 CY3 CA 1 1 9 3122 1 1 22 . CB C 8.034 2.360 0.834 1.00 . A A . 22 CY3 CB 1 1 9 3123 1 1 22 . H H 7.881 5.031 0.511 1.00 . A A . 22 CY3 H 1 1 9 3124 1 1 22 . HA H 8.824 3.195 2.674 1.00 . A A . 22 CY3 HA 1 1 9 3125 1 1 22 . HB2 H 8.539 1.421 1.008 1.00 . A A . 22 CY3 HB2 1 1 9 3126 1 1 22 . HB3 H 8.143 2.584 -0.217 1.00 . A A . 22 CY3 HB3 1 1 9 3127 1 1 22 . HN11 H 9.895 5.464 0.531 1.00 . A A . 22 CY3 HN11 1 1 9 3128 1 1 22 . HN12 H 11.430 4.871 0.171 1.00 . A A . 22 CY3 HN12 1 1 9 3129 1 1 22 . N N 8.119 4.767 1.424 1.00 . A A . 22 CY3 N 1 1 9 3130 1 1 22 . N1 N 10.545 4.730 0.550 1.00 . A A . 22 CY3 N1 1 1 9 3131 1 1 22 . O O 11.004 2.668 1.105 1.00 . A A . 22 CY3 O 1 1 9 3132 1 1 22 . SG S 6.271 2.065 1.123 1.00 . A A . 22 CY3 SG 1 1 10 3133 1 1 1 PCA C C -4.354 4.758 -0.008 1.00 . A A . 1 PCA C 1 1 10 3134 1 1 1 PCA CA C -5.827 4.449 -0.326 1.00 . A A . 1 PCA CA 1 1 10 3135 1 1 1 PCA CB C -6.003 3.398 -1.440 1.00 . A A . 1 PCA CB 1 1 10 3136 1 1 1 PCA CD C -6.916 5.455 -2.204 1.00 . A A . 1 PCA CD 1 1 10 3137 1 1 1 PCA CG C -6.289 4.183 -2.714 1.00 . A A . 1 PCA CG 1 1 10 3138 1 1 1 PCA HA H -6.321 4.104 0.571 1.00 . A A . 1 PCA HA 1 1 10 3139 1 1 1 PCA HB2 H -6.823 2.740 -1.191 1.00 . A A . 1 PCA HB2 1 1 10 3140 1 1 1 PCA HB3 H -5.118 2.787 -1.540 1.00 . A A . 1 PCA HB3 1 1 10 3141 1 1 1 PCA HG2 H -6.978 3.641 -3.347 1.00 . A A . 1 PCA HG2 1 1 10 3142 1 1 1 PCA HG3 H -5.371 4.395 -3.241 1.00 . A A . 1 PCA HG3 1 1 10 3143 1 1 1 PCA N N -6.528 5.657 -0.811 1.00 . A A . 1 PCA N 1 1 10 3144 1 1 1 PCA O O -3.496 4.607 -0.857 1.00 . A A . 1 PCA O 1 1 10 3145 1 1 1 PCA OE O -7.630 6.189 -2.858 1.00 . A A . 1 PCA OE 1 1 10 3146 1 1 2 ARG C C -2.155 4.230 2.275 1.00 . A A . 2 ARG C 1 1 10 3147 1 1 2 ARG CA C -2.748 5.526 1.677 1.00 . A A . 2 ARG CA 1 1 10 3148 1 1 2 ARG CB C -2.884 6.655 2.733 1.00 . A A . 2 ARG CB 1 1 10 3149 1 1 2 ARG CD C -0.849 7.988 1.998 1.00 . A A . 2 ARG CD 1 1 10 3150 1 1 2 ARG CG C -1.517 7.237 3.178 1.00 . A A . 2 ARG CG 1 1 10 3151 1 1 2 ARG CZ C 0.495 9.617 3.260 1.00 . A A . 2 ARG CZ 1 1 10 3152 1 1 2 ARG H H -4.880 5.279 1.833 1.00 . A A . 2 ARG H 1 1 10 3153 1 1 2 ARG HA H -2.149 5.840 0.835 1.00 . A A . 2 ARG HA 1 1 10 3154 1 1 2 ARG HB2 H -3.485 7.452 2.319 1.00 . A A . 2 ARG HB2 1 1 10 3155 1 1 2 ARG HB3 H -3.400 6.268 3.600 1.00 . A A . 2 ARG HB3 1 1 10 3156 1 1 2 ARG HD2 H -0.638 7.312 1.184 1.00 . A A . 2 ARG HD2 1 1 10 3157 1 1 2 ARG HD3 H -1.491 8.779 1.638 1.00 . A A . 2 ARG HD3 1 1 10 3158 1 1 2 ARG HE H 1.287 8.187 2.147 1.00 . A A . 2 ARG HE 1 1 10 3159 1 1 2 ARG HG2 H -1.681 7.912 4.004 1.00 . A A . 2 ARG HG2 1 1 10 3160 1 1 2 ARG HG3 H -0.864 6.446 3.512 1.00 . A A . 2 ARG HG3 1 1 10 3161 1 1 2 ARG HH11 H -1.493 9.821 3.421 1.00 . A A . 2 ARG HH11 1 1 10 3162 1 1 2 ARG HH12 H -0.548 10.965 4.311 1.00 . A A . 2 ARG HH12 1 1 10 3163 1 1 2 ARG HH21 H 2.496 9.625 3.262 1.00 . A A . 2 ARG HH21 1 1 10 3164 1 1 2 ARG HH22 H 1.740 10.854 4.219 1.00 . A A . 2 ARG HH22 1 1 10 3165 1 1 2 ARG N N -4.129 5.183 1.211 1.00 . A A . 2 ARG N 1 1 10 3166 1 1 2 ARG NE N 0.446 8.582 2.457 1.00 . A A . 2 ARG NE 1 1 10 3167 1 1 2 ARG NH1 N -0.602 10.178 3.697 1.00 . A A . 2 ARG NH1 1 1 10 3168 1 1 2 ARG NH2 N 1.669 10.067 3.607 1.00 . A A . 2 ARG NH2 1 1 10 3169 1 1 2 ARG O O -1.790 4.170 3.432 1.00 . A A . 2 ARG O 1 1 10 3170 1 1 3 LEU C C -0.048 1.930 2.240 1.00 . A A . 3 LEU C 1 1 10 3171 1 1 3 LEU CA C -1.544 1.890 1.860 1.00 . A A . 3 LEU CA 1 1 10 3172 1 1 3 LEU CB C -1.784 0.897 0.688 1.00 . A A . 3 LEU CB 1 1 10 3173 1 1 3 LEU CD1 C -3.413 -0.213 -0.863 1.00 . A A . 3 LEU CD1 1 1 10 3174 1 1 3 LEU CD2 C -4.014 0.030 1.555 1.00 . A A . 3 LEU CD2 1 1 10 3175 1 1 3 LEU CG C -3.291 0.712 0.369 1.00 . A A . 3 LEU CG 1 1 10 3176 1 1 3 LEU H H -2.399 3.342 0.523 1.00 . A A . 3 LEU H 1 1 10 3177 1 1 3 LEU HA H -2.092 1.561 2.730 1.00 . A A . 3 LEU HA 1 1 10 3178 1 1 3 LEU HB2 H -1.292 1.269 -0.200 1.00 . A A . 3 LEU HB2 1 1 10 3179 1 1 3 LEU HB3 H -1.354 -0.059 0.938 1.00 . A A . 3 LEU HB3 1 1 10 3180 1 1 3 LEU HD11 H -2.961 -1.174 -0.663 1.00 . A A . 3 LEU HD11 1 1 10 3181 1 1 3 LEU HD12 H -2.913 0.232 -1.712 1.00 . A A . 3 LEU HD12 1 1 10 3182 1 1 3 LEU HD13 H -4.453 -0.364 -1.116 1.00 . A A . 3 LEU HD13 1 1 10 3183 1 1 3 LEU HD21 H -3.935 0.629 2.449 1.00 . A A . 3 LEU HD21 1 1 10 3184 1 1 3 LEU HD22 H -3.579 -0.939 1.750 1.00 . A A . 3 LEU HD22 1 1 10 3185 1 1 3 LEU HD23 H -5.061 -0.099 1.322 1.00 . A A . 3 LEU HD23 1 1 10 3186 1 1 3 LEU HG H -3.750 1.667 0.155 1.00 . A A . 3 LEU HG 1 1 10 3187 1 1 3 LEU N N -2.087 3.223 1.443 1.00 . A A . 3 LEU N 1 1 10 3188 1 1 3 LEU O O 0.290 2.132 3.387 1.00 . A A . 3 LEU O 1 1 10 3189 1 1 4 CYS C C 2.872 2.666 2.443 1.00 . A A . 4 CYS C 1 1 10 3190 1 1 4 CYS CA C 2.277 1.729 1.386 1.00 . A A . 4 CYS CA 1 1 10 3191 1 1 4 CYS CB C 2.887 2.101 0.034 1.00 . A A . 4 CYS CB 1 1 10 3192 1 1 4 CYS H H 0.417 1.578 0.367 1.00 . A A . 4 CYS H 1 1 10 3193 1 1 4 CYS HA H 2.585 0.728 1.631 1.00 . A A . 4 CYS HA 1 1 10 3194 1 1 4 CYS HB2 H 2.799 3.149 -0.172 1.00 . A A . 4 CYS HB2 1 1 10 3195 1 1 4 CYS HB3 H 3.945 1.914 0.120 1.00 . A A . 4 CYS HB3 1 1 10 3196 1 1 4 CYS N N 0.788 1.739 1.253 1.00 . A A . 4 CYS N 1 1 10 3197 1 1 4 CYS O O 3.642 2.235 3.279 1.00 . A A . 4 CYS O 1 1 10 3198 1 1 4 CYS SG S 2.334 1.244 -1.457 1.00 . A A . 4 CYS SG 1 1 10 3199 1 1 5 CYS C C 2.271 4.847 4.697 1.00 . A A . 5 CYS C 1 1 10 3200 1 1 5 CYS CA C 3.020 4.911 3.354 1.00 . A A . 5 CYS CA 1 1 10 3201 1 1 5 CYS CB C 2.879 6.308 2.752 1.00 . A A . 5 CYS CB 1 1 10 3202 1 1 5 CYS H H 1.857 4.184 1.680 1.00 . A A . 5 CYS H 1 1 10 3203 1 1 5 CYS HA H 4.068 4.708 3.533 1.00 . A A . 5 CYS HA 1 1 10 3204 1 1 5 CYS HB2 H 3.182 6.277 1.715 1.00 . A A . 5 CYS HB2 1 1 10 3205 1 1 5 CYS HB3 H 1.836 6.580 2.782 1.00 . A A . 5 CYS HB3 1 1 10 3206 1 1 5 CYS N N 2.491 3.913 2.376 1.00 . A A . 5 CYS N 1 1 10 3207 1 1 5 CYS O O 2.836 5.150 5.729 1.00 . A A . 5 CYS O 1 1 10 3208 1 1 5 CYS SG S 3.831 7.604 3.579 1.00 . A A . 5 CYS SG 1 1 10 3209 1 1 6 GLY C C 0.666 3.255 6.829 1.00 . A A . 6 GLY C 1 1 10 3210 1 1 6 GLY CA C 0.182 4.351 5.872 1.00 . A A . 6 GLY CA 1 1 10 3211 1 1 6 GLY H H 0.630 4.221 3.771 1.00 . A A . 6 GLY H 1 1 10 3212 1 1 6 GLY HA2 H 0.197 5.302 6.386 1.00 . A A . 6 GLY HA2 1 1 10 3213 1 1 6 GLY HA3 H -0.835 4.129 5.591 1.00 . A A . 6 GLY HA3 1 1 10 3214 1 1 6 GLY N N 1.022 4.454 4.638 1.00 . A A . 6 GLY N 1 1 10 3215 1 1 6 GLY O O 0.706 3.469 8.025 1.00 . A A . 6 GLY O 1 1 10 3216 1 1 7 PHE C C 2.435 0.006 6.383 1.00 . A A . 7 PHE C 1 1 10 3217 1 1 7 PHE CA C 1.502 0.989 7.135 1.00 . A A . 7 PHE CA 1 1 10 3218 1 1 7 PHE CB C 0.257 0.225 7.713 1.00 . A A . 7 PHE CB 1 1 10 3219 1 1 7 PHE CD1 C -0.654 -0.239 5.328 1.00 . A A . 7 PHE CD1 1 1 10 3220 1 1 7 PHE CD2 C -1.570 -1.424 7.170 1.00 . A A . 7 PHE CD2 1 1 10 3221 1 1 7 PHE CE1 C -1.507 -0.904 4.473 1.00 . A A . 7 PHE CE1 1 1 10 3222 1 1 7 PHE CE2 C -2.426 -2.091 6.317 1.00 . A A . 7 PHE CE2 1 1 10 3223 1 1 7 PHE CG C -0.670 -0.487 6.690 1.00 . A A . 7 PHE CG 1 1 10 3224 1 1 7 PHE CZ C -2.395 -1.832 4.967 1.00 . A A . 7 PHE CZ 1 1 10 3225 1 1 7 PHE H H 0.965 2.012 5.306 1.00 . A A . 7 PHE H 1 1 10 3226 1 1 7 PHE HA H 2.055 1.418 7.957 1.00 . A A . 7 PHE HA 1 1 10 3227 1 1 7 PHE HB2 H 0.599 -0.507 8.425 1.00 . A A . 7 PHE HB2 1 1 10 3228 1 1 7 PHE HB3 H -0.350 0.936 8.254 1.00 . A A . 7 PHE HB3 1 1 10 3229 1 1 7 PHE HD1 H 0.030 0.478 4.916 1.00 . A A . 7 PHE HD1 1 1 10 3230 1 1 7 PHE HD2 H -1.608 -1.639 8.229 1.00 . A A . 7 PHE HD2 1 1 10 3231 1 1 7 PHE HE1 H -1.481 -0.695 3.415 1.00 . A A . 7 PHE HE1 1 1 10 3232 1 1 7 PHE HE2 H -3.121 -2.819 6.711 1.00 . A A . 7 PHE HE2 1 1 10 3233 1 1 7 PHE HZ H -3.065 -2.354 4.297 1.00 . A A . 7 PHE HZ 1 1 10 3234 1 1 7 PHE N N 1.018 2.117 6.278 1.00 . A A . 7 PHE N 1 1 10 3235 1 1 7 PHE O O 2.281 -0.226 5.195 1.00 . A A . 7 PHE O 1 1 10 3236 1 1 8 HYP C C 3.970 -2.628 5.810 1.00 . A A . 8 HYP C 1 1 10 3237 1 1 8 HYP CA C 4.473 -1.362 6.524 1.00 . A A . 8 HYP CA 1 1 10 3238 1 1 8 HYP CB C 5.402 -1.671 7.700 1.00 . A A . 8 HYP CB 1 1 10 3239 1 1 8 HYP CD C 3.538 -0.484 8.581 1.00 . A A . 8 HYP CD 1 1 10 3240 1 1 8 HYP CG C 4.510 -1.591 8.886 1.00 . A A . 8 HYP CG 1 1 10 3241 1 1 8 HYP HA H 5.033 -0.767 5.821 1.00 . A A . 8 HYP HA 1 1 10 3242 1 1 8 HYP HB2 H 6.199 -0.940 7.743 1.00 . A A . 8 HYP HB2 1 1 10 3243 1 1 8 HYP HB3 H 5.854 -2.647 7.591 1.00 . A A . 8 HYP HB3 1 1 10 3244 1 1 8 HYP HD1 H 4.648 -1.094 10.761 1.00 . A A . 8 HYP HD1 1 1 10 3245 1 1 8 HYP HD22 H 3.942 0.471 8.881 1.00 . A A . 8 HYP HD22 1 1 10 3246 1 1 8 HYP HD23 H 2.603 -0.672 9.086 1.00 . A A . 8 HYP HD23 1 1 10 3247 1 1 8 HYP HG H 3.986 -2.528 9.013 1.00 . A A . 8 HYP HG 1 1 10 3248 1 1 8 HYP N N 3.383 -0.552 7.110 1.00 . A A . 8 HYP N 1 1 10 3249 1 1 8 HYP O O 4.747 -3.319 5.178 1.00 . A A . 8 HYP O 1 1 10 3250 1 1 8 HYP OD1 O 5.263 -1.297 10.053 1.00 . A A . 8 HYP OD1 1 1 10 3251 1 1 9 LYS C C 2.130 -3.966 3.787 1.00 . A A . 9 LYS C 1 1 10 3252 1 1 9 LYS CA C 2.058 -4.065 5.309 1.00 . A A . 9 LYS CA 1 1 10 3253 1 1 9 LYS CB C 0.579 -4.165 5.764 1.00 . A A . 9 LYS CB 1 1 10 3254 1 1 9 LYS CD C 1.080 -3.501 8.224 1.00 . A A . 9 LYS CD 1 1 10 3255 1 1 9 LYS CE C 0.818 -3.891 9.689 1.00 . A A . 9 LYS CE 1 1 10 3256 1 1 9 LYS CG C 0.427 -4.531 7.273 1.00 . A A . 9 LYS CG 1 1 10 3257 1 1 9 LYS H H 2.132 -2.263 6.465 1.00 . A A . 9 LYS H 1 1 10 3258 1 1 9 LYS HA H 2.596 -4.949 5.624 1.00 . A A . 9 LYS HA 1 1 10 3259 1 1 9 LYS HB2 H 0.094 -3.218 5.581 1.00 . A A . 9 LYS HB2 1 1 10 3260 1 1 9 LYS HB3 H 0.076 -4.916 5.173 1.00 . A A . 9 LYS HB3 1 1 10 3261 1 1 9 LYS HD2 H 2.148 -3.493 8.084 1.00 . A A . 9 LYS HD2 1 1 10 3262 1 1 9 LYS HD3 H 0.694 -2.516 8.025 1.00 . A A . 9 LYS HD3 1 1 10 3263 1 1 9 LYS HE2 H 1.258 -3.162 10.352 1.00 . A A . 9 LYS HE2 1 1 10 3264 1 1 9 LYS HE3 H -0.244 -3.940 9.880 1.00 . A A . 9 LYS HE3 1 1 10 3265 1 1 9 LYS HG2 H -0.627 -4.605 7.503 1.00 . A A . 9 LYS HG2 1 1 10 3266 1 1 9 LYS HG3 H 0.872 -5.502 7.438 1.00 . A A . 9 LYS HG3 1 1 10 3267 1 1 9 LYS HZ1 H 1.483 -5.361 11.010 1.00 . A A . 9 LYS HZ1 1 1 10 3268 1 1 9 LYS HZ2 H 2.369 -5.274 9.563 1.00 . A A . 9 LYS HZ2 1 1 10 3269 1 1 9 LYS HZ3 H 0.821 -5.971 9.571 1.00 . A A . 9 LYS HZ3 1 1 10 3270 1 1 9 LYS N N 2.690 -2.874 5.942 1.00 . A A . 9 LYS N 1 1 10 3271 1 1 9 LYS NZ N 1.418 -5.225 9.982 1.00 . A A . 9 LYS NZ 1 1 10 3272 1 1 9 LYS O O 2.405 -4.956 3.138 1.00 . A A . 9 LYS O 1 1 10 3273 1 1 10 SER C C 3.370 -2.246 1.357 1.00 . A A . 10 SER C 1 1 10 3274 1 1 10 SER CA C 1.947 -2.646 1.766 1.00 . A A . 10 SER CA 1 1 10 3275 1 1 10 SER CB C 0.925 -1.583 1.358 1.00 . A A . 10 SER CB 1 1 10 3276 1 1 10 SER H H 1.668 -1.999 3.793 1.00 . A A . 10 SER H 1 1 10 3277 1 1 10 SER HA H 1.700 -3.588 1.294 1.00 . A A . 10 SER HA 1 1 10 3278 1 1 10 SER HB2 H 1.076 -0.666 1.901 1.00 . A A . 10 SER HB2 1 1 10 3279 1 1 10 SER HB3 H 0.917 -1.403 0.293 1.00 . A A . 10 SER HB3 1 1 10 3280 1 1 10 SER HG H -0.947 -2.020 1.046 1.00 . A A . 10 SER HG 1 1 10 3281 1 1 10 SER N N 1.888 -2.791 3.251 1.00 . A A . 10 SER N 1 1 10 3282 1 1 10 SER O O 3.862 -2.675 0.336 1.00 . A A . 10 SER O 1 1 10 3283 1 1 10 SER OG O -0.316 -2.148 1.759 1.00 . A A . 10 SER OG 1 1 10 3284 1 1 11 CYS C C 6.404 -1.912 1.417 1.00 . A A . 11 CYS C 1 1 10 3285 1 1 11 CYS CA C 5.371 -0.911 1.990 1.00 . A A . 11 CYS CA 1 1 10 3286 1 1 11 CYS CB C 5.822 -0.404 3.353 1.00 . A A . 11 CYS CB 1 1 10 3287 1 1 11 CYS H H 3.486 -1.156 2.987 1.00 . A A . 11 CYS H 1 1 10 3288 1 1 11 CYS HA H 5.315 -0.066 1.321 1.00 . A A . 11 CYS HA 1 1 10 3289 1 1 11 CYS HB2 H 5.060 0.259 3.736 1.00 . A A . 11 CYS HB2 1 1 10 3290 1 1 11 CYS HB3 H 5.837 -1.272 3.994 1.00 . A A . 11 CYS HB3 1 1 10 3291 1 1 11 CYS N N 3.976 -1.437 2.186 1.00 . A A . 11 CYS N 1 1 10 3292 1 1 11 CYS O O 7.320 -1.517 0.722 1.00 . A A . 11 CYS O 1 1 10 3293 1 1 11 CYS SG S 7.417 0.413 3.603 1.00 . A A . 11 CYS SG 1 1 10 3294 1 1 12 ARG C C 6.914 -4.720 -0.206 1.00 . A A . 12 ARG C 1 1 10 3295 1 1 12 ARG CA C 7.146 -4.252 1.249 1.00 . A A . 12 ARG CA 1 1 10 3296 1 1 12 ARG CB C 6.992 -5.439 2.234 1.00 . A A . 12 ARG CB 1 1 10 3297 1 1 12 ARG CD C 9.418 -6.233 1.978 1.00 . A A . 12 ARG CD 1 1 10 3298 1 1 12 ARG CG C 7.925 -6.640 1.906 1.00 . A A . 12 ARG CG 1 1 10 3299 1 1 12 ARG CZ C 9.863 -6.499 4.384 1.00 . A A . 12 ARG CZ 1 1 10 3300 1 1 12 ARG H H 5.452 -3.415 2.287 1.00 . A A . 12 ARG H 1 1 10 3301 1 1 12 ARG HA H 8.156 -3.874 1.318 1.00 . A A . 12 ARG HA 1 1 10 3302 1 1 12 ARG HB2 H 7.196 -5.094 3.237 1.00 . A A . 12 ARG HB2 1 1 10 3303 1 1 12 ARG HB3 H 5.968 -5.782 2.206 1.00 . A A . 12 ARG HB3 1 1 10 3304 1 1 12 ARG HD2 H 10.049 -7.087 1.779 1.00 . A A . 12 ARG HD2 1 1 10 3305 1 1 12 ARG HD3 H 9.644 -5.465 1.253 1.00 . A A . 12 ARG HD3 1 1 10 3306 1 1 12 ARG HE H 9.816 -4.741 3.476 1.00 . A A . 12 ARG HE 1 1 10 3307 1 1 12 ARG HG2 H 7.737 -7.432 2.617 1.00 . A A . 12 ARG HG2 1 1 10 3308 1 1 12 ARG HG3 H 7.705 -7.024 0.921 1.00 . A A . 12 ARG HG3 1 1 10 3309 1 1 12 ARG HH11 H 9.540 -8.198 3.368 1.00 . A A . 12 ARG HH11 1 1 10 3310 1 1 12 ARG HH12 H 9.855 -8.383 5.059 1.00 . A A . 12 ARG HH12 1 1 10 3311 1 1 12 ARG HH21 H 10.212 -4.960 5.617 1.00 . A A . 12 ARG HH21 1 1 10 3312 1 1 12 ARG HH22 H 10.239 -6.529 6.350 1.00 . A A . 12 ARG HH22 1 1 10 3313 1 1 12 ARG N N 6.219 -3.171 1.727 1.00 . A A . 12 ARG N 1 1 10 3314 1 1 12 ARG NE N 9.721 -5.708 3.348 1.00 . A A . 12 ARG NE 1 1 10 3315 1 1 12 ARG NH1 N 9.744 -7.794 4.259 1.00 . A A . 12 ARG NH1 1 1 10 3316 1 1 12 ARG NH2 N 10.125 -5.953 5.540 1.00 . A A . 12 ARG NH2 1 1 10 3317 1 1 12 ARG O O 7.832 -5.209 -0.837 1.00 . A A . 12 ARG O 1 1 10 3318 1 1 13 SER C C 6.131 -4.176 -3.155 1.00 . A A . 13 SER C 1 1 10 3319 1 1 13 SER CA C 5.385 -4.986 -2.101 1.00 . A A . 13 SER CA 1 1 10 3320 1 1 13 SER CB C 3.868 -4.834 -2.367 1.00 . A A . 13 SER CB 1 1 10 3321 1 1 13 SER H H 5.021 -4.146 -0.154 1.00 . A A . 13 SER H 1 1 10 3322 1 1 13 SER HA H 5.655 -6.027 -2.209 1.00 . A A . 13 SER HA 1 1 10 3323 1 1 13 SER HB2 H 3.616 -5.102 -3.385 1.00 . A A . 13 SER HB2 1 1 10 3324 1 1 13 SER HB3 H 3.274 -5.414 -1.678 1.00 . A A . 13 SER HB3 1 1 10 3325 1 1 13 SER HG H 4.037 -2.963 -2.871 1.00 . A A . 13 SER HG 1 1 10 3326 1 1 13 SER N N 5.713 -4.558 -0.703 1.00 . A A . 13 SER N 1 1 10 3327 1 1 13 SER O O 6.432 -3.020 -2.939 1.00 . A A . 13 SER O 1 1 10 3328 1 1 13 SER OG O 3.595 -3.454 -2.176 1.00 . A A . 13 SER OG 1 1 10 3329 1 1 14 ARG C C 6.325 -2.933 -5.834 1.00 . A A . 14 ARG C 1 1 10 3330 1 1 14 ARG CA C 7.113 -4.184 -5.407 1.00 . A A . 14 ARG CA 1 1 10 3331 1 1 14 ARG CB C 7.196 -5.216 -6.555 1.00 . A A . 14 ARG CB 1 1 10 3332 1 1 14 ARG CD C 9.339 -4.224 -7.524 1.00 . A A . 14 ARG CD 1 1 10 3333 1 1 14 ARG CG C 7.893 -4.654 -7.823 1.00 . A A . 14 ARG CG 1 1 10 3334 1 1 14 ARG CZ C 11.244 -3.545 -8.910 1.00 . A A . 14 ARG CZ 1 1 10 3335 1 1 14 ARG H H 6.110 -5.763 -4.342 1.00 . A A . 14 ARG H 1 1 10 3336 1 1 14 ARG HA H 8.097 -3.890 -5.077 1.00 . A A . 14 ARG HA 1 1 10 3337 1 1 14 ARG HB2 H 7.742 -6.081 -6.207 1.00 . A A . 14 ARG HB2 1 1 10 3338 1 1 14 ARG HB3 H 6.197 -5.535 -6.816 1.00 . A A . 14 ARG HB3 1 1 10 3339 1 1 14 ARG HD2 H 9.355 -3.405 -6.821 1.00 . A A . 14 ARG HD2 1 1 10 3340 1 1 14 ARG HD3 H 9.911 -5.053 -7.133 1.00 . A A . 14 ARG HD3 1 1 10 3341 1 1 14 ARG HE H 9.381 -3.600 -9.584 1.00 . A A . 14 ARG HE 1 1 10 3342 1 1 14 ARG HG2 H 7.902 -5.422 -8.583 1.00 . A A . 14 ARG HG2 1 1 10 3343 1 1 14 ARG HG3 H 7.336 -3.811 -8.208 1.00 . A A . 14 ARG HG3 1 1 10 3344 1 1 14 ARG HH11 H 11.665 -4.051 -7.014 1.00 . A A . 14 ARG HH11 1 1 10 3345 1 1 14 ARG HH12 H 13.019 -3.581 -7.985 1.00 . A A . 14 ARG HH12 1 1 10 3346 1 1 14 ARG HH21 H 11.078 -2.998 -10.827 1.00 . A A . 14 ARG HH21 1 1 10 3347 1 1 14 ARG HH22 H 12.684 -2.971 -10.177 1.00 . A A . 14 ARG HH22 1 1 10 3348 1 1 14 ARG N N 6.393 -4.828 -4.263 1.00 . A A . 14 ARG N 1 1 10 3349 1 1 14 ARG NE N 9.955 -3.754 -8.805 1.00 . A A . 14 ARG NE 1 1 10 3350 1 1 14 ARG NH1 N 12.037 -3.741 -7.890 1.00 . A A . 14 ARG NH1 1 1 10 3351 1 1 14 ARG NH2 N 11.705 -3.140 -10.060 1.00 . A A . 14 ARG NH2 1 1 10 3352 1 1 14 ARG O O 6.873 -1.997 -6.384 1.00 . A A . 14 ARG O 1 1 10 3353 1 1 15 GLN C C 4.504 -0.637 -5.053 1.00 . A A . 15 GLN C 1 1 10 3354 1 1 15 GLN CA C 4.112 -1.873 -5.875 1.00 . A A . 15 GLN CA 1 1 10 3355 1 1 15 GLN CB C 2.681 -2.326 -5.520 1.00 . A A . 15 GLN CB 1 1 10 3356 1 1 15 GLN CD C 1.662 -0.983 -7.403 1.00 . A A . 15 GLN CD 1 1 10 3357 1 1 15 GLN CG C 1.635 -1.246 -5.890 1.00 . A A . 15 GLN CG 1 1 10 3358 1 1 15 GLN H H 4.694 -3.783 -5.107 1.00 . A A . 15 GLN H 1 1 10 3359 1 1 15 GLN HA H 4.197 -1.643 -6.928 1.00 . A A . 15 GLN HA 1 1 10 3360 1 1 15 GLN HB2 H 2.455 -3.251 -6.031 1.00 . A A . 15 GLN HB2 1 1 10 3361 1 1 15 GLN HB3 H 2.623 -2.513 -4.457 1.00 . A A . 15 GLN HB3 1 1 10 3362 1 1 15 GLN HE21 H 1.790 -2.912 -7.843 1.00 . A A . 15 GLN HE21 1 1 10 3363 1 1 15 GLN HE22 H 1.758 -1.863 -9.183 1.00 . A A . 15 GLN HE22 1 1 10 3364 1 1 15 GLN HG2 H 0.646 -1.588 -5.621 1.00 . A A . 15 GLN HG2 1 1 10 3365 1 1 15 GLN HG3 H 1.837 -0.321 -5.369 1.00 . A A . 15 GLN HG3 1 1 10 3366 1 1 15 GLN N N 5.048 -2.985 -5.550 1.00 . A A . 15 GLN N 1 1 10 3367 1 1 15 GLN NE2 N 1.743 -2.004 -8.213 1.00 . A A . 15 GLN NE2 1 1 10 3368 1 1 15 GLN O O 4.514 0.470 -5.555 1.00 . A A . 15 GLN O 1 1 10 3369 1 1 15 GLN OE1 O 1.610 0.142 -7.855 1.00 . A A . 15 GLN OE1 1 1 10 3370 1 1 16 CYS C C 6.695 0.586 -2.876 1.00 . A A . 16 CYS C 1 1 10 3371 1 1 16 CYS CA C 5.213 0.185 -2.858 1.00 . A A . 16 CYS CA 1 1 10 3372 1 1 16 CYS CB C 4.842 -0.256 -1.465 1.00 . A A . 16 CYS CB 1 1 10 3373 1 1 16 CYS H H 4.771 -1.817 -3.483 1.00 . A A . 16 CYS H 1 1 10 3374 1 1 16 CYS HA H 4.624 1.059 -3.082 1.00 . A A . 16 CYS HA 1 1 10 3375 1 1 16 CYS HB2 H 5.390 -1.134 -1.195 1.00 . A A . 16 CYS HB2 1 1 10 3376 1 1 16 CYS HB3 H 5.149 0.521 -0.784 1.00 . A A . 16 CYS HB3 1 1 10 3377 1 1 16 CYS N N 4.810 -0.894 -3.805 1.00 . A A . 16 CYS N 1 1 10 3378 1 1 16 CYS O O 7.011 1.693 -2.487 1.00 . A A . 16 CYS O 1 1 10 3379 1 1 16 CYS SG S 3.096 -0.591 -1.149 1.00 . A A . 16 CYS SG 1 1 10 3380 1 1 17 LYS C C 9.372 1.396 -4.064 1.00 . A A . 17 LYS C 1 1 10 3381 1 1 17 LYS CA C 9.027 0.056 -3.347 1.00 . A A . 17 LYS CA 1 1 10 3382 1 1 17 LYS CB C 9.822 -1.087 -4.033 1.00 . A A . 17 LYS CB 1 1 10 3383 1 1 17 LYS CD C 10.524 -3.506 -3.821 1.00 . A A . 17 LYS CD 1 1 10 3384 1 1 17 LYS CE C 10.297 -4.807 -3.027 1.00 . A A . 17 LYS CE 1 1 10 3385 1 1 17 LYS CG C 9.686 -2.373 -3.195 1.00 . A A . 17 LYS CG 1 1 10 3386 1 1 17 LYS H H 7.254 -1.181 -3.598 1.00 . A A . 17 LYS H 1 1 10 3387 1 1 17 LYS HA H 9.370 0.125 -2.326 1.00 . A A . 17 LYS HA 1 1 10 3388 1 1 17 LYS HB2 H 9.436 -1.265 -5.025 1.00 . A A . 17 LYS HB2 1 1 10 3389 1 1 17 LYS HB3 H 10.864 -0.812 -4.112 1.00 . A A . 17 LYS HB3 1 1 10 3390 1 1 17 LYS HD2 H 10.249 -3.655 -4.853 1.00 . A A . 17 LYS HD2 1 1 10 3391 1 1 17 LYS HD3 H 11.572 -3.244 -3.784 1.00 . A A . 17 LYS HD3 1 1 10 3392 1 1 17 LYS HE2 H 9.257 -5.092 -3.068 1.00 . A A . 17 LYS HE2 1 1 10 3393 1 1 17 LYS HE3 H 10.891 -5.605 -3.449 1.00 . A A . 17 LYS HE3 1 1 10 3394 1 1 17 LYS HG2 H 10.030 -2.182 -2.189 1.00 . A A . 17 LYS HG2 1 1 10 3395 1 1 17 LYS HG3 H 8.656 -2.675 -3.153 1.00 . A A . 17 LYS HG3 1 1 10 3396 1 1 17 LYS HZ1 H 10.995 -5.540 -1.204 1.00 . A A . 17 LYS HZ1 1 1 10 3397 1 1 17 LYS HZ2 H 9.873 -4.274 -1.058 1.00 . A A . 17 LYS HZ2 1 1 10 3398 1 1 17 LYS HZ3 H 11.468 -3.943 -1.536 1.00 . A A . 17 LYS HZ3 1 1 10 3399 1 1 17 LYS N N 7.564 -0.296 -3.309 1.00 . A A . 17 LYS N 1 1 10 3400 1 1 17 LYS NZ N 10.688 -4.628 -1.599 1.00 . A A . 17 LYS NZ 1 1 10 3401 1 1 17 LYS O O 10.223 2.115 -3.576 1.00 . A A . 17 LYS O 1 1 10 3402 1 1 18 HYP C C 8.284 4.233 -5.158 1.00 . A A . 18 HYP C 1 1 10 3403 1 1 18 HYP CA C 8.950 3.017 -5.852 1.00 . A A . 18 HYP CA 1 1 10 3404 1 1 18 HYP CB C 8.436 2.771 -7.269 1.00 . A A . 18 HYP CB 1 1 10 3405 1 1 18 HYP CD C 7.777 0.894 -5.936 1.00 . A A . 18 HYP CD 1 1 10 3406 1 1 18 HYP CG C 7.346 1.775 -7.078 1.00 . A A . 18 HYP CG 1 1 10 3407 1 1 18 HYP HA H 10.008 3.230 -5.930 1.00 . A A . 18 HYP HA 1 1 10 3408 1 1 18 HYP HB2 H 9.233 2.385 -7.889 1.00 . A A . 18 HYP HB2 1 1 10 3409 1 1 18 HYP HB3 H 8.076 3.684 -7.718 1.00 . A A . 18 HYP HB3 1 1 10 3410 1 1 18 HYP HD1 H 7.976 0.511 -8.417 1.00 . A A . 18 HYP HD1 1 1 10 3411 1 1 18 HYP HD22 H 8.253 0.000 -6.307 1.00 . A A . 18 HYP HD22 1 1 10 3412 1 1 18 HYP HD23 H 6.914 0.647 -5.344 1.00 . A A . 18 HYP HD23 1 1 10 3413 1 1 18 HYP HG H 6.426 2.284 -6.832 1.00 . A A . 18 HYP HG 1 1 10 3414 1 1 18 HYP N N 8.743 1.715 -5.176 1.00 . A A . 18 HYP N 1 1 10 3415 1 1 18 HYP O O 8.194 5.281 -5.768 1.00 . A A . 18 HYP O 1 1 10 3416 1 1 18 HYP OD1 O 7.166 1.002 -8.256 1.00 . A A . 18 HYP OD1 1 1 10 3417 1 1 19 HIS C C 8.219 5.968 -2.364 1.00 . A A . 19 HIS C 1 1 10 3418 1 1 19 HIS CA C 7.191 5.198 -3.194 1.00 . A A . 19 HIS CA 1 1 10 3419 1 1 19 HIS CB C 6.092 4.652 -2.252 1.00 . A A . 19 HIS CB 1 1 10 3420 1 1 19 HIS CD2 C 4.930 3.298 -4.238 1.00 . A A . 19 HIS CD2 1 1 10 3421 1 1 19 HIS CE1 C 2.973 3.460 -3.585 1.00 . A A . 19 HIS CE1 1 1 10 3422 1 1 19 HIS CG C 4.945 4.020 -3.055 1.00 . A A . 19 HIS CG 1 1 10 3423 1 1 19 HIS H H 7.949 3.202 -3.484 1.00 . A A . 19 HIS H 1 1 10 3424 1 1 19 HIS HA H 6.742 5.877 -3.906 1.00 . A A . 19 HIS HA 1 1 10 3425 1 1 19 HIS HB2 H 6.503 3.908 -1.587 1.00 . A A . 19 HIS HB2 1 1 10 3426 1 1 19 HIS HB3 H 5.686 5.458 -1.657 1.00 . A A . 19 HIS HB3 1 1 10 3427 1 1 19 HIS HD1 H 3.359 4.525 -1.909 1.00 . A A . 19 HIS HD1 1 1 10 3428 1 1 19 HIS HD2 H 5.800 3.045 -4.819 1.00 . A A . 19 HIS HD2 1 1 10 3429 1 1 19 HIS HE1 H 1.900 3.369 -3.522 1.00 . A A . 19 HIS HE1 1 1 10 3430 1 1 19 HIS N N 7.848 4.066 -3.931 1.00 . A A . 19 HIS N 1 1 10 3431 1 1 19 HIS ND1 N 3.701 4.079 -2.712 1.00 . A A . 19 HIS ND1 1 1 10 3432 1 1 19 HIS NE2 N 3.697 2.959 -4.553 1.00 . A A . 19 HIS NE2 1 1 10 3433 1 1 19 HIS O O 9.189 5.404 -1.902 1.00 . A A . 19 HIS O 1 1 10 3434 1 1 20 ARG C C 8.931 7.718 0.075 1.00 . A A . 20 ARG C 1 1 10 3435 1 1 20 ARG CA C 8.892 8.119 -1.409 1.00 . A A . 20 ARG CA 1 1 10 3436 1 1 20 ARG CB C 8.423 9.580 -1.518 1.00 . A A . 20 ARG CB 1 1 10 3437 1 1 20 ARG CD C 7.953 11.501 -3.052 1.00 . A A . 20 ARG CD 1 1 10 3438 1 1 20 ARG CG C 8.432 10.039 -2.988 1.00 . A A . 20 ARG CG 1 1 10 3439 1 1 20 ARG CZ C 9.028 12.288 -5.116 1.00 . A A . 20 ARG CZ 1 1 10 3440 1 1 20 ARG H H 7.163 7.628 -2.601 1.00 . A A . 20 ARG H 1 1 10 3441 1 1 20 ARG HA H 9.889 8.025 -1.815 1.00 . A A . 20 ARG HA 1 1 10 3442 1 1 20 ARG HB2 H 7.421 9.666 -1.121 1.00 . A A . 20 ARG HB2 1 1 10 3443 1 1 20 ARG HB3 H 9.077 10.214 -0.938 1.00 . A A . 20 ARG HB3 1 1 10 3444 1 1 20 ARG HD2 H 6.951 11.585 -2.655 1.00 . A A . 20 ARG HD2 1 1 10 3445 1 1 20 ARG HD3 H 8.609 12.149 -2.487 1.00 . A A . 20 ARG HD3 1 1 10 3446 1 1 20 ARG HE H 7.080 11.957 -4.961 1.00 . A A . 20 ARG HE 1 1 10 3447 1 1 20 ARG HG2 H 9.434 9.961 -3.387 1.00 . A A . 20 ARG HG2 1 1 10 3448 1 1 20 ARG HG3 H 7.773 9.418 -3.578 1.00 . A A . 20 ARG HG3 1 1 10 3449 1 1 20 ARG HH11 H 10.248 11.987 -3.552 1.00 . A A . 20 ARG HH11 1 1 10 3450 1 1 20 ARG HH12 H 11.011 12.541 -5.003 1.00 . A A . 20 ARG HH12 1 1 10 3451 1 1 20 ARG HH21 H 8.024 12.658 -6.806 1.00 . A A . 20 ARG HH21 1 1 10 3452 1 1 20 ARG HH22 H 9.732 12.926 -6.876 1.00 . A A . 20 ARG HH22 1 1 10 3453 1 1 20 ARG N N 7.968 7.242 -2.199 1.00 . A A . 20 ARG N 1 1 10 3454 1 1 20 ARG NE N 7.935 11.935 -4.483 1.00 . A A . 20 ARG NE 1 1 10 3455 1 1 20 ARG NH1 N 10.185 12.270 -4.509 1.00 . A A . 20 ARG NH1 1 1 10 3456 1 1 20 ARG NH2 N 8.920 12.652 -6.363 1.00 . A A . 20 ARG NH2 1 1 10 3457 1 1 20 ARG O O 9.885 8.017 0.767 1.00 . A A . 20 ARG O 1 1 10 3458 1 1 21 CYS C C 8.428 5.216 2.126 1.00 . A A . 21 CYS C 1 1 10 3459 1 1 21 CYS CA C 7.798 6.602 1.938 1.00 . A A . 21 CYS CA 1 1 10 3460 1 1 21 CYS CB C 6.331 6.519 2.352 1.00 . A A . 21 CYS CB 1 1 10 3461 1 1 21 CYS H H 7.162 6.841 -0.111 1.00 . A A . 21 CYS H 1 1 10 3462 1 1 21 CYS HA H 8.331 7.304 2.560 1.00 . A A . 21 CYS HA 1 1 10 3463 1 1 21 CYS HB2 H 5.875 5.720 1.785 1.00 . A A . 21 CYS HB2 1 1 10 3464 1 1 21 CYS HB3 H 6.298 6.229 3.392 1.00 . A A . 21 CYS HB3 1 1 10 3465 1 1 21 CYS N N 7.891 7.052 0.510 1.00 . A A . 21 CYS N 1 1 10 3466 1 1 21 CYS O O 8.758 4.832 3.231 1.00 . A A . 21 CYS O 1 1 10 3467 1 1 21 CYS SG S 5.245 7.956 2.179 1.00 . A A . 21 CYS SG 1 1 10 3468 1 1 22 . C C 9.920 2.962 -0.255 1.00 . A A . 22 CY3 C 1 1 10 3469 1 1 22 . CA C 9.159 3.145 1.046 1.00 . A A . 22 CY3 CA 1 1 10 3470 1 1 22 . CB C 7.989 2.149 1.203 1.00 . A A . 22 CY3 CB 1 1 10 3471 1 1 22 . H H 8.295 4.888 0.169 1.00 . A A . 22 CY3 H 1 1 10 3472 1 1 22 . HA H 9.851 3.053 1.871 1.00 . A A . 22 CY3 HA 1 1 10 3473 1 1 22 . HB2 H 8.357 1.143 1.070 1.00 . A A . 22 CY3 HB2 1 1 10 3474 1 1 22 . HB3 H 7.258 2.339 0.430 1.00 . A A . 22 CY3 HB3 1 1 10 3475 1 1 22 . HN11 H 10.942 4.631 0.057 1.00 . A A . 22 CY3 HN11 1 1 10 3476 1 1 22 . HN12 H 11.309 3.820 -1.380 1.00 . A A . 22 CY3 HN12 1 1 10 3477 1 1 22 . N N 8.571 4.512 1.032 1.00 . A A . 22 CY3 N 1 1 10 3478 1 1 22 . N1 N 10.797 3.878 -0.553 1.00 . A A . 22 CY3 N1 1 1 10 3479 1 1 22 . O O 9.728 2.023 -0.997 1.00 . A A . 22 CY3 O 1 1 10 3480 1 1 22 . SG S 7.145 2.246 2.800 1.00 . A A . 22 CY3 SG 1 1 11 3481 1 1 1 PCA C C -4.479 4.892 0.322 1.00 . A A . 1 PCA C 1 1 11 3482 1 1 1 PCA CA C -6.005 5.045 0.242 1.00 . A A . 1 PCA CA 1 1 11 3483 1 1 1 PCA CB C -6.738 3.946 1.031 1.00 . A A . 1 PCA CB 1 1 11 3484 1 1 1 PCA CD C -7.331 3.770 -1.301 1.00 . A A . 1 PCA CD 1 1 11 3485 1 1 1 PCA CG C -7.589 3.145 0.047 1.00 . A A . 1 PCA CG 1 1 11 3486 1 1 1 PCA HA H -6.281 6.013 0.636 1.00 . A A . 1 PCA HA 1 1 11 3487 1 1 1 PCA HB2 H -7.354 4.406 1.791 1.00 . A A . 1 PCA HB2 1 1 11 3488 1 1 1 PCA HB3 H -6.029 3.310 1.540 1.00 . A A . 1 PCA HB3 1 1 11 3489 1 1 1 PCA HG2 H -8.635 3.227 0.303 1.00 . A A . 1 PCA HG2 1 1 11 3490 1 1 1 PCA HG3 H -7.283 2.110 0.043 1.00 . A A . 1 PCA HG3 1 1 11 3491 1 1 1 PCA N N -6.495 4.957 -1.149 1.00 . A A . 1 PCA N 1 1 11 3492 1 1 1 PCA O O -3.858 4.457 -0.630 1.00 . A A . 1 PCA O 1 1 11 3493 1 1 1 PCA OE O -7.762 3.341 -2.353 1.00 . A A . 1 PCA OE 1 1 11 3494 1 1 2 ARG C C -2.124 3.849 2.393 1.00 . A A . 2 ARG C 1 1 11 3495 1 1 2 ARG CA C -2.469 5.168 1.687 1.00 . A A . 2 ARG CA 1 1 11 3496 1 1 2 ARG CB C -1.988 6.365 2.562 1.00 . A A . 2 ARG CB 1 1 11 3497 1 1 2 ARG CD C -3.611 8.127 1.578 1.00 . A A . 2 ARG CD 1 1 11 3498 1 1 2 ARG CG C -2.144 7.754 1.881 1.00 . A A . 2 ARG CG 1 1 11 3499 1 1 2 ARG CZ C -3.578 10.576 1.778 1.00 . A A . 2 ARG CZ 1 1 11 3500 1 1 2 ARG H H -4.520 5.598 2.176 1.00 . A A . 2 ARG H 1 1 11 3501 1 1 2 ARG HA H -1.955 5.198 0.736 1.00 . A A . 2 ARG HA 1 1 11 3502 1 1 2 ARG HB2 H -2.548 6.369 3.487 1.00 . A A . 2 ARG HB2 1 1 11 3503 1 1 2 ARG HB3 H -0.946 6.223 2.807 1.00 . A A . 2 ARG HB3 1 1 11 3504 1 1 2 ARG HD2 H -4.029 7.474 0.830 1.00 . A A . 2 ARG HD2 1 1 11 3505 1 1 2 ARG HD3 H -4.223 8.088 2.468 1.00 . A A . 2 ARG HD3 1 1 11 3506 1 1 2 ARG HE H -3.688 9.631 0.038 1.00 . A A . 2 ARG HE 1 1 11 3507 1 1 2 ARG HG2 H -1.716 8.503 2.531 1.00 . A A . 2 ARG HG2 1 1 11 3508 1 1 2 ARG HG3 H -1.584 7.756 0.957 1.00 . A A . 2 ARG HG3 1 1 11 3509 1 1 2 ARG HH11 H -3.482 9.550 3.500 1.00 . A A . 2 ARG HH11 1 1 11 3510 1 1 2 ARG HH12 H -3.463 11.273 3.649 1.00 . A A . 2 ARG HH12 1 1 11 3511 1 1 2 ARG HH21 H -3.659 11.820 0.211 1.00 . A A . 2 ARG HH21 1 1 11 3512 1 1 2 ARG HH22 H -3.561 12.575 1.768 1.00 . A A . 2 ARG HH22 1 1 11 3513 1 1 2 ARG N N -3.943 5.259 1.460 1.00 . A A . 2 ARG N 1 1 11 3514 1 1 2 ARG NE N -3.633 9.513 1.009 1.00 . A A . 2 ARG NE 1 1 11 3515 1 1 2 ARG NH1 N -3.502 10.456 3.077 1.00 . A A . 2 ARG NH1 1 1 11 3516 1 1 2 ARG NH2 N -3.601 11.748 1.208 1.00 . A A . 2 ARG NH2 1 1 11 3517 1 1 2 ARG O O -2.047 3.789 3.606 1.00 . A A . 2 ARG O 1 1 11 3518 1 1 3 LEU C C -0.071 1.517 2.479 1.00 . A A . 3 LEU C 1 1 11 3519 1 1 3 LEU CA C -1.581 1.487 2.195 1.00 . A A . 3 LEU CA 1 1 11 3520 1 1 3 LEU CB C -1.914 0.349 1.187 1.00 . A A . 3 LEU CB 1 1 11 3521 1 1 3 LEU CD1 C -4.070 1.420 0.223 1.00 . A A . 3 LEU CD1 1 1 11 3522 1 1 3 LEU CD2 C -3.604 -1.031 -0.063 1.00 . A A . 3 LEU CD2 1 1 11 3523 1 1 3 LEU CG C -3.435 0.176 0.882 1.00 . A A . 3 LEU CG 1 1 11 3524 1 1 3 LEU H H -2.006 2.918 0.639 1.00 . A A . 3 LEU H 1 1 11 3525 1 1 3 LEU HA H -2.121 1.349 3.118 1.00 . A A . 3 LEU HA 1 1 11 3526 1 1 3 LEU HB2 H -1.396 0.532 0.256 1.00 . A A . 3 LEU HB2 1 1 11 3527 1 1 3 LEU HB3 H -1.548 -0.579 1.595 1.00 . A A . 3 LEU HB3 1 1 11 3528 1 1 3 LEU HD11 H -3.575 1.646 -0.710 1.00 . A A . 3 LEU HD11 1 1 11 3529 1 1 3 LEU HD12 H -4.008 2.276 0.872 1.00 . A A . 3 LEU HD12 1 1 11 3530 1 1 3 LEU HD13 H -5.115 1.231 0.023 1.00 . A A . 3 LEU HD13 1 1 11 3531 1 1 3 LEU HD21 H -3.221 -1.928 0.403 1.00 . A A . 3 LEU HD21 1 1 11 3532 1 1 3 LEU HD22 H -3.064 -0.864 -0.985 1.00 . A A . 3 LEU HD22 1 1 11 3533 1 1 3 LEU HD23 H -4.647 -1.182 -0.295 1.00 . A A . 3 LEU HD23 1 1 11 3534 1 1 3 LEU HG H -3.956 -0.031 1.806 1.00 . A A . 3 LEU HG 1 1 11 3535 1 1 3 LEU N N -1.926 2.818 1.612 1.00 . A A . 3 LEU N 1 1 11 3536 1 1 3 LEU O O 0.355 1.550 3.615 1.00 . A A . 3 LEU O 1 1 11 3537 1 1 4 CYS C C 2.716 2.570 2.365 1.00 . A A . 4 CYS C 1 1 11 3538 1 1 4 CYS CA C 2.160 1.531 1.379 1.00 . A A . 4 CYS CA 1 1 11 3539 1 1 4 CYS CB C 2.640 1.900 -0.029 1.00 . A A . 4 CYS CB 1 1 11 3540 1 1 4 CYS H H 0.209 1.452 0.543 1.00 . A A . 4 CYS H 1 1 11 3541 1 1 4 CYS HA H 2.558 0.566 1.644 1.00 . A A . 4 CYS HA 1 1 11 3542 1 1 4 CYS HB2 H 2.565 2.954 -0.207 1.00 . A A . 4 CYS HB2 1 1 11 3543 1 1 4 CYS HB3 H 3.698 1.693 -0.031 1.00 . A A . 4 CYS HB3 1 1 11 3544 1 1 4 CYS N N 0.668 1.501 1.399 1.00 . A A . 4 CYS N 1 1 11 3545 1 1 4 CYS O O 3.523 2.257 3.219 1.00 . A A . 4 CYS O 1 1 11 3546 1 1 4 CYS SG S 1.966 1.103 -1.507 1.00 . A A . 4 CYS SG 1 1 11 3547 1 1 5 CYS C C 2.045 4.894 4.451 1.00 . A A . 5 CYS C 1 1 11 3548 1 1 5 CYS CA C 2.687 4.908 3.060 1.00 . A A . 5 CYS CA 1 1 11 3549 1 1 5 CYS CB C 2.349 6.241 2.375 1.00 . A A . 5 CYS CB 1 1 11 3550 1 1 5 CYS H H 1.584 3.938 1.486 1.00 . A A . 5 CYS H 1 1 11 3551 1 1 5 CYS HA H 3.759 4.841 3.181 1.00 . A A . 5 CYS HA 1 1 11 3552 1 1 5 CYS HB2 H 2.674 6.198 1.345 1.00 . A A . 5 CYS HB2 1 1 11 3553 1 1 5 CYS HB3 H 1.279 6.392 2.377 1.00 . A A . 5 CYS HB3 1 1 11 3554 1 1 5 CYS N N 2.242 3.779 2.194 1.00 . A A . 5 CYS N 1 1 11 3555 1 1 5 CYS O O 2.729 5.101 5.435 1.00 . A A . 5 CYS O 1 1 11 3556 1 1 5 CYS SG S 3.123 7.678 3.152 1.00 . A A . 5 CYS SG 1 1 11 3557 1 1 6 GLY C C 0.639 3.594 6.762 1.00 . A A . 6 GLY C 1 1 11 3558 1 1 6 GLY CA C 0.029 4.620 5.804 1.00 . A A . 6 GLY CA 1 1 11 3559 1 1 6 GLY H H 0.264 4.494 3.662 1.00 . A A . 6 GLY H 1 1 11 3560 1 1 6 GLY HA2 H 0.078 5.599 6.256 1.00 . A A . 6 GLY HA2 1 1 11 3561 1 1 6 GLY HA3 H -1.004 4.364 5.634 1.00 . A A . 6 GLY HA3 1 1 11 3562 1 1 6 GLY N N 0.756 4.654 4.494 1.00 . A A . 6 GLY N 1 1 11 3563 1 1 6 GLY O O 0.654 3.798 7.961 1.00 . A A . 6 GLY O 1 1 11 3564 1 1 7 PHE C C 2.669 0.523 6.144 1.00 . A A . 7 PHE C 1 1 11 3565 1 1 7 PHE CA C 1.752 1.436 7.000 1.00 . A A . 7 PHE CA 1 1 11 3566 1 1 7 PHE CB C 0.613 0.620 7.668 1.00 . A A . 7 PHE CB 1 1 11 3567 1 1 7 PHE CD1 C -0.124 -1.095 5.969 1.00 . A A . 7 PHE CD1 1 1 11 3568 1 1 7 PHE CD2 C -1.540 0.780 6.329 1.00 . A A . 7 PHE CD2 1 1 11 3569 1 1 7 PHE CE1 C -1.008 -1.589 5.034 1.00 . A A . 7 PHE CE1 1 1 11 3570 1 1 7 PHE CE2 C -2.428 0.290 5.394 1.00 . A A . 7 PHE CE2 1 1 11 3571 1 1 7 PHE CG C -0.380 0.087 6.623 1.00 . A A . 7 PHE CG 1 1 11 3572 1 1 7 PHE CZ C -2.162 -0.897 4.745 1.00 . A A . 7 PHE CZ 1 1 11 3573 1 1 7 PHE H H 1.081 2.435 5.219 1.00 . A A . 7 PHE H 1 1 11 3574 1 1 7 PHE HA H 2.341 1.907 7.772 1.00 . A A . 7 PHE HA 1 1 11 3575 1 1 7 PHE HB2 H 1.030 -0.217 8.209 1.00 . A A . 7 PHE HB2 1 1 11 3576 1 1 7 PHE HB3 H 0.079 1.244 8.369 1.00 . A A . 7 PHE HB3 1 1 11 3577 1 1 7 PHE HD1 H 0.782 -1.632 6.196 1.00 . A A . 7 PHE HD1 1 1 11 3578 1 1 7 PHE HD2 H -1.757 1.711 6.833 1.00 . A A . 7 PHE HD2 1 1 11 3579 1 1 7 PHE HE1 H -0.795 -2.520 4.531 1.00 . A A . 7 PHE HE1 1 1 11 3580 1 1 7 PHE HE2 H -3.331 0.836 5.170 1.00 . A A . 7 PHE HE2 1 1 11 3581 1 1 7 PHE HZ H -2.855 -1.281 4.012 1.00 . A A . 7 PHE HZ 1 1 11 3582 1 1 7 PHE N N 1.127 2.521 6.192 1.00 . A A . 7 PHE N 1 1 11 3583 1 1 7 PHE O O 2.322 0.129 5.043 1.00 . A A . 7 PHE O 1 1 11 3584 1 1 8 HYP C C 4.577 -1.867 5.491 1.00 . A A . 8 HYP C 1 1 11 3585 1 1 8 HYP CA C 4.916 -0.438 5.931 1.00 . A A . 8 HYP CA 1 1 11 3586 1 1 8 HYP CB C 6.119 -0.371 6.863 1.00 . A A . 8 HYP CB 1 1 11 3587 1 1 8 HYP CD C 4.239 0.420 8.093 1.00 . A A . 8 HYP CD 1 1 11 3588 1 1 8 HYP CG C 5.503 -0.387 8.219 1.00 . A A . 8 HYP CG 1 1 11 3589 1 1 8 HYP HA H 5.147 0.138 5.046 1.00 . A A . 8 HYP HA 1 1 11 3590 1 1 8 HYP HB2 H 6.681 0.534 6.678 1.00 . A A . 8 HYP HB2 1 1 11 3591 1 1 8 HYP HB3 H 6.781 -1.210 6.704 1.00 . A A . 8 HYP HB3 1 1 11 3592 1 1 8 HYP HD1 H 5.939 0.225 10.011 1.00 . A A . 8 HYP HD1 1 1 11 3593 1 1 8 HYP HD22 H 4.439 1.466 8.283 1.00 . A A . 8 HYP HD22 1 1 11 3594 1 1 8 HYP HD23 H 3.490 0.048 8.778 1.00 . A A . 8 HYP HD23 1 1 11 3595 1 1 8 HYP HG H 5.274 -1.403 8.506 1.00 . A A . 8 HYP HG 1 1 11 3596 1 1 8 HYP N N 3.827 0.208 6.688 1.00 . A A . 8 HYP N 1 1 11 3597 1 1 8 HYP O O 5.347 -2.463 4.761 1.00 . A A . 8 HYP O 1 1 11 3598 1 1 8 HYP OD1 O 6.387 0.197 9.164 1.00 . A A . 8 HYP OD1 1 1 11 3599 1 1 9 LYS C C 2.874 -3.797 4.040 1.00 . A A . 9 LYS C 1 1 11 3600 1 1 9 LYS CA C 3.055 -3.751 5.556 1.00 . A A . 9 LYS CA 1 1 11 3601 1 1 9 LYS CB C 1.726 -4.154 6.232 1.00 . A A . 9 LYS CB 1 1 11 3602 1 1 9 LYS CD C 0.518 -4.439 8.414 1.00 . A A . 9 LYS CD 1 1 11 3603 1 1 9 LYS CE C 0.638 -4.321 9.940 1.00 . A A . 9 LYS CE 1 1 11 3604 1 1 9 LYS CG C 1.853 -4.030 7.764 1.00 . A A . 9 LYS CG 1 1 11 3605 1 1 9 LYS H H 2.874 -1.834 6.529 1.00 . A A . 9 LYS H 1 1 11 3606 1 1 9 LYS HA H 3.844 -4.434 5.839 1.00 . A A . 9 LYS HA 1 1 11 3607 1 1 9 LYS HB2 H 0.905 -3.568 5.855 1.00 . A A . 9 LYS HB2 1 1 11 3608 1 1 9 LYS HB3 H 1.526 -5.188 5.988 1.00 . A A . 9 LYS HB3 1 1 11 3609 1 1 9 LYS HD2 H -0.275 -3.791 8.065 1.00 . A A . 9 LYS HD2 1 1 11 3610 1 1 9 LYS HD3 H 0.274 -5.458 8.149 1.00 . A A . 9 LYS HD3 1 1 11 3611 1 1 9 LYS HE2 H 1.420 -4.972 10.308 1.00 . A A . 9 LYS HE2 1 1 11 3612 1 1 9 LYS HE3 H 0.865 -3.304 10.225 1.00 . A A . 9 LYS HE3 1 1 11 3613 1 1 9 LYS HG2 H 2.645 -4.674 8.118 1.00 . A A . 9 LYS HG2 1 1 11 3614 1 1 9 LYS HG3 H 2.089 -3.010 8.032 1.00 . A A . 9 LYS HG3 1 1 11 3615 1 1 9 LYS HZ1 H -0.899 -5.681 10.283 1.00 . A A . 9 LYS HZ1 1 1 11 3616 1 1 9 LYS HZ2 H -1.397 -4.059 10.284 1.00 . A A . 9 LYS HZ2 1 1 11 3617 1 1 9 LYS HZ3 H -0.548 -4.686 11.613 1.00 . A A . 9 LYS HZ3 1 1 11 3618 1 1 9 LYS N N 3.452 -2.365 5.943 1.00 . A A . 9 LYS N 1 1 11 3619 1 1 9 LYS NZ N -0.648 -4.716 10.579 1.00 . A A . 9 LYS NZ 1 1 11 3620 1 1 9 LYS O O 3.203 -4.801 3.435 1.00 . A A . 9 LYS O 1 1 11 3621 1 1 10 SER C C 3.525 -2.452 1.281 1.00 . A A . 10 SER C 1 1 11 3622 1 1 10 SER CA C 2.190 -2.758 1.979 1.00 . A A . 10 SER CA 1 1 11 3623 1 1 10 SER CB C 1.102 -1.737 1.631 1.00 . A A . 10 SER CB 1 1 11 3624 1 1 10 SER H H 2.103 -1.912 3.940 1.00 . A A . 10 SER H 1 1 11 3625 1 1 10 SER HA H 1.863 -3.744 1.677 1.00 . A A . 10 SER HA 1 1 11 3626 1 1 10 SER HB2 H 1.285 -0.797 2.115 1.00 . A A . 10 SER HB2 1 1 11 3627 1 1 10 SER HB3 H 0.955 -1.613 0.569 1.00 . A A . 10 SER HB3 1 1 11 3628 1 1 10 SER HG H -0.738 -2.358 1.545 1.00 . A A . 10 SER HG 1 1 11 3629 1 1 10 SER N N 2.368 -2.729 3.456 1.00 . A A . 10 SER N 1 1 11 3630 1 1 10 SER O O 3.666 -2.777 0.121 1.00 . A A . 10 SER O 1 1 11 3631 1 1 10 SER OG O -0.061 -2.299 2.222 1.00 . A A . 10 SER OG 1 1 11 3632 1 1 11 CYS C C 6.579 -2.802 0.948 1.00 . A A . 11 CYS C 1 1 11 3633 1 1 11 CYS CA C 5.795 -1.537 1.348 1.00 . A A . 11 CYS CA 1 1 11 3634 1 1 11 CYS CB C 6.702 -0.728 2.302 1.00 . A A . 11 CYS CB 1 1 11 3635 1 1 11 CYS H H 4.302 -1.612 2.918 1.00 . A A . 11 CYS H 1 1 11 3636 1 1 11 CYS HA H 5.628 -0.945 0.466 1.00 . A A . 11 CYS HA 1 1 11 3637 1 1 11 CYS HB2 H 6.809 -1.291 3.216 1.00 . A A . 11 CYS HB2 1 1 11 3638 1 1 11 CYS HB3 H 7.685 -0.673 1.857 1.00 . A A . 11 CYS HB3 1 1 11 3639 1 1 11 CYS N N 4.466 -1.853 1.982 1.00 . A A . 11 CYS N 1 1 11 3640 1 1 11 CYS O O 7.625 -2.707 0.332 1.00 . A A . 11 CYS O 1 1 11 3641 1 1 11 CYS SG S 6.276 0.965 2.776 1.00 . A A . 11 CYS SG 1 1 11 3642 1 1 12 ARG C C 6.376 -5.492 -0.529 1.00 . A A . 12 ARG C 1 1 11 3643 1 1 12 ARG CA C 6.721 -5.245 0.968 1.00 . A A . 12 ARG CA 1 1 11 3644 1 1 12 ARG CB C 6.114 -6.334 1.878 1.00 . A A . 12 ARG CB 1 1 11 3645 1 1 12 ARG CD C 7.617 -8.302 0.905 1.00 . A A . 12 ARG CD 1 1 11 3646 1 1 12 ARG CG C 6.997 -7.600 2.139 1.00 . A A . 12 ARG CG 1 1 11 3647 1 1 12 ARG CZ C 9.875 -7.317 0.970 1.00 . A A . 12 ARG CZ 1 1 11 3648 1 1 12 ARG H H 5.201 -3.959 1.789 1.00 . A A . 12 ARG H 1 1 11 3649 1 1 12 ARG HA H 7.789 -5.149 1.097 1.00 . A A . 12 ARG HA 1 1 11 3650 1 1 12 ARG HB2 H 5.900 -5.889 2.838 1.00 . A A . 12 ARG HB2 1 1 11 3651 1 1 12 ARG HB3 H 5.172 -6.658 1.458 1.00 . A A . 12 ARG HB3 1 1 11 3652 1 1 12 ARG HD2 H 8.006 -9.271 1.181 1.00 . A A . 12 ARG HD2 1 1 11 3653 1 1 12 ARG HD3 H 6.868 -8.436 0.138 1.00 . A A . 12 ARG HD3 1 1 11 3654 1 1 12 ARG HE H 8.620 -7.019 -0.515 1.00 . A A . 12 ARG HE 1 1 11 3655 1 1 12 ARG HG2 H 7.786 -7.317 2.819 1.00 . A A . 12 ARG HG2 1 1 11 3656 1 1 12 ARG HG3 H 6.382 -8.325 2.653 1.00 . A A . 12 ARG HG3 1 1 11 3657 1 1 12 ARG HH11 H 9.386 -8.456 2.548 1.00 . A A . 12 ARG HH11 1 1 11 3658 1 1 12 ARG HH12 H 10.971 -7.760 2.585 1.00 . A A . 12 ARG HH12 1 1 11 3659 1 1 12 ARG HH21 H 10.595 -6.144 -0.482 1.00 . A A . 12 ARG HH21 1 1 11 3660 1 1 12 ARG HH22 H 11.668 -6.435 0.847 1.00 . A A . 12 ARG HH22 1 1 11 3661 1 1 12 ARG N N 6.050 -3.947 1.300 1.00 . A A . 12 ARG N 1 1 11 3662 1 1 12 ARG NE N 8.733 -7.469 0.346 1.00 . A A . 12 ARG NE 1 1 11 3663 1 1 12 ARG NH1 N 10.092 -7.890 2.125 1.00 . A A . 12 ARG NH1 1 1 11 3664 1 1 12 ARG NH2 N 10.784 -6.574 0.401 1.00 . A A . 12 ARG NH2 1 1 11 3665 1 1 12 ARG O O 7.073 -6.189 -1.238 1.00 . A A . 12 ARG O 1 1 11 3666 1 1 13 SER C C 5.816 -4.299 -3.322 1.00 . A A . 13 SER C 1 1 11 3667 1 1 13 SER CA C 4.859 -5.062 -2.399 1.00 . A A . 13 SER CA 1 1 11 3668 1 1 13 SER CB C 3.433 -4.508 -2.554 1.00 . A A . 13 SER CB 1 1 11 3669 1 1 13 SER H H 4.762 -4.341 -0.378 1.00 . A A . 13 SER H 1 1 11 3670 1 1 13 SER HA H 4.879 -6.112 -2.654 1.00 . A A . 13 SER HA 1 1 11 3671 1 1 13 SER HB2 H 2.729 -5.047 -1.937 1.00 . A A . 13 SER HB2 1 1 11 3672 1 1 13 SER HB3 H 3.389 -3.452 -2.335 1.00 . A A . 13 SER HB3 1 1 11 3673 1 1 13 SER HG H 3.390 -5.599 -4.168 1.00 . A A . 13 SER HG 1 1 11 3674 1 1 13 SER N N 5.294 -4.900 -0.978 1.00 . A A . 13 SER N 1 1 11 3675 1 1 13 SER O O 6.282 -3.228 -2.983 1.00 . A A . 13 SER O 1 1 11 3676 1 1 13 SER OG O 3.114 -4.712 -3.925 1.00 . A A . 13 SER OG 1 1 11 3677 1 1 14 ARG C C 6.358 -2.942 -5.954 1.00 . A A . 14 ARG C 1 1 11 3678 1 1 14 ARG CA C 6.987 -4.256 -5.462 1.00 . A A . 14 ARG CA 1 1 11 3679 1 1 14 ARG CB C 7.188 -5.235 -6.641 1.00 . A A . 14 ARG CB 1 1 11 3680 1 1 14 ARG CD C 9.571 -4.448 -7.086 1.00 . A A . 14 ARG CD 1 1 11 3681 1 1 14 ARG CG C 8.166 -4.657 -7.696 1.00 . A A . 14 ARG CG 1 1 11 3682 1 1 14 ARG CZ C 10.517 -2.560 -8.335 1.00 . A A . 14 ARG CZ 1 1 11 3683 1 1 14 ARG H H 5.658 -5.754 -4.664 1.00 . A A . 14 ARG H 1 1 11 3684 1 1 14 ARG HA H 7.924 -4.040 -4.972 1.00 . A A . 14 ARG HA 1 1 11 3685 1 1 14 ARG HB2 H 7.572 -6.173 -6.266 1.00 . A A . 14 ARG HB2 1 1 11 3686 1 1 14 ARG HB3 H 6.234 -5.427 -7.111 1.00 . A A . 14 ARG HB3 1 1 11 3687 1 1 14 ARG HD2 H 9.553 -3.795 -6.228 1.00 . A A . 14 ARG HD2 1 1 11 3688 1 1 14 ARG HD3 H 9.989 -5.399 -6.790 1.00 . A A . 14 ARG HD3 1 1 11 3689 1 1 14 ARG HE H 11.001 -4.448 -8.694 1.00 . A A . 14 ARG HE 1 1 11 3690 1 1 14 ARG HG2 H 8.241 -5.351 -8.521 1.00 . A A . 14 ARG HG2 1 1 11 3691 1 1 14 ARG HG3 H 7.789 -3.721 -8.080 1.00 . A A . 14 ARG HG3 1 1 11 3692 1 1 14 ARG HH11 H 9.194 -2.086 -6.902 1.00 . A A . 14 ARG HH11 1 1 11 3693 1 1 14 ARG HH12 H 9.867 -0.751 -7.773 1.00 . A A . 14 ARG HH12 1 1 11 3694 1 1 14 ARG HH21 H 11.850 -2.771 -9.811 1.00 . A A . 14 ARG HH21 1 1 11 3695 1 1 14 ARG HH22 H 11.387 -1.142 -9.446 1.00 . A A . 14 ARG HH22 1 1 11 3696 1 1 14 ARG N N 6.071 -4.888 -4.463 1.00 . A A . 14 ARG N 1 1 11 3697 1 1 14 ARG NE N 10.454 -3.855 -8.138 1.00 . A A . 14 ARG NE 1 1 11 3698 1 1 14 ARG NH1 N 9.804 -1.735 -7.613 1.00 . A A . 14 ARG NH1 1 1 11 3699 1 1 14 ARG NH2 N 11.314 -2.123 -9.270 1.00 . A A . 14 ARG NH2 1 1 11 3700 1 1 14 ARG O O 7.055 -2.024 -6.338 1.00 . A A . 14 ARG O 1 1 11 3701 1 1 15 GLN C C 4.565 -0.563 -5.365 1.00 . A A . 15 GLN C 1 1 11 3702 1 1 15 GLN CA C 4.290 -1.698 -6.360 1.00 . A A . 15 GLN CA 1 1 11 3703 1 1 15 GLN CB C 2.793 -2.053 -6.390 1.00 . A A . 15 GLN CB 1 1 11 3704 1 1 15 GLN CD C 0.484 -1.230 -6.868 1.00 . A A . 15 GLN CD 1 1 11 3705 1 1 15 GLN CG C 1.964 -0.837 -6.849 1.00 . A A . 15 GLN CG 1 1 11 3706 1 1 15 GLN H H 4.554 -3.690 -5.597 1.00 . A A . 15 GLN H 1 1 11 3707 1 1 15 GLN HA H 4.633 -1.405 -7.342 1.00 . A A . 15 GLN HA 1 1 11 3708 1 1 15 GLN HB2 H 2.639 -2.874 -7.074 1.00 . A A . 15 GLN HB2 1 1 11 3709 1 1 15 GLN HB3 H 2.475 -2.363 -5.404 1.00 . A A . 15 GLN HB3 1 1 11 3710 1 1 15 GLN HE21 H 0.337 -1.235 -4.889 1.00 . A A . 15 GLN HE21 1 1 11 3711 1 1 15 GLN HE22 H -1.086 -1.633 -5.724 1.00 . A A . 15 GLN HE22 1 1 11 3712 1 1 15 GLN HG2 H 2.088 -0.007 -6.169 1.00 . A A . 15 GLN HG2 1 1 11 3713 1 1 15 GLN HG3 H 2.260 -0.529 -7.842 1.00 . A A . 15 GLN HG3 1 1 11 3714 1 1 15 GLN N N 5.048 -2.907 -5.919 1.00 . A A . 15 GLN N 1 1 11 3715 1 1 15 GLN NE2 N -0.140 -1.378 -5.732 1.00 . A A . 15 GLN NE2 1 1 11 3716 1 1 15 GLN O O 4.683 0.584 -5.749 1.00 . A A . 15 GLN O 1 1 11 3717 1 1 15 GLN OE1 O -0.115 -1.408 -7.910 1.00 . A A . 15 GLN OE1 1 1 11 3718 1 1 16 CYS C C 6.413 0.372 -2.846 1.00 . A A . 16 CYS C 1 1 11 3719 1 1 16 CYS CA C 4.923 0.051 -3.030 1.00 . A A . 16 CYS CA 1 1 11 3720 1 1 16 CYS CB C 4.418 -0.469 -1.709 1.00 . A A . 16 CYS CB 1 1 11 3721 1 1 16 CYS H H 4.544 -1.884 -3.882 1.00 . A A . 16 CYS H 1 1 11 3722 1 1 16 CYS HA H 4.392 0.958 -3.253 1.00 . A A . 16 CYS HA 1 1 11 3723 1 1 16 CYS HB2 H 4.932 -1.383 -1.489 1.00 . A A . 16 CYS HB2 1 1 11 3724 1 1 16 CYS HB3 H 4.727 0.240 -0.959 1.00 . A A . 16 CYS HB3 1 1 11 3725 1 1 16 CYS N N 4.656 -0.938 -4.113 1.00 . A A . 16 CYS N 1 1 11 3726 1 1 16 CYS O O 6.748 1.406 -2.297 1.00 . A A . 16 CYS O 1 1 11 3727 1 1 16 CYS SG S 2.663 -0.783 -1.422 1.00 . A A . 16 CYS SG 1 1 11 3728 1 1 17 LYS C C 9.258 1.077 -3.552 1.00 . A A . 17 LYS C 1 1 11 3729 1 1 17 LYS CA C 8.736 -0.338 -3.193 1.00 . A A . 17 LYS CA 1 1 11 3730 1 1 17 LYS CB C 9.415 -1.408 -4.096 1.00 . A A . 17 LYS CB 1 1 11 3731 1 1 17 LYS CD C 11.480 -1.571 -2.603 1.00 . A A . 17 LYS CD 1 1 11 3732 1 1 17 LYS CE C 13.018 -1.500 -2.578 1.00 . A A . 17 LYS CE 1 1 11 3733 1 1 17 LYS CG C 10.965 -1.325 -4.044 1.00 . A A . 17 LYS CG 1 1 11 3734 1 1 17 LYS H H 6.903 -1.324 -3.742 1.00 . A A . 17 LYS H 1 1 11 3735 1 1 17 LYS HA H 8.996 -0.537 -2.164 1.00 . A A . 17 LYS HA 1 1 11 3736 1 1 17 LYS HB2 H 9.102 -2.391 -3.772 1.00 . A A . 17 LYS HB2 1 1 11 3737 1 1 17 LYS HB3 H 9.103 -1.279 -5.119 1.00 . A A . 17 LYS HB3 1 1 11 3738 1 1 17 LYS HD2 H 11.092 -0.819 -1.933 1.00 . A A . 17 LYS HD2 1 1 11 3739 1 1 17 LYS HD3 H 11.154 -2.542 -2.258 1.00 . A A . 17 LYS HD3 1 1 11 3740 1 1 17 LYS HE2 H 13.377 -1.678 -1.576 1.00 . A A . 17 LYS HE2 1 1 11 3741 1 1 17 LYS HE3 H 13.444 -2.242 -3.238 1.00 . A A . 17 LYS HE3 1 1 11 3742 1 1 17 LYS HG2 H 11.376 -2.075 -4.703 1.00 . A A . 17 LYS HG2 1 1 11 3743 1 1 17 LYS HG3 H 11.289 -0.356 -4.395 1.00 . A A . 17 LYS HG3 1 1 11 3744 1 1 17 LYS HZ1 H 12.776 0.562 -2.752 1.00 . A A . 17 LYS HZ1 1 1 11 3745 1 1 17 LYS HZ2 H 13.609 -0.152 -4.048 1.00 . A A . 17 LYS HZ2 1 1 11 3746 1 1 17 LYS HZ3 H 14.389 0.068 -2.555 1.00 . A A . 17 LYS HZ3 1 1 11 3747 1 1 17 LYS N N 7.254 -0.519 -3.309 1.00 . A A . 17 LYS N 1 1 11 3748 1 1 17 LYS NZ N 13.483 -0.153 -3.016 1.00 . A A . 17 LYS NZ 1 1 11 3749 1 1 17 LYS O O 10.064 1.607 -2.811 1.00 . A A . 17 LYS O 1 1 11 3750 1 1 18 HYP C C 8.727 4.173 -4.514 1.00 . A A . 18 HYP C 1 1 11 3751 1 1 18 HYP CA C 9.367 2.922 -5.149 1.00 . A A . 18 HYP CA 1 1 11 3752 1 1 18 HYP CB C 9.169 2.828 -6.662 1.00 . A A . 18 HYP CB 1 1 11 3753 1 1 18 HYP CD C 7.726 1.210 -5.540 1.00 . A A . 18 HYP CD 1 1 11 3754 1 1 18 HYP CG C 8.038 1.859 -6.869 1.00 . A A . 18 HYP CG 1 1 11 3755 1 1 18 HYP HA H 10.431 2.966 -4.966 1.00 . A A . 18 HYP HA 1 1 11 3756 1 1 18 HYP HB2 H 10.084 2.485 -7.123 1.00 . A A . 18 HYP HB2 1 1 11 3757 1 1 18 HYP HB3 H 8.941 3.799 -7.077 1.00 . A A . 18 HYP HB3 1 1 11 3758 1 1 18 HYP HD1 H 8.260 0.012 -7.467 1.00 . A A . 18 HYP HD1 1 1 11 3759 1 1 18 HYP HD22 H 7.707 0.139 -5.639 1.00 . A A . 18 HYP HD22 1 1 11 3760 1 1 18 HYP HD23 H 6.776 1.564 -5.178 1.00 . A A . 18 HYP HD23 1 1 11 3761 1 1 18 HYP HG H 7.169 2.400 -7.214 1.00 . A A . 18 HYP HG 1 1 11 3762 1 1 18 HYP N N 8.808 1.656 -4.646 1.00 . A A . 18 HYP N 1 1 11 3763 1 1 18 HYP O O 9.041 5.274 -4.927 1.00 . A A . 18 HYP O 1 1 11 3764 1 1 18 HYP OD1 O 8.406 0.885 -7.837 1.00 . A A . 18 HYP OD1 1 1 11 3765 1 1 19 HIS C C 8.179 5.933 -2.027 1.00 . A A . 19 HIS C 1 1 11 3766 1 1 19 HIS CA C 7.200 5.131 -2.874 1.00 . A A . 19 HIS CA 1 1 11 3767 1 1 19 HIS CB C 6.048 4.626 -1.973 1.00 . A A . 19 HIS CB 1 1 11 3768 1 1 19 HIS CD2 C 4.895 3.468 -4.079 1.00 . A A . 19 HIS CD2 1 1 11 3769 1 1 19 HIS CE1 C 2.959 3.408 -3.353 1.00 . A A . 19 HIS CE1 1 1 11 3770 1 1 19 HIS CG C 4.911 4.027 -2.813 1.00 . A A . 19 HIS CG 1 1 11 3771 1 1 19 HIS H H 7.654 3.063 -3.249 1.00 . A A . 19 HIS H 1 1 11 3772 1 1 19 HIS HA H 6.815 5.786 -3.636 1.00 . A A . 19 HIS HA 1 1 11 3773 1 1 19 HIS HB2 H 6.411 3.864 -1.300 1.00 . A A . 19 HIS HB2 1 1 11 3774 1 1 19 HIS HB3 H 5.647 5.442 -1.390 1.00 . A A . 19 HIS HB3 1 1 11 3775 1 1 19 HIS HD1 H 3.343 4.269 -1.561 1.00 . A A . 19 HIS HD1 1 1 11 3776 1 1 19 HIS HD2 H 5.756 3.358 -4.715 1.00 . A A . 19 HIS HD2 1 1 11 3777 1 1 19 HIS HE1 H 1.895 3.236 -3.270 1.00 . A A . 19 HIS HE1 1 1 11 3778 1 1 19 HIS N N 7.866 3.971 -3.544 1.00 . A A . 19 HIS N 1 1 11 3779 1 1 19 HIS ND1 N 3.680 3.955 -2.427 1.00 . A A . 19 HIS ND1 1 1 11 3780 1 1 19 HIS NE2 N 3.675 3.088 -4.400 1.00 . A A . 19 HIS NE2 1 1 11 3781 1 1 19 HIS O O 9.143 5.402 -1.516 1.00 . A A . 19 HIS O 1 1 11 3782 1 1 20 ARG C C 8.597 7.817 0.376 1.00 . A A . 20 ARG C 1 1 11 3783 1 1 20 ARG CA C 8.733 8.138 -1.121 1.00 . A A . 20 ARG CA 1 1 11 3784 1 1 20 ARG CB C 8.287 9.608 -1.356 1.00 . A A . 20 ARG CB 1 1 11 3785 1 1 20 ARG CD C 7.524 9.328 -3.813 1.00 . A A . 20 ARG CD 1 1 11 3786 1 1 20 ARG CG C 8.426 10.103 -2.829 1.00 . A A . 20 ARG CG 1 1 11 3787 1 1 20 ARG CZ C 6.895 9.580 -6.164 1.00 . A A . 20 ARG CZ 1 1 11 3788 1 1 20 ARG H H 7.078 7.542 -2.360 1.00 . A A . 20 ARG H 1 1 11 3789 1 1 20 ARG HA H 9.765 8.011 -1.414 1.00 . A A . 20 ARG HA 1 1 11 3790 1 1 20 ARG HB2 H 7.255 9.712 -1.053 1.00 . A A . 20 ARG HB2 1 1 11 3791 1 1 20 ARG HB3 H 8.882 10.254 -0.727 1.00 . A A . 20 ARG HB3 1 1 11 3792 1 1 20 ARG HD2 H 7.850 8.304 -3.916 1.00 . A A . 20 ARG HD2 1 1 11 3793 1 1 20 ARG HD3 H 6.492 9.353 -3.491 1.00 . A A . 20 ARG HD3 1 1 11 3794 1 1 20 ARG HE H 8.284 10.697 -5.291 1.00 . A A . 20 ARG HE 1 1 11 3795 1 1 20 ARG HG2 H 8.169 11.151 -2.870 1.00 . A A . 20 ARG HG2 1 1 11 3796 1 1 20 ARG HG3 H 9.454 9.998 -3.141 1.00 . A A . 20 ARG HG3 1 1 11 3797 1 1 20 ARG HH11 H 5.932 8.158 -5.128 1.00 . A A . 20 ARG HH11 1 1 11 3798 1 1 20 ARG HH12 H 5.465 8.323 -6.785 1.00 . A A . 20 ARG HH12 1 1 11 3799 1 1 20 ARG HH21 H 7.714 10.925 -7.399 1.00 . A A . 20 ARG HH21 1 1 11 3800 1 1 20 ARG HH22 H 6.493 9.913 -8.096 1.00 . A A . 20 ARG HH22 1 1 11 3801 1 1 20 ARG N N 7.881 7.202 -1.915 1.00 . A A . 20 ARG N 1 1 11 3802 1 1 20 ARG NE N 7.640 9.969 -5.159 1.00 . A A . 20 ARG NE 1 1 11 3803 1 1 20 ARG NH1 N 6.030 8.611 -6.014 1.00 . A A . 20 ARG NH1 1 1 11 3804 1 1 20 ARG NH2 N 7.045 10.186 -7.308 1.00 . A A . 20 ARG NH2 1 1 11 3805 1 1 20 ARG O O 9.435 8.194 1.171 1.00 . A A . 20 ARG O 1 1 11 3806 1 1 21 CYS C C 7.939 5.391 2.416 1.00 . A A . 21 CYS C 1 1 11 3807 1 1 21 CYS CA C 7.253 6.731 2.112 1.00 . A A . 21 CYS CA 1 1 11 3808 1 1 21 CYS CB C 5.755 6.575 2.294 1.00 . A A . 21 CYS CB 1 1 11 3809 1 1 21 CYS H H 6.909 6.850 -0.008 1.00 . A A . 21 CYS H 1 1 11 3810 1 1 21 CYS HA H 7.634 7.488 2.782 1.00 . A A . 21 CYS HA 1 1 11 3811 1 1 21 CYS HB2 H 5.434 5.722 1.714 1.00 . A A . 21 CYS HB2 1 1 11 3812 1 1 21 CYS HB3 H 5.577 6.341 3.334 1.00 . A A . 21 CYS HB3 1 1 11 3813 1 1 21 CYS N N 7.534 7.123 0.696 1.00 . A A . 21 CYS N 1 1 11 3814 1 1 21 CYS O O 8.183 5.067 3.563 1.00 . A A . 21 CYS O 1 1 11 3815 1 1 21 CYS SG S 4.655 7.946 1.864 1.00 . A A . 21 CYS SG 1 1 11 3816 1 1 22 . C C 10.299 3.478 0.894 1.00 . A A . 22 CY3 C 1 1 11 3817 1 1 22 . CA C 8.890 3.330 1.484 1.00 . A A . 22 CY3 CA 1 1 11 3818 1 1 22 . CB C 8.103 2.282 0.682 1.00 . A A . 22 CY3 CB 1 1 11 3819 1 1 22 . H H 8.008 4.992 0.467 1.00 . A A . 22 CY3 H 1 1 11 3820 1 1 22 . HA H 8.967 3.037 2.522 1.00 . A A . 22 CY3 HA 1 1 11 3821 1 1 22 . HB2 H 8.611 1.336 0.796 1.00 . A A . 22 CY3 HB2 1 1 11 3822 1 1 22 . HB3 H 8.171 2.551 -0.363 1.00 . A A . 22 CY3 HB3 1 1 11 3823 1 1 22 . HN11 H 10.020 5.395 0.474 1.00 . A A . 22 CY3 HN11 1 1 11 3824 1 1 22 . HN12 H 11.528 4.785 0.031 1.00 . A A . 22 CY3 HN12 1 1 11 3825 1 1 22 . N N 8.224 4.662 1.365 1.00 . A A . 22 CY3 N 1 1 11 3826 1 1 22 . N1 N 10.649 4.646 0.429 1.00 . A A . 22 CY3 N1 1 1 11 3827 1 1 22 . O O 11.079 2.548 0.840 1.00 . A A . 22 CY3 O 1 1 11 3828 1 1 22 . SG S 6.351 1.977 1.028 1.00 . A A . 22 CY3 SG 1 1 12 3829 1 1 1 PCA C C -3.165 6.261 1.133 1.00 . A A . 1 PCA C 1 1 12 3830 1 1 1 PCA CA C -3.690 7.579 1.713 1.00 . A A . 1 PCA CA 1 1 12 3831 1 1 1 PCA CB C -3.127 7.847 3.111 1.00 . A A . 1 PCA CB 1 1 12 3832 1 1 1 PCA CD C -5.500 7.604 3.274 1.00 . A A . 1 PCA CD 1 1 12 3833 1 1 1 PCA CG C -4.239 7.502 4.095 1.00 . A A . 1 PCA CG 1 1 12 3834 1 1 1 PCA HA H -3.412 8.389 1.055 1.00 . A A . 1 PCA HA 1 1 12 3835 1 1 1 PCA HB2 H -2.830 8.882 3.189 1.00 . A A . 1 PCA HB2 1 1 12 3836 1 1 1 PCA HB3 H -2.247 7.243 3.285 1.00 . A A . 1 PCA HB3 1 1 12 3837 1 1 1 PCA HG2 H -4.255 8.214 4.909 1.00 . A A . 1 PCA HG2 1 1 12 3838 1 1 1 PCA HG3 H -4.110 6.497 4.471 1.00 . A A . 1 PCA HG3 1 1 12 3839 1 1 1 PCA N N -5.162 7.577 1.853 1.00 . A A . 1 PCA N 1 1 12 3840 1 1 1 PCA O O -3.894 5.288 1.065 1.00 . A A . 1 PCA O 1 1 12 3841 1 1 1 PCA OE O -6.621 7.695 3.735 1.00 . A A . 1 PCA OE 1 1 12 3842 1 1 2 ARG C C -1.069 4.014 1.245 1.00 . A A . 2 ARG C 1 1 12 3843 1 1 2 ARG CA C -1.283 5.069 0.154 1.00 . A A . 2 ARG CA 1 1 12 3844 1 1 2 ARG CB C 0.087 5.416 -0.459 1.00 . A A . 2 ARG CB 1 1 12 3845 1 1 2 ARG CD C 1.355 6.685 -2.177 1.00 . A A . 2 ARG CD 1 1 12 3846 1 1 2 ARG CG C -0.050 6.435 -1.606 1.00 . A A . 2 ARG CG 1 1 12 3847 1 1 2 ARG CZ C 1.840 7.459 -4.468 1.00 . A A . 2 ARG CZ 1 1 12 3848 1 1 2 ARG H H -1.397 7.112 0.825 1.00 . A A . 2 ARG H 1 1 12 3849 1 1 2 ARG HA H -1.932 4.665 -0.610 1.00 . A A . 2 ARG HA 1 1 12 3850 1 1 2 ARG HB2 H 0.728 5.826 0.309 1.00 . A A . 2 ARG HB2 1 1 12 3851 1 1 2 ARG HB3 H 0.546 4.512 -0.834 1.00 . A A . 2 ARG HB3 1 1 12 3852 1 1 2 ARG HD2 H 2.004 7.099 -1.420 1.00 . A A . 2 ARG HD2 1 1 12 3853 1 1 2 ARG HD3 H 1.766 5.752 -2.521 1.00 . A A . 2 ARG HD3 1 1 12 3854 1 1 2 ARG HE H 0.726 8.474 -3.187 1.00 . A A . 2 ARG HE 1 1 12 3855 1 1 2 ARG HG2 H -0.696 6.043 -2.377 1.00 . A A . 2 ARG HG2 1 1 12 3856 1 1 2 ARG HG3 H -0.466 7.362 -1.236 1.00 . A A . 2 ARG HG3 1 1 12 3857 1 1 2 ARG HH11 H 2.676 5.688 -3.997 1.00 . A A . 2 ARG HH11 1 1 12 3858 1 1 2 ARG HH12 H 2.987 6.269 -5.593 1.00 . A A . 2 ARG HH12 1 1 12 3859 1 1 2 ARG HH21 H 1.138 9.185 -5.195 1.00 . A A . 2 ARG HH21 1 1 12 3860 1 1 2 ARG HH22 H 2.119 8.257 -6.280 1.00 . A A . 2 ARG HH22 1 1 12 3861 1 1 2 ARG N N -1.918 6.287 0.738 1.00 . A A . 2 ARG N 1 1 12 3862 1 1 2 ARG NE N 1.252 7.657 -3.312 1.00 . A A . 2 ARG NE 1 1 12 3863 1 1 2 ARG NH1 N 2.555 6.387 -4.700 1.00 . A A . 2 ARG NH1 1 1 12 3864 1 1 2 ARG NH2 N 1.688 8.371 -5.386 1.00 . A A . 2 ARG NH2 1 1 12 3865 1 1 2 ARG O O -0.333 4.248 2.181 1.00 . A A . 2 ARG O 1 1 12 3866 1 1 3 LEU C C -0.171 1.520 2.506 1.00 . A A . 3 LEU C 1 1 12 3867 1 1 3 LEU CA C -1.629 1.752 2.049 1.00 . A A . 3 LEU CA 1 1 12 3868 1 1 3 LEU CB C -2.216 0.482 1.347 1.00 . A A . 3 LEU CB 1 1 12 3869 1 1 3 LEU CD1 C -2.204 -1.258 -0.491 1.00 . A A . 3 LEU CD1 1 1 12 3870 1 1 3 LEU CD2 C -1.562 1.071 -1.125 1.00 . A A . 3 LEU CD2 1 1 12 3871 1 1 3 LEU CG C -1.503 0.025 0.017 1.00 . A A . 3 LEU CG 1 1 12 3872 1 1 3 LEU H H -2.307 2.807 0.300 1.00 . A A . 3 LEU H 1 1 12 3873 1 1 3 LEU HA H -2.226 1.997 2.915 1.00 . A A . 3 LEU HA 1 1 12 3874 1 1 3 LEU HB2 H -2.157 -0.342 2.042 1.00 . A A . 3 LEU HB2 1 1 12 3875 1 1 3 LEU HB3 H -3.260 0.660 1.139 1.00 . A A . 3 LEU HB3 1 1 12 3876 1 1 3 LEU HD11 H -1.736 -1.602 -1.402 1.00 . A A . 3 LEU HD11 1 1 12 3877 1 1 3 LEU HD12 H -3.248 -1.060 -0.690 1.00 . A A . 3 LEU HD12 1 1 12 3878 1 1 3 LEU HD13 H -2.136 -2.041 0.247 1.00 . A A . 3 LEU HD13 1 1 12 3879 1 1 3 LEU HD21 H -1.053 1.982 -0.859 1.00 . A A . 3 LEU HD21 1 1 12 3880 1 1 3 LEU HD22 H -2.588 1.300 -1.375 1.00 . A A . 3 LEU HD22 1 1 12 3881 1 1 3 LEU HD23 H -1.074 0.675 -2.004 1.00 . A A . 3 LEU HD23 1 1 12 3882 1 1 3 LEU HG H -0.469 -0.196 0.214 1.00 . A A . 3 LEU HG 1 1 12 3883 1 1 3 LEU N N -1.726 2.894 1.083 1.00 . A A . 3 LEU N 1 1 12 3884 1 1 3 LEU O O 0.112 1.344 3.674 1.00 . A A . 3 LEU O 1 1 12 3885 1 1 4 CYS C C 2.757 2.248 2.756 1.00 . A A . 4 CYS C 1 1 12 3886 1 1 4 CYS CA C 2.159 1.349 1.658 1.00 . A A . 4 CYS CA 1 1 12 3887 1 1 4 CYS CB C 2.818 1.693 0.315 1.00 . A A . 4 CYS CB 1 1 12 3888 1 1 4 CYS H H 0.333 1.662 0.625 1.00 . A A . 4 CYS H 1 1 12 3889 1 1 4 CYS HA H 2.372 0.323 1.909 1.00 . A A . 4 CYS HA 1 1 12 3890 1 1 4 CYS HB2 H 2.779 2.756 0.152 1.00 . A A . 4 CYS HB2 1 1 12 3891 1 1 4 CYS HB3 H 3.865 1.448 0.393 1.00 . A A . 4 CYS HB3 1 1 12 3892 1 1 4 CYS N N 0.687 1.533 1.520 1.00 . A A . 4 CYS N 1 1 12 3893 1 1 4 CYS O O 3.247 1.771 3.761 1.00 . A A . 4 CYS O 1 1 12 3894 1 1 4 CYS SG S 2.236 0.947 -1.227 1.00 . A A . 4 CYS SG 1 1 12 3895 1 1 5 CYS C C 2.440 4.589 4.777 1.00 . A A . 5 CYS C 1 1 12 3896 1 1 5 CYS CA C 3.223 4.554 3.459 1.00 . A A . 5 CYS CA 1 1 12 3897 1 1 5 CYS CB C 3.157 5.944 2.808 1.00 . A A . 5 CYS CB 1 1 12 3898 1 1 5 CYS H H 2.258 3.829 1.675 1.00 . A A . 5 CYS H 1 1 12 3899 1 1 5 CYS HA H 4.254 4.310 3.674 1.00 . A A . 5 CYS HA 1 1 12 3900 1 1 5 CYS HB2 H 3.563 5.878 1.810 1.00 . A A . 5 CYS HB2 1 1 12 3901 1 1 5 CYS HB3 H 2.125 6.251 2.721 1.00 . A A . 5 CYS HB3 1 1 12 3902 1 1 5 CYS N N 2.682 3.533 2.507 1.00 . A A . 5 CYS N 1 1 12 3903 1 1 5 CYS O O 3.022 4.631 5.843 1.00 . A A . 5 CYS O 1 1 12 3904 1 1 5 CYS SG S 4.054 7.241 3.696 1.00 . A A . 5 CYS SG 1 1 12 3905 1 1 6 GLY C C 0.567 3.492 6.812 1.00 . A A . 6 GLY C 1 1 12 3906 1 1 6 GLY CA C 0.218 4.602 5.825 1.00 . A A . 6 GLY CA 1 1 12 3907 1 1 6 GLY H H 0.758 4.532 3.747 1.00 . A A . 6 GLY H 1 1 12 3908 1 1 6 GLY HA2 H 0.303 5.561 6.316 1.00 . A A . 6 GLY HA2 1 1 12 3909 1 1 6 GLY HA3 H -0.797 4.462 5.481 1.00 . A A . 6 GLY HA3 1 1 12 3910 1 1 6 GLY N N 1.137 4.571 4.646 1.00 . A A . 6 GLY N 1 1 12 3911 1 1 6 GLY O O 0.496 3.680 8.012 1.00 . A A . 6 GLY O 1 1 12 3912 1 1 7 PHE C C 2.157 0.142 6.336 1.00 . A A . 7 PHE C 1 1 12 3913 1 1 7 PHE CA C 1.310 1.191 7.101 1.00 . A A . 7 PHE CA 1 1 12 3914 1 1 7 PHE CB C 0.001 0.560 7.657 1.00 . A A . 7 PHE CB 1 1 12 3915 1 1 7 PHE CD1 C -0.874 -0.984 5.862 1.00 . A A . 7 PHE CD1 1 1 12 3916 1 1 7 PHE CD2 C -2.021 1.071 6.211 1.00 . A A . 7 PHE CD2 1 1 12 3917 1 1 7 PHE CE1 C -1.765 -1.320 4.864 1.00 . A A . 7 PHE CE1 1 1 12 3918 1 1 7 PHE CE2 C -2.915 0.741 5.214 1.00 . A A . 7 PHE CE2 1 1 12 3919 1 1 7 PHE CG C -0.992 0.207 6.541 1.00 . A A . 7 PHE CG 1 1 12 3920 1 1 7 PHE CZ C -2.788 -0.455 4.542 1.00 . A A . 7 PHE CZ 1 1 12 3921 1 1 7 PHE H H 0.967 2.296 5.282 1.00 . A A . 7 PHE H 1 1 12 3922 1 1 7 PHE HA H 1.885 1.569 7.933 1.00 . A A . 7 PHE HA 1 1 12 3923 1 1 7 PHE HB2 H 0.239 -0.341 8.204 1.00 . A A . 7 PHE HB2 1 1 12 3924 1 1 7 PHE HB3 H -0.474 1.249 8.338 1.00 . A A . 7 PHE HB3 1 1 12 3925 1 1 7 PHE HD1 H -0.070 -1.651 6.122 1.00 . A A . 7 PHE HD1 1 1 12 3926 1 1 7 PHE HD2 H -2.126 2.009 6.735 1.00 . A A . 7 PHE HD2 1 1 12 3927 1 1 7 PHE HE1 H -1.662 -2.257 4.338 1.00 . A A . 7 PHE HE1 1 1 12 3928 1 1 7 PHE HE2 H -3.716 1.420 4.962 1.00 . A A . 7 PHE HE2 1 1 12 3929 1 1 7 PHE HZ H -3.490 -0.713 3.763 1.00 . A A . 7 PHE HZ 1 1 12 3930 1 1 7 PHE N N 0.937 2.363 6.259 1.00 . A A . 7 PHE N 1 1 12 3931 1 1 7 PHE O O 1.849 -0.240 5.217 1.00 . A A . 7 PHE O 1 1 12 3932 1 1 8 HYP C C 3.890 -2.409 5.789 1.00 . A A . 8 HYP C 1 1 12 3933 1 1 8 HYP CA C 4.312 -1.034 6.324 1.00 . A A . 8 HYP CA 1 1 12 3934 1 1 8 HYP CB C 5.407 -1.120 7.383 1.00 . A A . 8 HYP CB 1 1 12 3935 1 1 8 HYP CD C 3.500 -0.156 8.431 1.00 . A A . 8 HYP CD 1 1 12 3936 1 1 8 HYP CG C 4.651 -1.096 8.664 1.00 . A A . 8 HYP CG 1 1 12 3937 1 1 8 HYP HA H 4.695 -0.453 5.502 1.00 . A A . 8 HYP HA 1 1 12 3938 1 1 8 HYP HB2 H 6.078 -0.278 7.288 1.00 . A A . 8 HYP HB2 1 1 12 3939 1 1 8 HYP HB3 H 5.988 -2.023 7.271 1.00 . A A . 8 HYP HB3 1 1 12 3940 1 1 8 HYP HD1 H 4.954 -0.579 10.514 1.00 . A A . 8 HYP HD1 1 1 12 3941 1 1 8 HYP HD22 H 3.790 0.857 8.667 1.00 . A A . 8 HYP HD22 1 1 12 3942 1 1 8 HYP HD23 H 2.648 -0.454 9.024 1.00 . A A . 8 HYP HD23 1 1 12 3943 1 1 8 HYP HG H 4.284 -2.086 8.892 1.00 . A A . 8 HYP HG 1 1 12 3944 1 1 8 HYP N N 3.217 -0.299 6.985 1.00 . A A . 8 HYP N 1 1 12 3945 1 1 8 HYP O O 4.693 -3.089 5.178 1.00 . A A . 8 HYP O 1 1 12 3946 1 1 8 HYP OD1 O 5.483 -0.629 9.715 1.00 . A A . 8 HYP OD1 1 1 12 3947 1 1 9 LYS C C 2.227 -4.050 4.038 1.00 . A A . 9 LYS C 1 1 12 3948 1 1 9 LYS CA C 2.125 -4.073 5.568 1.00 . A A . 9 LYS CA 1 1 12 3949 1 1 9 LYS CB C 0.654 -4.209 6.057 1.00 . A A . 9 LYS CB 1 1 12 3950 1 1 9 LYS CD C -0.192 -5.984 4.347 1.00 . A A . 9 LYS CD 1 1 12 3951 1 1 9 LYS CE C -0.924 -7.336 4.248 1.00 . A A . 9 LYS CE 1 1 12 3952 1 1 9 LYS CG C 0.000 -5.607 5.838 1.00 . A A . 9 LYS CG 1 1 12 3953 1 1 9 LYS H H 2.063 -2.157 6.535 1.00 . A A . 9 LYS H 1 1 12 3954 1 1 9 LYS HA H 2.741 -4.869 5.962 1.00 . A A . 9 LYS HA 1 1 12 3955 1 1 9 LYS HB2 H 0.600 -3.956 7.106 1.00 . A A . 9 LYS HB2 1 1 12 3956 1 1 9 LYS HB3 H 0.051 -3.507 5.509 1.00 . A A . 9 LYS HB3 1 1 12 3957 1 1 9 LYS HD2 H -0.749 -5.216 3.829 1.00 . A A . 9 LYS HD2 1 1 12 3958 1 1 9 LYS HD3 H 0.759 -6.116 3.864 1.00 . A A . 9 LYS HD3 1 1 12 3959 1 1 9 LYS HE2 H -1.055 -7.609 3.212 1.00 . A A . 9 LYS HE2 1 1 12 3960 1 1 9 LYS HE3 H -0.356 -8.109 4.745 1.00 . A A . 9 LYS HE3 1 1 12 3961 1 1 9 LYS HG2 H 0.619 -6.356 6.312 1.00 . A A . 9 LYS HG2 1 1 12 3962 1 1 9 LYS HG3 H -0.961 -5.608 6.333 1.00 . A A . 9 LYS HG3 1 1 12 3963 1 1 9 LYS HZ1 H -2.895 -7.971 4.485 1.00 . A A . 9 LYS HZ1 1 1 12 3964 1 1 9 LYS HZ2 H -2.669 -6.304 4.724 1.00 . A A . 9 LYS HZ2 1 1 12 3965 1 1 9 LYS HZ3 H -2.170 -7.409 5.914 1.00 . A A . 9 LYS HZ3 1 1 12 3966 1 1 9 LYS N N 2.652 -2.761 6.038 1.00 . A A . 9 LYS N 1 1 12 3967 1 1 9 LYS NZ N -2.266 -7.247 4.890 1.00 . A A . 9 LYS NZ 1 1 12 3968 1 1 9 LYS O O 2.680 -5.020 3.460 1.00 . A A . 9 LYS O 1 1 12 3969 1 1 10 SER C C 3.304 -2.483 1.444 1.00 . A A . 10 SER C 1 1 12 3970 1 1 10 SER CA C 1.920 -2.928 1.932 1.00 . A A . 10 SER CA 1 1 12 3971 1 1 10 SER CB C 0.832 -1.987 1.425 1.00 . A A . 10 SER CB 1 1 12 3972 1 1 10 SER H H 1.483 -2.157 3.886 1.00 . A A . 10 SER H 1 1 12 3973 1 1 10 SER HA H 1.725 -3.919 1.544 1.00 . A A . 10 SER HA 1 1 12 3974 1 1 10 SER HB2 H 0.902 -1.011 1.871 1.00 . A A . 10 SER HB2 1 1 12 3975 1 1 10 SER HB3 H 0.829 -1.920 0.348 1.00 . A A . 10 SER HB3 1 1 12 3976 1 1 10 SER HG H -0.592 -3.296 1.249 1.00 . A A . 10 SER HG 1 1 12 3977 1 1 10 SER N N 1.829 -2.958 3.420 1.00 . A A . 10 SER N 1 1 12 3978 1 1 10 SER O O 3.708 -2.865 0.367 1.00 . A A . 10 SER O 1 1 12 3979 1 1 10 SER OG O -0.371 -2.597 1.868 1.00 . A A . 10 SER OG 1 1 12 3980 1 1 11 CYS C C 6.372 -2.217 1.406 1.00 . A A . 11 CYS C 1 1 12 3981 1 1 11 CYS CA C 5.357 -1.175 1.922 1.00 . A A . 11 CYS CA 1 1 12 3982 1 1 11 CYS CB C 5.879 -0.512 3.191 1.00 . A A . 11 CYS CB 1 1 12 3983 1 1 11 CYS H H 3.576 -1.454 3.104 1.00 . A A . 11 CYS H 1 1 12 3984 1 1 11 CYS HA H 5.245 -0.412 1.166 1.00 . A A . 11 CYS HA 1 1 12 3985 1 1 11 CYS HB2 H 5.152 0.228 3.488 1.00 . A A . 11 CYS HB2 1 1 12 3986 1 1 11 CYS HB3 H 5.883 -1.275 3.953 1.00 . A A . 11 CYS HB3 1 1 12 3987 1 1 11 CYS N N 3.984 -1.704 2.247 1.00 . A A . 11 CYS N 1 1 12 3988 1 1 11 CYS O O 7.300 -1.868 0.703 1.00 . A A . 11 CYS O 1 1 12 3989 1 1 11 CYS SG S 7.500 0.288 3.293 1.00 . A A . 11 CYS SG 1 1 12 3990 1 1 12 ARG C C 6.803 -5.037 -0.108 1.00 . A A . 12 ARG C 1 1 12 3991 1 1 12 ARG CA C 7.084 -4.564 1.337 1.00 . A A . 12 ARG CA 1 1 12 3992 1 1 12 ARG CB C 6.903 -5.713 2.365 1.00 . A A . 12 ARG CB 1 1 12 3993 1 1 12 ARG CD C 9.300 -6.557 2.059 1.00 . A A . 12 ARG CD 1 1 12 3994 1 1 12 ARG CG C 7.806 -6.946 2.080 1.00 . A A . 12 ARG CG 1 1 12 3995 1 1 12 ARG CZ C 10.861 -5.478 3.608 1.00 . A A . 12 ARG CZ 1 1 12 3996 1 1 12 ARG H H 5.392 -3.668 2.334 1.00 . A A . 12 ARG H 1 1 12 3997 1 1 12 ARG HA H 8.098 -4.197 1.385 1.00 . A A . 12 ARG HA 1 1 12 3998 1 1 12 ARG HB2 H 7.118 -5.336 3.354 1.00 . A A . 12 ARG HB2 1 1 12 3999 1 1 12 ARG HB3 H 5.870 -6.030 2.350 1.00 . A A . 12 ARG HB3 1 1 12 4000 1 1 12 ARG HD2 H 9.905 -7.438 1.905 1.00 . A A . 12 ARG HD2 1 1 12 4001 1 1 12 ARG HD3 H 9.507 -5.848 1.271 1.00 . A A . 12 ARG HD3 1 1 12 4002 1 1 12 ARG HE H 8.987 -5.913 4.090 1.00 . A A . 12 ARG HE 1 1 12 4003 1 1 12 ARG HG2 H 7.649 -7.674 2.863 1.00 . A A . 12 ARG HG2 1 1 12 4004 1 1 12 ARG HG3 H 7.532 -7.407 1.143 1.00 . A A . 12 ARG HG3 1 1 12 4005 1 1 12 ARG HH11 H 11.573 -5.917 1.785 1.00 . A A . 12 ARG HH11 1 1 12 4006 1 1 12 ARG HH12 H 12.690 -5.153 2.865 1.00 . A A . 12 ARG HH12 1 1 12 4007 1 1 12 ARG HH21 H 10.386 -4.942 5.476 1.00 . A A . 12 ARG HH21 1 1 12 4008 1 1 12 ARG HH22 H 12.010 -4.593 4.985 1.00 . A A . 12 ARG HH22 1 1 12 4009 1 1 12 ARG N N 6.164 -3.458 1.769 1.00 . A A . 12 ARG N 1 1 12 4010 1 1 12 ARG NE N 9.661 -5.954 3.380 1.00 . A A . 12 ARG NE 1 1 12 4011 1 1 12 ARG NH1 N 11.779 -5.520 2.679 1.00 . A A . 12 ARG NH1 1 1 12 4012 1 1 12 ARG NH2 N 11.105 -4.965 4.781 1.00 . A A . 12 ARG NH2 1 1 12 4013 1 1 12 ARG O O 7.540 -5.833 -0.657 1.00 . A A . 12 ARG O 1 1 12 4014 1 1 13 SER C C 6.173 -4.107 -3.095 1.00 . A A . 13 SER C 1 1 12 4015 1 1 13 SER CA C 5.347 -4.889 -2.074 1.00 . A A . 13 SER CA 1 1 12 4016 1 1 13 SER CB C 3.849 -4.574 -2.267 1.00 . A A . 13 SER CB 1 1 12 4017 1 1 13 SER H H 5.209 -3.878 -0.184 1.00 . A A . 13 SER H 1 1 12 4018 1 1 13 SER HA H 5.517 -5.947 -2.219 1.00 . A A . 13 SER HA 1 1 12 4019 1 1 13 SER HB2 H 3.233 -5.147 -1.588 1.00 . A A . 13 SER HB2 1 1 12 4020 1 1 13 SER HB3 H 3.641 -3.521 -2.153 1.00 . A A . 13 SER HB3 1 1 12 4021 1 1 13 SER HG H 3.980 -4.332 -4.195 1.00 . A A . 13 SER HG 1 1 12 4022 1 1 13 SER N N 5.746 -4.523 -0.681 1.00 . A A . 13 SER N 1 1 12 4023 1 1 13 SER O O 6.548 -2.976 -2.855 1.00 . A A . 13 SER O 1 1 12 4024 1 1 13 SER OG O 3.562 -4.963 -3.604 1.00 . A A . 13 SER OG 1 1 12 4025 1 1 14 ARG C C 6.520 -2.850 -5.772 1.00 . A A . 14 ARG C 1 1 12 4026 1 1 14 ARG CA C 7.214 -4.139 -5.315 1.00 . A A . 14 ARG CA 1 1 12 4027 1 1 14 ARG CB C 7.297 -5.161 -6.465 1.00 . A A . 14 ARG CB 1 1 12 4028 1 1 14 ARG CD C 8.165 -5.623 -8.777 1.00 . A A . 14 ARG CD 1 1 12 4029 1 1 14 ARG CG C 8.103 -4.581 -7.646 1.00 . A A . 14 ARG CG 1 1 12 4030 1 1 14 ARG CZ C 8.361 -4.220 -10.785 1.00 . A A . 14 ARG CZ 1 1 12 4031 1 1 14 ARG H H 6.082 -5.668 -4.311 1.00 . A A . 14 ARG H 1 1 12 4032 1 1 14 ARG HA H 8.201 -3.898 -4.953 1.00 . A A . 14 ARG HA 1 1 12 4033 1 1 14 ARG HB2 H 7.777 -6.060 -6.106 1.00 . A A . 14 ARG HB2 1 1 12 4034 1 1 14 ARG HB3 H 6.299 -5.414 -6.794 1.00 . A A . 14 ARG HB3 1 1 12 4035 1 1 14 ARG HD2 H 8.684 -6.509 -8.443 1.00 . A A . 14 ARG HD2 1 1 12 4036 1 1 14 ARG HD3 H 7.174 -5.901 -9.107 1.00 . A A . 14 ARG HD3 1 1 12 4037 1 1 14 ARG HE H 9.873 -5.258 -10.033 1.00 . A A . 14 ARG HE 1 1 12 4038 1 1 14 ARG HG2 H 7.631 -3.683 -8.014 1.00 . A A . 14 ARG HG2 1 1 12 4039 1 1 14 ARG HG3 H 9.104 -4.339 -7.321 1.00 . A A . 14 ARG HG3 1 1 12 4040 1 1 14 ARG HH11 H 6.549 -4.262 -9.922 1.00 . A A . 14 ARG HH11 1 1 12 4041 1 1 14 ARG HH12 H 6.685 -3.277 -11.338 1.00 . A A . 14 ARG HH12 1 1 12 4042 1 1 14 ARG HH21 H 10.059 -4.011 -11.823 1.00 . A A . 14 ARG HH21 1 1 12 4043 1 1 14 ARG HH22 H 8.697 -3.130 -12.427 1.00 . A A . 14 ARG HH22 1 1 12 4044 1 1 14 ARG N N 6.423 -4.756 -4.206 1.00 . A A . 14 ARG N 1 1 12 4045 1 1 14 ARG NE N 8.926 -5.032 -9.923 1.00 . A A . 14 ARG NE 1 1 12 4046 1 1 14 ARG NH1 N 7.100 -3.895 -10.671 1.00 . A A . 14 ARG NH1 1 1 12 4047 1 1 14 ARG NH2 N 9.096 -3.750 -11.754 1.00 . A A . 14 ARG NH2 1 1 12 4048 1 1 14 ARG O O 7.169 -1.881 -6.117 1.00 . A A . 14 ARG O 1 1 12 4049 1 1 15 GLN C C 4.639 -0.550 -5.203 1.00 . A A . 15 GLN C 1 1 12 4050 1 1 15 GLN CA C 4.381 -1.724 -6.161 1.00 . A A . 15 GLN CA 1 1 12 4051 1 1 15 GLN CB C 2.902 -2.148 -6.119 1.00 . A A . 15 GLN CB 1 1 12 4052 1 1 15 GLN CD C 0.510 -1.410 -6.500 1.00 . A A . 15 GLN CD 1 1 12 4053 1 1 15 GLN CG C 1.986 -0.983 -6.568 1.00 . A A . 15 GLN CG 1 1 12 4054 1 1 15 GLN H H 4.767 -3.718 -5.456 1.00 . A A . 15 GLN H 1 1 12 4055 1 1 15 GLN HA H 4.663 -1.431 -7.163 1.00 . A A . 15 GLN HA 1 1 12 4056 1 1 15 GLN HB2 H 2.763 -2.995 -6.777 1.00 . A A . 15 GLN HB2 1 1 12 4057 1 1 15 GLN HB3 H 2.639 -2.452 -5.116 1.00 . A A . 15 GLN HB3 1 1 12 4058 1 1 15 GLN HE21 H 0.848 -3.245 -7.181 1.00 . A A . 15 GLN HE21 1 1 12 4059 1 1 15 GLN HE22 H -0.773 -2.889 -6.826 1.00 . A A . 15 GLN HE22 1 1 12 4060 1 1 15 GLN HG2 H 2.123 -0.127 -5.924 1.00 . A A . 15 GLN HG2 1 1 12 4061 1 1 15 GLN HG3 H 2.218 -0.698 -7.584 1.00 . A A . 15 GLN HG3 1 1 12 4062 1 1 15 GLN N N 5.212 -2.895 -5.750 1.00 . A A . 15 GLN N 1 1 12 4063 1 1 15 GLN NE2 N 0.167 -2.615 -6.866 1.00 . A A . 15 GLN NE2 1 1 12 4064 1 1 15 GLN O O 4.594 0.598 -5.603 1.00 . A A . 15 GLN O 1 1 12 4065 1 1 15 GLN OE1 O -0.348 -0.642 -6.112 1.00 . A A . 15 GLN OE1 1 1 12 4066 1 1 16 CYS C C 6.617 0.648 -2.887 1.00 . A A . 16 CYS C 1 1 12 4067 1 1 16 CYS CA C 5.173 0.144 -2.925 1.00 . A A . 16 CYS CA 1 1 12 4068 1 1 16 CYS CB C 4.832 -0.414 -1.563 1.00 . A A . 16 CYS CB 1 1 12 4069 1 1 16 CYS H H 4.924 -1.837 -3.720 1.00 . A A . 16 CYS H 1 1 12 4070 1 1 16 CYS HA H 4.520 0.979 -3.103 1.00 . A A . 16 CYS HA 1 1 12 4071 1 1 16 CYS HB2 H 5.438 -1.278 -1.359 1.00 . A A . 16 CYS HB2 1 1 12 4072 1 1 16 CYS HB3 H 5.109 0.334 -0.837 1.00 . A A . 16 CYS HB3 1 1 12 4073 1 1 16 CYS N N 4.903 -0.890 -3.966 1.00 . A A . 16 CYS N 1 1 12 4074 1 1 16 CYS O O 6.856 1.738 -2.406 1.00 . A A . 16 CYS O 1 1 12 4075 1 1 16 CYS SG S 3.116 -0.864 -1.226 1.00 . A A . 16 CYS SG 1 1 12 4076 1 1 17 LYS C C 9.226 1.678 -4.040 1.00 . A A . 17 LYS C 1 1 12 4077 1 1 17 LYS CA C 8.972 0.303 -3.369 1.00 . A A . 17 LYS CA 1 1 12 4078 1 1 17 LYS CB C 9.837 -0.783 -4.063 1.00 . A A . 17 LYS CB 1 1 12 4079 1 1 17 LYS CD C 10.668 -3.166 -3.838 1.00 . A A . 17 LYS CD 1 1 12 4080 1 1 17 LYS CE C 10.617 -4.440 -2.964 1.00 . A A . 17 LYS CE 1 1 12 4081 1 1 17 LYS CG C 9.788 -2.069 -3.209 1.00 . A A . 17 LYS CG 1 1 12 4082 1 1 17 LYS H H 7.293 -1.015 -3.747 1.00 . A A . 17 LYS H 1 1 12 4083 1 1 17 LYS HA H 9.278 0.372 -2.337 1.00 . A A . 17 LYS HA 1 1 12 4084 1 1 17 LYS HB2 H 9.453 -0.991 -5.050 1.00 . A A . 17 LYS HB2 1 1 12 4085 1 1 17 LYS HB3 H 10.857 -0.440 -4.154 1.00 . A A . 17 LYS HB3 1 1 12 4086 1 1 17 LYS HD2 H 10.324 -3.393 -4.837 1.00 . A A . 17 LYS HD2 1 1 12 4087 1 1 17 LYS HD3 H 11.688 -2.818 -3.899 1.00 . A A . 17 LYS HD3 1 1 12 4088 1 1 17 LYS HE2 H 11.244 -5.207 -3.395 1.00 . A A . 17 LYS HE2 1 1 12 4089 1 1 17 LYS HE3 H 10.972 -4.221 -1.966 1.00 . A A . 17 LYS HE3 1 1 12 4090 1 1 17 LYS HG2 H 10.141 -1.853 -2.211 1.00 . A A . 17 LYS HG2 1 1 12 4091 1 1 17 LYS HG3 H 8.771 -2.417 -3.143 1.00 . A A . 17 LYS HG3 1 1 12 4092 1 1 17 LYS HZ1 H 8.590 -4.217 -2.525 1.00 . A A . 17 LYS HZ1 1 1 12 4093 1 1 17 LYS HZ2 H 9.201 -5.767 -2.206 1.00 . A A . 17 LYS HZ2 1 1 12 4094 1 1 17 LYS HZ3 H 8.909 -5.284 -3.807 1.00 . A A . 17 LYS HZ3 1 1 12 4095 1 1 17 LYS N N 7.541 -0.140 -3.378 1.00 . A A . 17 LYS N 1 1 12 4096 1 1 17 LYS NZ N 9.224 -4.966 -2.868 1.00 . A A . 17 LYS NZ 1 1 12 4097 1 1 17 LYS O O 9.955 2.472 -3.476 1.00 . A A . 17 LYS O 1 1 12 4098 1 1 18 HYP C C 8.191 4.453 -5.040 1.00 . A A . 18 HYP C 1 1 12 4099 1 1 18 HYP CA C 8.789 3.276 -5.844 1.00 . A A . 18 HYP CA 1 1 12 4100 1 1 18 HYP CB C 8.127 3.101 -7.214 1.00 . A A . 18 HYP CB 1 1 12 4101 1 1 18 HYP CD C 7.817 1.062 -6.031 1.00 . A A . 18 HYP CD 1 1 12 4102 1 1 18 HYP CG C 7.156 1.999 -6.998 1.00 . A A . 18 HYP CG 1 1 12 4103 1 1 18 HYP HA H 9.832 3.495 -6.018 1.00 . A A . 18 HYP HA 1 1 12 4104 1 1 18 HYP HB2 H 8.872 2.852 -7.957 1.00 . A A . 18 HYP HB2 1 1 12 4105 1 1 18 HYP HB3 H 7.640 4.014 -7.527 1.00 . A A . 18 HYP HB3 1 1 12 4106 1 1 18 HYP HD1 H 6.280 0.592 -8.010 1.00 . A A . 18 HYP HD1 1 1 12 4107 1 1 18 HYP HD22 H 8.429 0.342 -6.554 1.00 . A A . 18 HYP HD22 1 1 12 4108 1 1 18 HYP HD23 H 7.056 0.565 -5.460 1.00 . A A . 18 HYP HD23 1 1 12 4109 1 1 18 HYP HG H 6.247 2.398 -6.573 1.00 . A A . 18 HYP HG 1 1 12 4110 1 1 18 HYP N N 8.651 1.951 -5.195 1.00 . A A . 18 HYP N 1 1 12 4111 1 1 18 HYP O O 8.357 5.587 -5.451 1.00 . A A . 18 HYP O 1 1 12 4112 1 1 18 HYP OD1 O 6.865 1.326 -8.213 1.00 . A A . 18 HYP OD1 1 1 12 4113 1 1 19 HIS C C 8.029 6.029 -2.384 1.00 . A A . 19 HIS C 1 1 12 4114 1 1 19 HIS CA C 6.931 5.265 -3.122 1.00 . A A . 19 HIS CA 1 1 12 4115 1 1 19 HIS CB C 5.936 4.686 -2.087 1.00 . A A . 19 HIS CB 1 1 12 4116 1 1 19 HIS CD2 C 4.646 3.315 -3.977 1.00 . A A . 19 HIS CD2 1 1 12 4117 1 1 19 HIS CE1 C 2.748 3.402 -3.155 1.00 . A A . 19 HIS CE1 1 1 12 4118 1 1 19 HIS CG C 4.740 4.026 -2.790 1.00 . A A . 19 HIS CG 1 1 12 4119 1 1 19 HIS H H 7.431 3.233 -3.656 1.00 . A A . 19 HIS H 1 1 12 4120 1 1 19 HIS HA H 6.418 5.942 -3.787 1.00 . A A . 19 HIS HA 1 1 12 4121 1 1 19 HIS HB2 H 6.425 3.953 -1.463 1.00 . A A . 19 HIS HB2 1 1 12 4122 1 1 19 HIS HB3 H 5.562 5.480 -1.456 1.00 . A A . 19 HIS HB3 1 1 12 4123 1 1 19 HIS HD1 H 3.242 4.464 -1.505 1.00 . A A . 19 HIS HD1 1 1 12 4124 1 1 19 HIS HD2 H 5.471 3.098 -4.634 1.00 . A A . 19 HIS HD2 1 1 12 4125 1 1 19 HIS HE1 H 1.686 3.274 -3.003 1.00 . A A . 19 HIS HE1 1 1 12 4126 1 1 19 HIS N N 7.532 4.164 -3.943 1.00 . A A . 19 HIS N 1 1 12 4127 1 1 19 HIS ND1 N 3.529 4.038 -2.340 1.00 . A A . 19 HIS ND1 1 1 12 4128 1 1 19 HIS NE2 N 3.402 2.937 -4.189 1.00 . A A . 19 HIS NE2 1 1 12 4129 1 1 19 HIS O O 9.061 5.471 -2.073 1.00 . A A . 19 HIS O 1 1 12 4130 1 1 20 ARG C C 8.957 7.671 0.052 1.00 . A A . 20 ARG C 1 1 12 4131 1 1 20 ARG CA C 8.783 8.129 -1.406 1.00 . A A . 20 ARG CA 1 1 12 4132 1 1 20 ARG CB C 8.343 9.621 -1.397 1.00 . A A . 20 ARG CB 1 1 12 4133 1 1 20 ARG CD C 7.116 9.649 -3.683 1.00 . A A . 20 ARG CD 1 1 12 4134 1 1 20 ARG CG C 8.234 10.266 -2.815 1.00 . A A . 20 ARG CG 1 1 12 4135 1 1 20 ARG CZ C 4.866 8.902 -2.994 1.00 . A A . 20 ARG CZ 1 1 12 4136 1 1 20 ARG H H 6.919 7.676 -2.394 1.00 . A A . 20 ARG H 1 1 12 4137 1 1 20 ARG HA H 9.733 8.036 -1.912 1.00 . A A . 20 ARG HA 1 1 12 4138 1 1 20 ARG HB2 H 7.388 9.699 -0.900 1.00 . A A . 20 ARG HB2 1 1 12 4139 1 1 20 ARG HB3 H 9.061 10.189 -0.825 1.00 . A A . 20 ARG HB3 1 1 12 4140 1 1 20 ARG HD2 H 7.034 10.204 -4.607 1.00 . A A . 20 ARG HD2 1 1 12 4141 1 1 20 ARG HD3 H 7.316 8.618 -3.928 1.00 . A A . 20 ARG HD3 1 1 12 4142 1 1 20 ARG HE H 5.690 10.587 -2.376 1.00 . A A . 20 ARG HE 1 1 12 4143 1 1 20 ARG HG2 H 8.046 11.323 -2.702 1.00 . A A . 20 ARG HG2 1 1 12 4144 1 1 20 ARG HG3 H 9.178 10.152 -3.327 1.00 . A A . 20 ARG HG3 1 1 12 4145 1 1 20 ARG HH11 H 5.818 7.670 -4.256 1.00 . A A . 20 ARG HH11 1 1 12 4146 1 1 20 ARG HH12 H 4.249 7.155 -3.742 1.00 . A A . 20 ARG HH12 1 1 12 4147 1 1 20 ARG HH21 H 3.709 9.954 -1.745 1.00 . A A . 20 ARG HH21 1 1 12 4148 1 1 20 ARG HH22 H 3.036 8.466 -2.319 1.00 . A A . 20 ARG HH22 1 1 12 4149 1 1 20 ARG N N 7.776 7.286 -2.122 1.00 . A A . 20 ARG N 1 1 12 4150 1 1 20 ARG NE N 5.824 9.794 -2.936 1.00 . A A . 20 ARG NE 1 1 12 4151 1 1 20 ARG NH1 N 4.989 7.826 -3.722 1.00 . A A . 20 ARG NH1 1 1 12 4152 1 1 20 ARG NH2 N 3.786 9.125 -2.299 1.00 . A A . 20 ARG NH2 1 1 12 4153 1 1 20 ARG O O 9.939 8.002 0.687 1.00 . A A . 20 ARG O 1 1 12 4154 1 1 21 CYS C C 8.683 5.019 2.008 1.00 . A A . 21 CYS C 1 1 12 4155 1 1 21 CYS CA C 8.030 6.409 1.935 1.00 . A A . 21 CYS CA 1 1 12 4156 1 1 21 CYS CB C 6.606 6.291 2.465 1.00 . A A . 21 CYS CB 1 1 12 4157 1 1 21 CYS H H 7.234 6.692 -0.045 1.00 . A A . 21 CYS H 1 1 12 4158 1 1 21 CYS HA H 8.602 7.090 2.548 1.00 . A A . 21 CYS HA 1 1 12 4159 1 1 21 CYS HB2 H 6.126 5.470 1.953 1.00 . A A . 21 CYS HB2 1 1 12 4160 1 1 21 CYS HB3 H 6.667 6.024 3.510 1.00 . A A . 21 CYS HB3 1 1 12 4161 1 1 21 CYS N N 7.994 6.922 0.529 1.00 . A A . 21 CYS N 1 1 12 4162 1 1 21 CYS O O 9.087 4.594 3.073 1.00 . A A . 21 CYS O 1 1 12 4163 1 1 21 CYS SG S 5.486 7.707 2.349 1.00 . A A . 21 CYS SG 1 1 12 4164 1 1 22 . C C 10.261 2.828 -0.409 1.00 . A A . 22 CY3 C 1 1 12 4165 1 1 22 . CA C 9.375 2.993 0.823 1.00 . A A . 22 CY3 CA 1 1 12 4166 1 1 22 . CB C 8.182 2.006 0.856 1.00 . A A . 22 CY3 CB 1 1 12 4167 1 1 22 . H H 8.435 4.761 0.047 1.00 . A A . 22 CY3 H 1 1 12 4168 1 1 22 . HA H 9.991 2.837 1.697 1.00 . A A . 22 CY3 HA 1 1 12 4169 1 1 22 . HB2 H 8.530 0.996 0.705 1.00 . A A . 22 CY3 HB2 1 1 12 4170 1 1 22 . HB3 H 7.499 2.248 0.054 1.00 . A A . 22 CY3 HB3 1 1 12 4171 1 1 22 . HN11 H 10.572 4.779 -0.547 1.00 . A A . 22 CY3 HN11 1 1 12 4172 1 1 22 . HN12 H 11.343 3.844 -1.727 1.00 . A A . 22 CY3 HN12 1 1 12 4173 1 1 22 . N N 8.768 4.359 0.879 1.00 . A A . 22 CY3 N 1 1 12 4174 1 1 22 . N1 N 10.769 3.904 -0.940 1.00 . A A . 22 CY3 N1 1 1 12 4175 1 1 22 . O O 10.503 1.741 -0.893 1.00 . A A . 22 CY3 O 1 1 12 4176 1 1 22 . SG S 7.263 2.090 2.414 1.00 . A A . 22 CY3 SG 1 1 13 4177 1 1 1 PCA C C -4.242 5.904 1.851 1.00 . A A . 1 PCA C 1 1 13 4178 1 1 1 PCA CA C -5.309 5.959 0.743 1.00 . A A . 1 PCA CA 1 1 13 4179 1 1 1 PCA CB C -5.448 7.337 0.082 1.00 . A A . 1 PCA CB 1 1 13 4180 1 1 1 PCA CD C -7.375 6.938 1.429 1.00 . A A . 1 PCA CD 1 1 13 4181 1 1 1 PCA CG C -6.529 8.062 0.875 1.00 . A A . 1 PCA CG 1 1 13 4182 1 1 1 PCA HA H -5.083 5.212 -0.001 1.00 . A A . 1 PCA HA 1 1 13 4183 1 1 1 PCA HB2 H -5.735 7.212 -0.953 1.00 . A A . 1 PCA HB2 1 1 13 4184 1 1 1 PCA HB3 H -4.510 7.875 0.094 1.00 . A A . 1 PCA HB3 1 1 13 4185 1 1 1 PCA HG2 H -7.111 8.699 0.225 1.00 . A A . 1 PCA HG2 1 1 13 4186 1 1 1 PCA HG3 H -6.087 8.638 1.675 1.00 . A A . 1 PCA HG3 1 1 13 4187 1 1 1 PCA N N -6.647 5.676 1.303 1.00 . A A . 1 PCA N 1 1 13 4188 1 1 1 PCA O O -3.363 6.742 1.915 1.00 . A A . 1 PCA O 1 1 13 4189 1 1 1 PCA OE O -8.486 7.074 1.902 1.00 . A A . 1 PCA OE 1 1 13 4190 1 1 2 ARG C C -2.679 3.366 3.635 1.00 . A A . 2 ARG C 1 1 13 4191 1 1 2 ARG CA C -3.437 4.686 3.821 1.00 . A A . 2 ARG CA 1 1 13 4192 1 1 2 ARG CB C -4.280 4.681 5.115 1.00 . A A . 2 ARG CB 1 1 13 4193 1 1 2 ARG CD C -5.918 6.007 6.492 1.00 . A A . 2 ARG CD 1 1 13 4194 1 1 2 ARG CG C -5.030 6.026 5.237 1.00 . A A . 2 ARG CG 1 1 13 4195 1 1 2 ARG CZ C -7.678 7.567 5.781 1.00 . A A . 2 ARG CZ 1 1 13 4196 1 1 2 ARG H H -5.119 4.272 2.542 1.00 . A A . 2 ARG H 1 1 13 4197 1 1 2 ARG HA H -2.709 5.483 3.842 1.00 . A A . 2 ARG HA 1 1 13 4198 1 1 2 ARG HB2 H -4.991 3.867 5.082 1.00 . A A . 2 ARG HB2 1 1 13 4199 1 1 2 ARG HB3 H -3.636 4.543 5.971 1.00 . A A . 2 ARG HB3 1 1 13 4200 1 1 2 ARG HD2 H -6.626 5.192 6.455 1.00 . A A . 2 ARG HD2 1 1 13 4201 1 1 2 ARG HD3 H -5.312 5.906 7.381 1.00 . A A . 2 ARG HD3 1 1 13 4202 1 1 2 ARG HE H -6.382 7.977 7.224 1.00 . A A . 2 ARG HE 1 1 13 4203 1 1 2 ARG HG2 H -4.318 6.835 5.312 1.00 . A A . 2 ARG HG2 1 1 13 4204 1 1 2 ARG HG3 H -5.644 6.190 4.364 1.00 . A A . 2 ARG HG3 1 1 13 4205 1 1 2 ARG HH11 H -7.614 5.815 4.806 1.00 . A A . 2 ARG HH11 1 1 13 4206 1 1 2 ARG HH12 H -8.855 6.910 4.300 1.00 . A A . 2 ARG HH12 1 1 13 4207 1 1 2 ARG HH21 H -7.948 9.374 6.597 1.00 . A A . 2 ARG HH21 1 1 13 4208 1 1 2 ARG HH22 H -9.049 8.952 5.328 1.00 . A A . 2 ARG HH22 1 1 13 4209 1 1 2 ARG N N -4.379 4.900 2.678 1.00 . A A . 2 ARG N 1 1 13 4210 1 1 2 ARG NE N -6.661 7.304 6.569 1.00 . A A . 2 ARG NE 1 1 13 4211 1 1 2 ARG NH1 N -8.079 6.694 4.893 1.00 . A A . 2 ARG NH1 1 1 13 4212 1 1 2 ARG NH2 N -8.270 8.721 5.912 1.00 . A A . 2 ARG NH2 1 1 13 4213 1 1 2 ARG O O -2.449 2.623 4.571 1.00 . A A . 2 ARG O 1 1 13 4214 1 1 3 LEU C C -0.067 2.121 2.360 1.00 . A A . 3 LEU C 1 1 13 4215 1 1 3 LEU CA C -1.563 1.886 2.052 1.00 . A A . 3 LEU CA 1 1 13 4216 1 1 3 LEU CB C -1.777 1.556 0.532 1.00 . A A . 3 LEU CB 1 1 13 4217 1 1 3 LEU CD1 C -4.238 2.345 0.355 1.00 . A A . 3 LEU CD1 1 1 13 4218 1 1 3 LEU CD2 C -3.253 0.775 -1.349 1.00 . A A . 3 LEU CD2 1 1 13 4219 1 1 3 LEU CG C -3.240 1.187 0.140 1.00 . A A . 3 LEU CG 1 1 13 4220 1 1 3 LEU H H -2.535 3.783 1.709 1.00 . A A . 3 LEU H 1 1 13 4221 1 1 3 LEU HA H -1.938 1.078 2.655 1.00 . A A . 3 LEU HA 1 1 13 4222 1 1 3 LEU HB2 H -1.462 2.406 -0.057 1.00 . A A . 3 LEU HB2 1 1 13 4223 1 1 3 LEU HB3 H -1.146 0.719 0.269 1.00 . A A . 3 LEU HB3 1 1 13 4224 1 1 3 LEU HD11 H -4.289 2.630 1.391 1.00 . A A . 3 LEU HD11 1 1 13 4225 1 1 3 LEU HD12 H -5.225 2.032 0.048 1.00 . A A . 3 LEU HD12 1 1 13 4226 1 1 3 LEU HD13 H -3.946 3.201 -0.235 1.00 . A A . 3 LEU HD13 1 1 13 4227 1 1 3 LEU HD21 H -2.608 -0.077 -1.505 1.00 . A A . 3 LEU HD21 1 1 13 4228 1 1 3 LEU HD22 H -2.905 1.588 -1.970 1.00 . A A . 3 LEU HD22 1 1 13 4229 1 1 3 LEU HD23 H -4.255 0.510 -1.653 1.00 . A A . 3 LEU HD23 1 1 13 4230 1 1 3 LEU HG H -3.554 0.342 0.736 1.00 . A A . 3 LEU HG 1 1 13 4231 1 1 3 LEU N N -2.311 3.129 2.402 1.00 . A A . 3 LEU N 1 1 13 4232 1 1 3 LEU O O 0.278 2.397 3.492 1.00 . A A . 3 LEU O 1 1 13 4233 1 1 4 CYS C C 2.608 3.340 2.371 1.00 . A A . 4 CYS C 1 1 13 4234 1 1 4 CYS CA C 2.240 2.183 1.420 1.00 . A A . 4 CYS CA 1 1 13 4235 1 1 4 CYS CB C 2.774 2.522 0.020 1.00 . A A . 4 CYS CB 1 1 13 4236 1 1 4 CYS H H 0.391 1.742 0.482 1.00 . A A . 4 CYS H 1 1 13 4237 1 1 4 CYS HA H 2.692 1.278 1.791 1.00 . A A . 4 CYS HA 1 1 13 4238 1 1 4 CYS HB2 H 2.697 3.568 -0.188 1.00 . A A . 4 CYS HB2 1 1 13 4239 1 1 4 CYS HB3 H 3.833 2.324 0.060 1.00 . A A . 4 CYS HB3 1 1 13 4240 1 1 4 CYS N N 0.758 1.993 1.348 1.00 . A A . 4 CYS N 1 1 13 4241 1 1 4 CYS O O 3.478 3.219 3.212 1.00 . A A . 4 CYS O 1 1 13 4242 1 1 4 CYS SG S 2.165 1.675 -1.458 1.00 . A A . 4 CYS SG 1 1 13 4243 1 1 5 CYS C C 1.222 5.611 4.260 1.00 . A A . 5 CYS C 1 1 13 4244 1 1 5 CYS CA C 2.097 5.666 2.993 1.00 . A A . 5 CYS CA 1 1 13 4245 1 1 5 CYS CB C 1.719 6.862 2.103 1.00 . A A . 5 CYS CB 1 1 13 4246 1 1 5 CYS H H 1.213 4.426 1.480 1.00 . A A . 5 CYS H 1 1 13 4247 1 1 5 CYS HA H 3.130 5.739 3.297 1.00 . A A . 5 CYS HA 1 1 13 4248 1 1 5 CYS HB2 H 0.657 6.868 1.960 1.00 . A A . 5 CYS HB2 1 1 13 4249 1 1 5 CYS HB3 H 1.980 7.770 2.628 1.00 . A A . 5 CYS HB3 1 1 13 4250 1 1 5 CYS N N 1.899 4.427 2.180 1.00 . A A . 5 CYS N 1 1 13 4251 1 1 5 CYS O O 0.546 6.562 4.606 1.00 . A A . 5 CYS O 1 1 13 4252 1 1 5 CYS SG S 2.473 6.950 0.461 1.00 . A A . 5 CYS SG 1 1 13 4253 1 1 6 GLY C C 1.110 3.182 7.020 1.00 . A A . 6 GLY C 1 1 13 4254 1 1 6 GLY CA C 0.475 4.277 6.162 1.00 . A A . 6 GLY CA 1 1 13 4255 1 1 6 GLY H H 1.834 3.751 4.584 1.00 . A A . 6 GLY H 1 1 13 4256 1 1 6 GLY HA2 H 0.447 5.197 6.728 1.00 . A A . 6 GLY HA2 1 1 13 4257 1 1 6 GLY HA3 H -0.531 3.984 5.899 1.00 . A A . 6 GLY HA3 1 1 13 4258 1 1 6 GLY N N 1.269 4.480 4.915 1.00 . A A . 6 GLY N 1 1 13 4259 1 1 6 GLY O O 1.185 3.314 8.226 1.00 . A A . 6 GLY O 1 1 13 4260 1 1 7 PHE C C 3.066 0.073 6.207 1.00 . A A . 7 PHE C 1 1 13 4261 1 1 7 PHE CA C 2.191 0.991 7.098 1.00 . A A . 7 PHE CA 1 1 13 4262 1 1 7 PHE CB C 1.048 0.174 7.801 1.00 . A A . 7 PHE CB 1 1 13 4263 1 1 7 PHE CD1 C -0.133 -0.099 5.511 1.00 . A A . 7 PHE CD1 1 1 13 4264 1 1 7 PHE CD2 C -1.204 -0.898 7.476 1.00 . A A . 7 PHE CD2 1 1 13 4265 1 1 7 PHE CE1 C -1.200 -0.521 4.764 1.00 . A A . 7 PHE CE1 1 1 13 4266 1 1 7 PHE CE2 C -2.277 -1.320 6.719 1.00 . A A . 7 PHE CE2 1 1 13 4267 1 1 7 PHE CG C -0.114 -0.280 6.884 1.00 . A A . 7 PHE CG 1 1 13 4268 1 1 7 PHE CZ C -2.271 -1.129 5.355 1.00 . A A . 7 PHE CZ 1 1 13 4269 1 1 7 PHE H H 1.458 2.093 5.395 1.00 . A A . 7 PHE H 1 1 13 4270 1 1 7 PHE HA H 2.825 1.416 7.861 1.00 . A A . 7 PHE HA 1 1 13 4271 1 1 7 PHE HB2 H 1.468 -0.710 8.256 1.00 . A A . 7 PHE HB2 1 1 13 4272 1 1 7 PHE HB3 H 0.628 0.779 8.591 1.00 . A A . 7 PHE HB3 1 1 13 4273 1 1 7 PHE HD1 H 0.681 0.378 4.998 1.00 . A A . 7 PHE HD1 1 1 13 4274 1 1 7 PHE HD2 H -1.217 -1.053 8.545 1.00 . A A . 7 PHE HD2 1 1 13 4275 1 1 7 PHE HE1 H -1.196 -0.377 3.701 1.00 . A A . 7 PHE HE1 1 1 13 4276 1 1 7 PHE HE2 H -3.120 -1.800 7.195 1.00 . A A . 7 PHE HE2 1 1 13 4277 1 1 7 PHE HZ H -3.096 -1.451 4.741 1.00 . A A . 7 PHE HZ 1 1 13 4278 1 1 7 PHE N N 1.549 2.132 6.369 1.00 . A A . 7 PHE N 1 1 13 4279 1 1 7 PHE O O 2.837 -0.064 5.019 1.00 . A A . 7 PHE O 1 1 13 4280 1 1 8 HYP C C 4.441 -2.567 5.373 1.00 . A A . 8 HYP C 1 1 13 4281 1 1 8 HYP CA C 5.055 -1.353 6.086 1.00 . A A . 8 HYP CA 1 1 13 4282 1 1 8 HYP CB C 6.087 -1.748 7.140 1.00 . A A . 8 HYP CB 1 1 13 4283 1 1 8 HYP CD C 4.369 -0.538 8.264 1.00 . A A . 8 HYP CD 1 1 13 4284 1 1 8 HYP CG C 5.331 -1.683 8.421 1.00 . A A . 8 HYP CG 1 1 13 4285 1 1 8 HYP HA H 5.553 -0.745 5.346 1.00 . A A . 8 HYP HA 1 1 13 4286 1 1 8 HYP HB2 H 6.919 -1.058 7.118 1.00 . A A . 8 HYP HB2 1 1 13 4287 1 1 8 HYP HB3 H 6.475 -2.738 6.948 1.00 . A A . 8 HYP HB3 1 1 13 4288 1 1 8 HYP HD1 H 6.686 -0.635 9.345 1.00 . A A . 8 HYP HD1 1 1 13 4289 1 1 8 HYP HD22 H 4.830 0.394 8.559 1.00 . A A . 8 HYP HD22 1 1 13 4290 1 1 8 HYP HD23 H 3.487 -0.724 8.857 1.00 . A A . 8 HYP HD23 1 1 13 4291 1 1 8 HYP HG H 4.790 -2.606 8.574 1.00 . A A . 8 HYP HG 1 1 13 4292 1 1 8 HYP N N 4.061 -0.539 6.816 1.00 . A A . 8 HYP N 1 1 13 4293 1 1 8 HYP O O 5.110 -3.184 4.564 1.00 . A A . 8 HYP O 1 1 13 4294 1 1 8 HYP OD1 O 6.215 -1.456 9.510 1.00 . A A . 8 HYP OD1 1 1 13 4295 1 1 9 LYS C C 2.449 -3.779 3.548 1.00 . A A . 9 LYS C 1 1 13 4296 1 1 9 LYS CA C 2.513 -4.021 5.058 1.00 . A A . 9 LYS CA 1 1 13 4297 1 1 9 LYS CB C 1.090 -4.157 5.632 1.00 . A A . 9 LYS CB 1 1 13 4298 1 1 9 LYS CD C -1.019 -5.628 5.558 1.00 . A A . 9 LYS CD 1 1 13 4299 1 1 9 LYS CE C -1.914 -4.439 5.179 1.00 . A A . 9 LYS CE 1 1 13 4300 1 1 9 LYS CG C 0.413 -5.419 5.013 1.00 . A A . 9 LYS CG 1 1 13 4301 1 1 9 LYS H H 2.725 -2.313 6.353 1.00 . A A . 9 LYS H 1 1 13 4302 1 1 9 LYS HA H 3.087 -4.917 5.252 1.00 . A A . 9 LYS HA 1 1 13 4303 1 1 9 LYS HB2 H 1.138 -4.257 6.706 1.00 . A A . 9 LYS HB2 1 1 13 4304 1 1 9 LYS HB3 H 0.530 -3.265 5.392 1.00 . A A . 9 LYS HB3 1 1 13 4305 1 1 9 LYS HD2 H -1.431 -6.535 5.140 1.00 . A A . 9 LYS HD2 1 1 13 4306 1 1 9 LYS HD3 H -0.987 -5.731 6.633 1.00 . A A . 9 LYS HD3 1 1 13 4307 1 1 9 LYS HE2 H -1.526 -3.538 5.620 1.00 . A A . 9 LYS HE2 1 1 13 4308 1 1 9 LYS HE3 H -1.957 -4.319 4.106 1.00 . A A . 9 LYS HE3 1 1 13 4309 1 1 9 LYS HG2 H 0.362 -5.320 3.938 1.00 . A A . 9 LYS HG2 1 1 13 4310 1 1 9 LYS HG3 H 1.005 -6.292 5.242 1.00 . A A . 9 LYS HG3 1 1 13 4311 1 1 9 LYS HZ1 H -3.404 -5.633 6.011 1.00 . A A . 9 LYS HZ1 1 1 13 4312 1 1 9 LYS HZ2 H -3.980 -4.452 4.935 1.00 . A A . 9 LYS HZ2 1 1 13 4313 1 1 9 LYS HZ3 H -3.466 -4.005 6.492 1.00 . A A . 9 LYS HZ3 1 1 13 4314 1 1 9 LYS N N 3.203 -2.859 5.694 1.00 . A A . 9 LYS N 1 1 13 4315 1 1 9 LYS NZ N -3.296 -4.649 5.693 1.00 . A A . 9 LYS NZ 1 1 13 4316 1 1 9 LYS O O 2.706 -4.684 2.777 1.00 . A A . 9 LYS O 1 1 13 4317 1 1 10 SER C C 3.467 -2.102 1.183 1.00 . A A . 10 SER C 1 1 13 4318 1 1 10 SER CA C 2.035 -2.268 1.710 1.00 . A A . 10 SER CA 1 1 13 4319 1 1 10 SER CB C 1.196 -1.004 1.559 1.00 . A A . 10 SER CB 1 1 13 4320 1 1 10 SER H H 1.909 -1.846 3.800 1.00 . A A . 10 SER H 1 1 13 4321 1 1 10 SER HA H 1.563 -3.094 1.195 1.00 . A A . 10 SER HA 1 1 13 4322 1 1 10 SER HB2 H 1.547 -0.237 2.228 1.00 . A A . 10 SER HB2 1 1 13 4323 1 1 10 SER HB3 H 1.130 -0.644 0.546 1.00 . A A . 10 SER HB3 1 1 13 4324 1 1 10 SER HG H -0.703 -0.698 1.819 1.00 . A A . 10 SER HG 1 1 13 4325 1 1 10 SER N N 2.112 -2.569 3.162 1.00 . A A . 10 SER N 1 1 13 4326 1 1 10 SER O O 3.734 -2.484 0.061 1.00 . A A . 10 SER O 1 1 13 4327 1 1 10 SER OG O -0.089 -1.414 1.997 1.00 . A A . 10 SER OG 1 1 13 4328 1 1 11 CYS C C 6.471 -2.713 1.304 1.00 . A A . 11 CYS C 1 1 13 4329 1 1 11 CYS CA C 5.770 -1.369 1.539 1.00 . A A . 11 CYS CA 1 1 13 4330 1 1 11 CYS CB C 6.587 -0.594 2.584 1.00 . A A . 11 CYS CB 1 1 13 4331 1 1 11 CYS H H 4.077 -1.260 2.888 1.00 . A A . 11 CYS H 1 1 13 4332 1 1 11 CYS HA H 5.778 -0.809 0.620 1.00 . A A . 11 CYS HA 1 1 13 4333 1 1 11 CYS HB2 H 6.521 -1.123 3.521 1.00 . A A . 11 CYS HB2 1 1 13 4334 1 1 11 CYS HB3 H 7.623 -0.614 2.280 1.00 . A A . 11 CYS HB3 1 1 13 4335 1 1 11 CYS N N 4.348 -1.550 1.992 1.00 . A A . 11 CYS N 1 1 13 4336 1 1 11 CYS O O 7.563 -2.756 0.770 1.00 . A A . 11 CYS O 1 1 13 4337 1 1 11 CYS SG S 6.185 1.139 2.904 1.00 . A A . 11 CYS SG 1 1 13 4338 1 1 12 ARG C C 6.170 -5.584 0.074 1.00 . A A . 12 ARG C 1 1 13 4339 1 1 12 ARG CA C 6.383 -5.141 1.538 1.00 . A A . 12 ARG CA 1 1 13 4340 1 1 12 ARG CB C 5.644 -6.072 2.530 1.00 . A A . 12 ARG CB 1 1 13 4341 1 1 12 ARG CD C 7.688 -7.519 3.031 1.00 . A A . 12 ARG CD 1 1 13 4342 1 1 12 ARG CG C 6.218 -7.514 2.559 1.00 . A A . 12 ARG CG 1 1 13 4343 1 1 12 ARG CZ C 8.855 -6.884 5.095 1.00 . A A . 12 ARG CZ 1 1 13 4344 1 1 12 ARG H H 4.936 -3.666 2.128 1.00 . A A . 12 ARG H 1 1 13 4345 1 1 12 ARG HA H 7.442 -5.111 1.752 1.00 . A A . 12 ARG HA 1 1 13 4346 1 1 12 ARG HB2 H 5.683 -5.644 3.521 1.00 . A A . 12 ARG HB2 1 1 13 4347 1 1 12 ARG HB3 H 4.606 -6.132 2.237 1.00 . A A . 12 ARG HB3 1 1 13 4348 1 1 12 ARG HD2 H 8.052 -8.535 3.077 1.00 . A A . 12 ARG HD2 1 1 13 4349 1 1 12 ARG HD3 H 8.320 -6.949 2.366 1.00 . A A . 12 ARG HD3 1 1 13 4350 1 1 12 ARG HE H 6.926 -6.550 4.798 1.00 . A A . 12 ARG HE 1 1 13 4351 1 1 12 ARG HG2 H 5.630 -8.110 3.243 1.00 . A A . 12 ARG HG2 1 1 13 4352 1 1 12 ARG HG3 H 6.148 -7.968 1.581 1.00 . A A . 12 ARG HG3 1 1 13 4353 1 1 12 ARG HH11 H 9.968 -7.778 3.687 1.00 . A A . 12 ARG HH11 1 1 13 4354 1 1 12 ARG HH12 H 10.805 -7.336 5.137 1.00 . A A . 12 ARG HH12 1 1 13 4355 1 1 12 ARG HH21 H 7.961 -5.980 6.640 1.00 . A A . 12 ARG HH21 1 1 13 4356 1 1 12 ARG HH22 H 9.652 -6.302 6.836 1.00 . A A . 12 ARG HH22 1 1 13 4357 1 1 12 ARG N N 5.814 -3.771 1.707 1.00 . A A . 12 ARG N 1 1 13 4358 1 1 12 ARG NE N 7.743 -6.922 4.404 1.00 . A A . 12 ARG NE 1 1 13 4359 1 1 12 ARG NH1 N 9.962 -7.371 4.600 1.00 . A A . 12 ARG NH1 1 1 13 4360 1 1 12 ARG NH2 N 8.820 -6.346 6.282 1.00 . A A . 12 ARG NH2 1 1 13 4361 1 1 12 ARG O O 6.696 -6.596 -0.349 1.00 . A A . 12 ARG O 1 1 13 4362 1 1 13 SER C C 5.990 -4.244 -2.998 1.00 . A A . 13 SER C 1 1 13 4363 1 1 13 SER CA C 5.101 -5.087 -2.078 1.00 . A A . 13 SER CA 1 1 13 4364 1 1 13 SER CB C 3.637 -4.756 -2.311 1.00 . A A . 13 SER CB 1 1 13 4365 1 1 13 SER H H 5.005 -3.994 -0.281 1.00 . A A . 13 SER H 1 1 13 4366 1 1 13 SER HA H 5.274 -6.134 -2.286 1.00 . A A . 13 SER HA 1 1 13 4367 1 1 13 SER HB2 H 3.415 -3.724 -2.082 1.00 . A A . 13 SER HB2 1 1 13 4368 1 1 13 SER HB3 H 3.353 -4.976 -3.320 1.00 . A A . 13 SER HB3 1 1 13 4369 1 1 13 SER HG H 3.169 -5.351 -0.521 1.00 . A A . 13 SER HG 1 1 13 4370 1 1 13 SER N N 5.406 -4.803 -0.654 1.00 . A A . 13 SER N 1 1 13 4371 1 1 13 SER O O 6.336 -3.123 -2.672 1.00 . A A . 13 SER O 1 1 13 4372 1 1 13 SER OG O 2.933 -5.605 -1.416 1.00 . A A . 13 SER OG 1 1 13 4373 1 1 14 ARG C C 6.449 -2.875 -5.640 1.00 . A A . 14 ARG C 1 1 13 4374 1 1 14 ARG CA C 7.193 -4.124 -5.127 1.00 . A A . 14 ARG CA 1 1 13 4375 1 1 14 ARG CB C 7.483 -5.110 -6.278 1.00 . A A . 14 ARG CB 1 1 13 4376 1 1 14 ARG CD C 8.691 -5.472 -8.469 1.00 . A A . 14 ARG CD 1 1 13 4377 1 1 14 ARG CG C 8.394 -4.457 -7.345 1.00 . A A . 14 ARG CG 1 1 13 4378 1 1 14 ARG CZ C 6.756 -5.136 -9.953 1.00 . A A . 14 ARG CZ 1 1 13 4379 1 1 14 ARG H H 6.011 -5.730 -4.313 1.00 . A A . 14 ARG H 1 1 13 4380 1 1 14 ARG HA H 8.112 -3.819 -4.651 1.00 . A A . 14 ARG HA 1 1 13 4381 1 1 14 ARG HB2 H 7.967 -5.989 -5.879 1.00 . A A . 14 ARG HB2 1 1 13 4382 1 1 14 ARG HB3 H 6.547 -5.411 -6.729 1.00 . A A . 14 ARG HB3 1 1 13 4383 1 1 14 ARG HD2 H 9.330 -5.031 -9.221 1.00 . A A . 14 ARG HD2 1 1 13 4384 1 1 14 ARG HD3 H 9.181 -6.345 -8.065 1.00 . A A . 14 ARG HD3 1 1 13 4385 1 1 14 ARG HE H 7.028 -6.776 -8.876 1.00 . A A . 14 ARG HE 1 1 13 4386 1 1 14 ARG HG2 H 7.912 -3.589 -7.769 1.00 . A A . 14 ARG HG2 1 1 13 4387 1 1 14 ARG HG3 H 9.324 -4.145 -6.890 1.00 . A A . 14 ARG HG3 1 1 13 4388 1 1 14 ARG HH11 H 8.077 -3.628 -9.884 1.00 . A A . 14 ARG HH11 1 1 13 4389 1 1 14 ARG HH12 H 6.719 -3.389 -10.930 1.00 . A A . 14 ARG HH12 1 1 13 4390 1 1 14 ARG HH21 H 5.304 -6.492 -10.190 1.00 . A A . 14 ARG HH21 1 1 13 4391 1 1 14 ARG HH22 H 5.124 -5.033 -11.106 1.00 . A A . 14 ARG HH22 1 1 13 4392 1 1 14 ARG N N 6.329 -4.823 -4.124 1.00 . A A . 14 ARG N 1 1 13 4393 1 1 14 ARG NE N 7.401 -5.899 -9.104 1.00 . A A . 14 ARG NE 1 1 13 4394 1 1 14 ARG NH1 N 7.220 -3.959 -10.280 1.00 . A A . 14 ARG NH1 1 1 13 4395 1 1 14 ARG NH2 N 5.641 -5.589 -10.456 1.00 . A A . 14 ARG NH2 1 1 13 4396 1 1 14 ARG O O 7.061 -1.920 -6.074 1.00 . A A . 14 ARG O 1 1 13 4397 1 1 15 GLN C C 4.594 -0.557 -5.185 1.00 . A A . 15 GLN C 1 1 13 4398 1 1 15 GLN CA C 4.272 -1.809 -6.016 1.00 . A A . 15 GLN CA 1 1 13 4399 1 1 15 GLN CB C 2.803 -2.232 -5.823 1.00 . A A . 15 GLN CB 1 1 13 4400 1 1 15 GLN CD C 0.402 -1.574 -6.065 1.00 . A A . 15 GLN CD 1 1 13 4401 1 1 15 GLN CG C 1.846 -1.111 -6.286 1.00 . A A . 15 GLN CG 1 1 13 4402 1 1 15 GLN H H 4.723 -3.745 -5.202 1.00 . A A . 15 GLN H 1 1 13 4403 1 1 15 GLN HA H 4.474 -1.608 -7.058 1.00 . A A . 15 GLN HA 1 1 13 4404 1 1 15 GLN HB2 H 2.613 -3.128 -6.397 1.00 . A A . 15 GLN HB2 1 1 13 4405 1 1 15 GLN HB3 H 2.627 -2.454 -4.780 1.00 . A A . 15 GLN HB3 1 1 13 4406 1 1 15 GLN HE21 H 0.526 -1.407 -4.092 1.00 . A A . 15 GLN HE21 1 1 13 4407 1 1 15 GLN HE22 H -0.974 -1.939 -4.681 1.00 . A A . 15 GLN HE22 1 1 13 4408 1 1 15 GLN HG2 H 2.006 -0.207 -5.716 1.00 . A A . 15 GLN HG2 1 1 13 4409 1 1 15 GLN HG3 H 1.991 -0.899 -7.335 1.00 . A A . 15 GLN HG3 1 1 13 4410 1 1 15 GLN N N 5.142 -2.938 -5.564 1.00 . A A . 15 GLN N 1 1 13 4411 1 1 15 GLN NE2 N -0.054 -1.647 -4.845 1.00 . A A . 15 GLN NE2 1 1 13 4412 1 1 15 GLN O O 4.718 0.526 -5.724 1.00 . A A . 15 GLN O 1 1 13 4413 1 1 15 GLN OE1 O -0.320 -1.873 -6.995 1.00 . A A . 15 GLN OE1 1 1 13 4414 1 1 16 CYS C C 6.520 0.696 -2.854 1.00 . A A . 16 CYS C 1 1 13 4415 1 1 16 CYS CA C 5.027 0.361 -2.961 1.00 . A A . 16 CYS CA 1 1 13 4416 1 1 16 CYS CB C 4.550 0.027 -1.573 1.00 . A A . 16 CYS CB 1 1 13 4417 1 1 16 CYS H H 4.591 -1.662 -3.537 1.00 . A A . 16 CYS H 1 1 13 4418 1 1 16 CYS HA H 4.492 1.235 -3.285 1.00 . A A . 16 CYS HA 1 1 13 4419 1 1 16 CYS HB2 H 5.050 -0.860 -1.248 1.00 . A A . 16 CYS HB2 1 1 13 4420 1 1 16 CYS HB3 H 4.874 0.817 -0.915 1.00 . A A . 16 CYS HB3 1 1 13 4421 1 1 16 CYS N N 4.714 -0.761 -3.897 1.00 . A A . 16 CYS N 1 1 13 4422 1 1 16 CYS O O 6.866 1.785 -2.443 1.00 . A A . 16 CYS O 1 1 13 4423 1 1 16 CYS SG S 2.794 -0.224 -1.250 1.00 . A A . 16 CYS SG 1 1 13 4424 1 1 17 LYS C C 9.332 1.320 -3.727 1.00 . A A . 17 LYS C 1 1 13 4425 1 1 17 LYS CA C 8.834 -0.038 -3.158 1.00 . A A . 17 LYS CA 1 1 13 4426 1 1 17 LYS CB C 9.497 -1.231 -3.905 1.00 . A A . 17 LYS CB 1 1 13 4427 1 1 17 LYS CD C 11.615 -1.162 -2.428 1.00 . A A . 17 LYS CD 1 1 13 4428 1 1 17 LYS CE C 11.196 -2.442 -1.668 1.00 . A A . 17 LYS CE 1 1 13 4429 1 1 17 LYS CG C 11.048 -1.151 -3.878 1.00 . A A . 17 LYS CG 1 1 13 4430 1 1 17 LYS H H 6.999 -1.100 -3.548 1.00 . A A . 17 LYS H 1 1 13 4431 1 1 17 LYS HA H 9.113 -0.084 -2.115 1.00 . A A . 17 LYS HA 1 1 13 4432 1 1 17 LYS HB2 H 9.173 -2.155 -3.449 1.00 . A A . 17 LYS HB2 1 1 13 4433 1 1 17 LYS HB3 H 9.177 -1.255 -4.933 1.00 . A A . 17 LYS HB3 1 1 13 4434 1 1 17 LYS HD2 H 12.693 -1.120 -2.478 1.00 . A A . 17 LYS HD2 1 1 13 4435 1 1 17 LYS HD3 H 11.273 -0.290 -1.889 1.00 . A A . 17 LYS HD3 1 1 13 4436 1 1 17 LYS HE2 H 11.638 -2.438 -0.683 1.00 . A A . 17 LYS HE2 1 1 13 4437 1 1 17 LYS HE3 H 10.123 -2.499 -1.561 1.00 . A A . 17 LYS HE3 1 1 13 4438 1 1 17 LYS HG2 H 11.451 -1.993 -4.422 1.00 . A A . 17 LYS HG2 1 1 13 4439 1 1 17 LYS HG3 H 11.375 -0.251 -4.379 1.00 . A A . 17 LYS HG3 1 1 13 4440 1 1 17 LYS HZ1 H 11.574 -4.487 -1.777 1.00 . A A . 17 LYS HZ1 1 1 13 4441 1 1 17 LYS HZ2 H 12.674 -3.530 -2.650 1.00 . A A . 17 LYS HZ2 1 1 13 4442 1 1 17 LYS HZ3 H 11.107 -3.787 -3.252 1.00 . A A . 17 LYS HZ3 1 1 13 4443 1 1 17 LYS N N 7.352 -0.246 -3.223 1.00 . A A . 17 LYS N 1 1 13 4444 1 1 17 LYS NZ N 11.675 -3.654 -2.391 1.00 . A A . 17 LYS NZ 1 1 13 4445 1 1 17 LYS O O 10.060 2.006 -3.034 1.00 . A A . 17 LYS O 1 1 13 4446 1 1 18 HYP C C 8.917 4.228 -4.979 1.00 . A A . 18 HYP C 1 1 13 4447 1 1 18 HYP CA C 9.459 2.916 -5.585 1.00 . A A . 18 HYP CA 1 1 13 4448 1 1 18 HYP CB C 9.077 2.737 -7.047 1.00 . A A . 18 HYP CB 1 1 13 4449 1 1 18 HYP CD C 8.004 1.000 -5.838 1.00 . A A . 18 HYP CD 1 1 13 4450 1 1 18 HYP CG C 7.799 1.980 -6.958 1.00 . A A . 18 HYP CG 1 1 13 4451 1 1 18 HYP HA H 10.538 2.948 -5.531 1.00 . A A . 18 HYP HA 1 1 13 4452 1 1 18 HYP HB2 H 9.846 2.185 -7.569 1.00 . A A . 18 HYP HB2 1 1 13 4453 1 1 18 HYP HB3 H 8.958 3.692 -7.541 1.00 . A A . 18 HYP HB3 1 1 13 4454 1 1 18 HYP HD1 H 7.557 1.943 -8.888 1.00 . A A . 18 HYP HD1 1 1 13 4455 1 1 18 HYP HD22 H 8.433 0.092 -6.229 1.00 . A A . 18 HYP HD22 1 1 13 4456 1 1 18 HYP HD23 H 7.065 0.802 -5.353 1.00 . A A . 18 HYP HD23 1 1 13 4457 1 1 18 HYP HG H 6.987 2.655 -6.726 1.00 . A A . 18 HYP HG 1 1 13 4458 1 1 18 HYP N N 8.952 1.687 -4.933 1.00 . A A . 18 HYP N 1 1 13 4459 1 1 18 HYP O O 9.322 5.288 -5.415 1.00 . A A . 18 HYP O 1 1 13 4460 1 1 18 HYP OD1 O 7.532 1.299 -8.176 1.00 . A A . 18 HYP OD1 1 1 13 4461 1 1 19 HIS C C 8.390 5.952 -2.325 1.00 . A A . 19 HIS C 1 1 13 4462 1 1 19 HIS CA C 7.471 5.349 -3.376 1.00 . A A . 19 HIS CA 1 1 13 4463 1 1 19 HIS CB C 6.118 5.009 -2.718 1.00 . A A . 19 HIS CB 1 1 13 4464 1 1 19 HIS CD2 C 5.113 3.430 -4.599 1.00 . A A . 19 HIS CD2 1 1 13 4465 1 1 19 HIS CE1 C 3.405 4.524 -5.025 1.00 . A A . 19 HIS CE1 1 1 13 4466 1 1 19 HIS CG C 5.116 4.544 -3.779 1.00 . A A . 19 HIS CG 1 1 13 4467 1 1 19 HIS H H 7.754 3.242 -3.689 1.00 . A A . 19 HIS H 1 1 13 4468 1 1 19 HIS HA H 7.323 6.086 -4.145 1.00 . A A . 19 HIS HA 1 1 13 4469 1 1 19 HIS HB2 H 6.241 4.222 -1.987 1.00 . A A . 19 HIS HB2 1 1 13 4470 1 1 19 HIS HB3 H 5.714 5.881 -2.224 1.00 . A A . 19 HIS HB3 1 1 13 4471 1 1 19 HIS HD1 H 3.732 6.015 -3.696 1.00 . A A . 19 HIS HD1 1 1 13 4472 1 1 19 HIS HD2 H 5.876 2.670 -4.607 1.00 . A A . 19 HIS HD2 1 1 13 4473 1 1 19 HIS HE1 H 2.470 4.843 -5.462 1.00 . A A . 19 HIS HE1 1 1 13 4474 1 1 19 HIS N N 8.041 4.121 -4.009 1.00 . A A . 19 HIS N 1 1 13 4475 1 1 19 HIS ND1 N 4.032 5.173 -4.097 1.00 . A A . 19 HIS ND1 1 1 13 4476 1 1 19 HIS NE2 N 4.042 3.431 -5.367 1.00 . A A . 19 HIS NE2 1 1 13 4477 1 1 19 HIS O O 9.220 5.270 -1.757 1.00 . A A . 19 HIS O 1 1 13 4478 1 1 20 ARG C C 8.562 7.511 0.284 1.00 . A A . 20 ARG C 1 1 13 4479 1 1 20 ARG CA C 9.012 7.987 -1.105 1.00 . A A . 20 ARG CA 1 1 13 4480 1 1 20 ARG CB C 8.751 9.512 -1.221 1.00 . A A . 20 ARG CB 1 1 13 4481 1 1 20 ARG CD C 8.377 9.542 -3.787 1.00 . A A . 20 ARG CD 1 1 13 4482 1 1 20 ARG CG C 9.157 10.137 -2.594 1.00 . A A . 20 ARG CG 1 1 13 4483 1 1 20 ARG CZ C 6.022 8.927 -4.114 1.00 . A A . 20 ARG CZ 1 1 13 4484 1 1 20 ARG H H 7.506 7.700 -2.618 1.00 . A A . 20 ARG H 1 1 13 4485 1 1 20 ARG HA H 10.059 7.761 -1.242 1.00 . A A . 20 ARG HA 1 1 13 4486 1 1 20 ARG HB2 H 7.704 9.708 -1.043 1.00 . A A . 20 ARG HB2 1 1 13 4487 1 1 20 ARG HB3 H 9.314 10.014 -0.447 1.00 . A A . 20 ARG HB3 1 1 13 4488 1 1 20 ARG HD2 H 8.603 10.111 -4.676 1.00 . A A . 20 ARG HD2 1 1 13 4489 1 1 20 ARG HD3 H 8.645 8.513 -3.963 1.00 . A A . 20 ARG HD3 1 1 13 4490 1 1 20 ARG HE H 6.609 10.327 -2.843 1.00 . A A . 20 ARG HE 1 1 13 4491 1 1 20 ARG HG2 H 8.981 11.203 -2.557 1.00 . A A . 20 ARG HG2 1 1 13 4492 1 1 20 ARG HG3 H 10.214 9.979 -2.754 1.00 . A A . 20 ARG HG3 1 1 13 4493 1 1 20 ARG HH11 H 7.351 7.926 -5.231 1.00 . A A . 20 ARG HH11 1 1 13 4494 1 1 20 ARG HH12 H 5.694 7.481 -5.457 1.00 . A A . 20 ARG HH12 1 1 13 4495 1 1 20 ARG HH21 H 4.507 9.776 -3.118 1.00 . A A . 20 ARG HH21 1 1 13 4496 1 1 20 ARG HH22 H 4.064 8.541 -4.248 1.00 . A A . 20 ARG HH22 1 1 13 4497 1 1 20 ARG N N 8.199 7.230 -2.110 1.00 . A A . 20 ARG N 1 1 13 4498 1 1 20 ARG NE N 6.912 9.671 -3.505 1.00 . A A . 20 ARG NE 1 1 13 4499 1 1 20 ARG NH1 N 6.384 8.043 -5.003 1.00 . A A . 20 ARG NH1 1 1 13 4500 1 1 20 ARG NH2 N 4.766 9.095 -3.802 1.00 . A A . 20 ARG NH2 1 1 13 4501 1 1 20 ARG O O 9.304 7.564 1.245 1.00 . A A . 20 ARG O 1 1 13 4502 1 1 21 CYS C C 7.382 5.255 2.032 1.00 . A A . 21 CYS C 1 1 13 4503 1 1 21 CYS CA C 6.695 6.539 1.559 1.00 . A A . 21 CYS CA 1 1 13 4504 1 1 21 CYS CB C 5.247 6.286 1.253 1.00 . A A . 21 CYS CB 1 1 13 4505 1 1 21 CYS H H 6.813 7.049 -0.520 1.00 . A A . 21 CYS H 1 1 13 4506 1 1 21 CYS HA H 6.723 7.291 2.334 1.00 . A A . 21 CYS HA 1 1 13 4507 1 1 21 CYS HB2 H 5.178 5.590 0.429 1.00 . A A . 21 CYS HB2 1 1 13 4508 1 1 21 CYS HB3 H 4.791 5.825 2.114 1.00 . A A . 21 CYS HB3 1 1 13 4509 1 1 21 CYS N N 7.333 7.055 0.312 1.00 . A A . 21 CYS N 1 1 13 4510 1 1 21 CYS O O 7.326 4.907 3.195 1.00 . A A . 21 CYS O 1 1 13 4511 1 1 21 CYS SG S 4.284 7.753 0.823 1.00 . A A . 21 CYS SG 1 1 13 4512 1 1 22 . C C 10.164 3.460 0.791 1.00 . A A . 22 CY3 C 1 1 13 4513 1 1 22 . CA C 8.736 3.330 1.351 1.00 . A A . 22 CY3 CA 1 1 13 4514 1 1 22 . CB C 7.990 2.196 0.655 1.00 . A A . 22 CY3 CB 1 1 13 4515 1 1 22 . H H 7.997 4.960 0.171 1.00 . A A . 22 CY3 H 1 1 13 4516 1 1 22 . HA H 8.794 3.150 2.415 1.00 . A A . 22 CY3 HA 1 1 13 4517 1 1 22 . HB2 H 8.508 1.270 0.853 1.00 . A A . 22 CY3 HB2 1 1 13 4518 1 1 22 . HB3 H 8.052 2.373 -0.407 1.00 . A A . 22 CY3 HB3 1 1 13 4519 1 1 22 . HN11 H 9.982 5.407 0.452 1.00 . A A . 22 CY3 HN11 1 1 13 4520 1 1 22 . HN12 H 11.479 4.740 0.022 1.00 . A A . 22 CY3 HN12 1 1 13 4521 1 1 22 . N N 8.007 4.603 1.085 1.00 . A A . 22 CY3 N 1 1 13 4522 1 1 22 . N1 N 10.578 4.631 0.390 1.00 . A A . 22 CY3 N1 1 1 13 4523 1 1 22 . O O 10.911 2.507 0.710 1.00 . A A . 22 CY3 O 1 1 13 4524 1 1 22 . SG S 6.242 1.931 1.046 1.00 . A A . 22 CY3 SG 1 1 14 4525 1 1 1 PCA C C -5.669 3.975 3.012 1.00 . A A . 1 PCA C 1 1 14 4526 1 1 1 PCA CA C -7.137 3.560 2.809 1.00 . A A . 1 PCA CA 1 1 14 4527 1 1 1 PCA CB C -7.362 2.052 3.015 1.00 . A A . 1 PCA CB 1 1 14 4528 1 1 1 PCA CD C -7.870 2.577 0.760 1.00 . A A . 1 PCA CD 1 1 14 4529 1 1 1 PCA CG C -7.365 1.446 1.618 1.00 . A A . 1 PCA CG 1 1 14 4530 1 1 1 PCA HA H -7.754 4.114 3.499 1.00 . A A . 1 PCA HA 1 1 14 4531 1 1 1 PCA HB2 H -8.306 1.894 3.517 1.00 . A A . 1 PCA HB2 1 1 14 4532 1 1 1 PCA HB3 H -6.588 1.623 3.634 1.00 . A A . 1 PCA HB3 1 1 14 4533 1 1 1 PCA HG2 H -8.032 0.598 1.574 1.00 . A A . 1 PCA HG2 1 1 14 4534 1 1 1 PCA HG3 H -6.364 1.163 1.325 1.00 . A A . 1 PCA HG3 1 1 14 4535 1 1 1 PCA N N -7.608 3.845 1.436 1.00 . A A . 1 PCA N 1 1 14 4536 1 1 1 PCA O O -5.063 4.532 2.118 1.00 . A A . 1 PCA O 1 1 14 4537 1 1 1 PCA OE O -8.406 2.443 -0.321 1.00 . A A . 1 PCA OE 1 1 14 4538 1 1 2 ARG C C -2.837 2.989 3.847 1.00 . A A . 2 ARG C 1 1 14 4539 1 1 2 ARG CA C -3.746 4.027 4.524 1.00 . A A . 2 ARG CA 1 1 14 4540 1 1 2 ARG CB C -3.560 3.989 6.071 1.00 . A A . 2 ARG CB 1 1 14 4541 1 1 2 ARG CD C -5.916 4.932 6.640 1.00 . A A . 2 ARG CD 1 1 14 4542 1 1 2 ARG CG C -4.390 5.066 6.841 1.00 . A A . 2 ARG CG 1 1 14 4543 1 1 2 ARG CZ C -7.480 3.040 6.674 1.00 . A A . 2 ARG CZ 1 1 14 4544 1 1 2 ARG H H -5.721 3.233 4.850 1.00 . A A . 2 ARG H 1 1 14 4545 1 1 2 ARG HA H -3.512 5.011 4.143 1.00 . A A . 2 ARG HA 1 1 14 4546 1 1 2 ARG HB2 H -3.833 3.010 6.438 1.00 . A A . 2 ARG HB2 1 1 14 4547 1 1 2 ARG HB3 H -2.515 4.146 6.299 1.00 . A A . 2 ARG HB3 1 1 14 4548 1 1 2 ARG HD2 H -6.423 5.633 7.287 1.00 . A A . 2 ARG HD2 1 1 14 4549 1 1 2 ARG HD3 H -6.206 5.138 5.621 1.00 . A A . 2 ARG HD3 1 1 14 4550 1 1 2 ARG HE H -5.719 3.006 7.579 1.00 . A A . 2 ARG HE 1 1 14 4551 1 1 2 ARG HG2 H -4.171 4.981 7.895 1.00 . A A . 2 ARG HG2 1 1 14 4552 1 1 2 ARG HG3 H -4.079 6.049 6.518 1.00 . A A . 2 ARG HG3 1 1 14 4553 1 1 2 ARG HH11 H -8.092 4.662 5.664 1.00 . A A . 2 ARG HH11 1 1 14 4554 1 1 2 ARG HH12 H -9.194 3.328 5.682 1.00 . A A . 2 ARG HH12 1 1 14 4555 1 1 2 ARG HH21 H -7.101 1.314 7.611 1.00 . A A . 2 ARG HH21 1 1 14 4556 1 1 2 ARG HH22 H -8.628 1.407 6.798 1.00 . A A . 2 ARG HH22 1 1 14 4557 1 1 2 ARG N N -5.162 3.685 4.184 1.00 . A A . 2 ARG N 1 1 14 4558 1 1 2 ARG NE N -6.328 3.549 7.036 1.00 . A A . 2 ARG NE 1 1 14 4559 1 1 2 ARG NH1 N -8.320 3.732 5.950 1.00 . A A . 2 ARG NH1 1 1 14 4560 1 1 2 ARG NH2 N -7.758 1.825 7.058 1.00 . A A . 2 ARG NH2 1 1 14 4561 1 1 2 ARG O O -2.513 1.973 4.429 1.00 . A A . 2 ARG O 1 1 14 4562 1 1 3 LEU C C -0.125 2.275 2.346 1.00 . A A . 3 LEU C 1 1 14 4563 1 1 3 LEU CA C -1.573 2.382 1.823 1.00 . A A . 3 LEU CA 1 1 14 4564 1 1 3 LEU CB C -1.585 2.899 0.352 1.00 . A A . 3 LEU CB 1 1 14 4565 1 1 3 LEU CD1 C -2.898 3.440 -1.713 1.00 . A A . 3 LEU CD1 1 1 14 4566 1 1 3 LEU CD2 C -3.552 1.439 -0.346 1.00 . A A . 3 LEU CD2 1 1 14 4567 1 1 3 LEU CG C -3.005 2.887 -0.274 1.00 . A A . 3 LEU CG 1 1 14 4568 1 1 3 LEU H H -2.762 4.129 2.231 1.00 . A A . 3 LEU H 1 1 14 4569 1 1 3 LEU HA H -1.984 1.389 1.850 1.00 . A A . 3 LEU HA 1 1 14 4570 1 1 3 LEU HB2 H -1.191 3.904 0.335 1.00 . A A . 3 LEU HB2 1 1 14 4571 1 1 3 LEU HB3 H -0.958 2.277 -0.267 1.00 . A A . 3 LEU HB3 1 1 14 4572 1 1 3 LEU HD11 H -3.869 3.449 -2.185 1.00 . A A . 3 LEU HD11 1 1 14 4573 1 1 3 LEU HD12 H -2.231 2.826 -2.304 1.00 . A A . 3 LEU HD12 1 1 14 4574 1 1 3 LEU HD13 H -2.511 4.448 -1.696 1.00 . A A . 3 LEU HD13 1 1 14 4575 1 1 3 LEU HD21 H -2.900 0.822 -0.947 1.00 . A A . 3 LEU HD21 1 1 14 4576 1 1 3 LEU HD22 H -4.537 1.438 -0.790 1.00 . A A . 3 LEU HD22 1 1 14 4577 1 1 3 LEU HD23 H -3.626 1.005 0.640 1.00 . A A . 3 LEU HD23 1 1 14 4578 1 1 3 LEU HG H -3.676 3.507 0.303 1.00 . A A . 3 LEU HG 1 1 14 4579 1 1 3 LEU N N -2.458 3.288 2.628 1.00 . A A . 3 LEU N 1 1 14 4580 1 1 3 LEU O O 0.139 2.527 3.503 1.00 . A A . 3 LEU O 1 1 14 4581 1 1 4 CYS C C 2.829 2.678 2.687 1.00 . A A . 4 CYS C 1 1 14 4582 1 1 4 CYS CA C 2.212 1.703 1.677 1.00 . A A . 4 CYS CA 1 1 14 4583 1 1 4 CYS CB C 2.943 1.879 0.342 1.00 . A A . 4 CYS CB 1 1 14 4584 1 1 4 CYS H H 0.425 1.696 0.546 1.00 . A A . 4 CYS H 1 1 14 4585 1 1 4 CYS HA H 2.379 0.704 2.042 1.00 . A A . 4 CYS HA 1 1 14 4586 1 1 4 CYS HB2 H 2.969 2.920 0.073 1.00 . A A . 4 CYS HB2 1 1 14 4587 1 1 4 CYS HB3 H 3.970 1.589 0.498 1.00 . A A . 4 CYS HB3 1 1 14 4588 1 1 4 CYS N N 0.748 1.890 1.446 1.00 . A A . 4 CYS N 1 1 14 4589 1 1 4 CYS O O 3.381 2.271 3.690 1.00 . A A . 4 CYS O 1 1 14 4590 1 1 4 CYS SG S 2.387 0.999 -1.138 1.00 . A A . 4 CYS SG 1 1 14 4591 1 1 5 CYS C C 2.662 4.897 4.678 1.00 . A A . 5 CYS C 1 1 14 4592 1 1 5 CYS CA C 3.266 5.004 3.272 1.00 . A A . 5 CYS CA 1 1 14 4593 1 1 5 CYS CB C 2.956 6.393 2.689 1.00 . A A . 5 CYS CB 1 1 14 4594 1 1 5 CYS H H 2.219 4.181 1.560 1.00 . A A . 5 CYS H 1 1 14 4595 1 1 5 CYS HA H 4.335 4.864 3.340 1.00 . A A . 5 CYS HA 1 1 14 4596 1 1 5 CYS HB2 H 3.188 6.389 1.633 1.00 . A A . 5 CYS HB2 1 1 14 4597 1 1 5 CYS HB3 H 1.901 6.603 2.796 1.00 . A A . 5 CYS HB3 1 1 14 4598 1 1 5 CYS N N 2.699 3.944 2.380 1.00 . A A . 5 CYS N 1 1 14 4599 1 1 5 CYS O O 3.319 5.146 5.670 1.00 . A A . 5 CYS O 1 1 14 4600 1 1 5 CYS SG S 3.882 7.741 3.464 1.00 . A A . 5 CYS SG 1 1 14 4601 1 1 6 GLY C C 1.037 3.100 6.750 1.00 . A A . 6 GLY C 1 1 14 4602 1 1 6 GLY CA C 0.647 4.357 5.957 1.00 . A A . 6 GLY CA 1 1 14 4603 1 1 6 GLY H H 0.964 4.345 3.837 1.00 . A A . 6 GLY H 1 1 14 4604 1 1 6 GLY HA2 H 0.804 5.228 6.577 1.00 . A A . 6 GLY HA2 1 1 14 4605 1 1 6 GLY HA3 H -0.403 4.294 5.712 1.00 . A A . 6 GLY HA3 1 1 14 4606 1 1 6 GLY N N 1.411 4.521 4.691 1.00 . A A . 6 GLY N 1 1 14 4607 1 1 6 GLY O O 0.959 3.130 7.964 1.00 . A A . 6 GLY O 1 1 14 4608 1 1 7 PHE C C 2.728 -0.246 6.138 1.00 . A A . 7 PHE C 1 1 14 4609 1 1 7 PHE CA C 1.826 0.801 6.848 1.00 . A A . 7 PHE CA 1 1 14 4610 1 1 7 PHE CB C 0.509 0.098 7.330 1.00 . A A . 7 PHE CB 1 1 14 4611 1 1 7 PHE CD1 C -0.276 -0.098 4.863 1.00 . A A . 7 PHE CD1 1 1 14 4612 1 1 7 PHE CD2 C -1.708 -0.848 6.607 1.00 . A A . 7 PHE CD2 1 1 14 4613 1 1 7 PHE CE1 C -1.222 -0.463 3.933 1.00 . A A . 7 PHE CE1 1 1 14 4614 1 1 7 PHE CE2 C -2.656 -1.214 5.673 1.00 . A A . 7 PHE CE2 1 1 14 4615 1 1 7 PHE CG C -0.502 -0.284 6.218 1.00 . A A . 7 PHE CG 1 1 14 4616 1 1 7 PHE CZ C -2.413 -1.020 4.332 1.00 . A A . 7 PHE CZ 1 1 14 4617 1 1 7 PHE H H 1.497 2.054 5.106 1.00 . A A . 7 PHE H 1 1 14 4618 1 1 7 PHE HA H 2.355 1.140 7.725 1.00 . A A . 7 PHE HA 1 1 14 4619 1 1 7 PHE HB2 H 0.769 -0.807 7.860 1.00 . A A . 7 PHE HB2 1 1 14 4620 1 1 7 PHE HB3 H 0.004 0.751 8.027 1.00 . A A . 7 PHE HB3 1 1 14 4621 1 1 7 PHE HD1 H 0.640 0.340 4.510 1.00 . A A . 7 PHE HD1 1 1 14 4622 1 1 7 PHE HD2 H -1.912 -1.004 7.656 1.00 . A A . 7 PHE HD2 1 1 14 4623 1 1 7 PHE HE1 H -1.028 -0.309 2.884 1.00 . A A . 7 PHE HE1 1 1 14 4624 1 1 7 PHE HE2 H -3.589 -1.651 5.994 1.00 . A A . 7 PHE HE2 1 1 14 4625 1 1 7 PHE HZ H -3.149 -1.302 3.593 1.00 . A A . 7 PHE HZ 1 1 14 4626 1 1 7 PHE N N 1.443 2.039 6.084 1.00 . A A . 7 PHE N 1 1 14 4627 1 1 7 PHE O O 2.697 -0.403 4.930 1.00 . A A . 7 PHE O 1 1 14 4628 1 1 8 HYP C C 3.619 -3.169 5.763 1.00 . A A . 8 HYP C 1 1 14 4629 1 1 8 HYP CA C 4.394 -2.043 6.463 1.00 . A A . 8 HYP CA 1 1 14 4630 1 1 8 HYP CB C 5.135 -2.526 7.708 1.00 . A A . 8 HYP CB 1 1 14 4631 1 1 8 HYP CD C 3.668 -0.797 8.402 1.00 . A A . 8 HYP CD 1 1 14 4632 1 1 8 HYP CG C 4.252 -2.112 8.828 1.00 . A A . 8 HYP CG 1 1 14 4633 1 1 8 HYP HA H 5.138 -1.665 5.785 1.00 . A A . 8 HYP HA 1 1 14 4634 1 1 8 HYP HB2 H 6.108 -2.061 7.763 1.00 . A A . 8 HYP HB2 1 1 14 4635 1 1 8 HYP HB3 H 5.281 -3.596 7.682 1.00 . A A . 8 HYP HB3 1 1 14 4636 1 1 8 HYP HD1 H 5.410 -2.822 10.217 1.00 . A A . 8 HYP HD1 1 1 14 4637 1 1 8 HYP HD22 H 4.341 0.016 8.636 1.00 . A A . 8 HYP HD22 1 1 14 4638 1 1 8 HYP HD23 H 2.717 -0.651 8.892 1.00 . A A . 8 HYP HD23 1 1 14 4639 1 1 8 HYP HG H 3.466 -2.842 8.966 1.00 . A A . 8 HYP HG 1 1 14 4640 1 1 8 HYP N N 3.514 -0.949 6.937 1.00 . A A . 8 HYP N 1 1 14 4641 1 1 8 HYP O O 4.219 -4.018 5.131 1.00 . A A . 8 HYP O 1 1 14 4642 1 1 8 HYP OD1 O 5.003 -1.973 10.025 1.00 . A A . 8 HYP OD1 1 1 14 4643 1 1 9 LYS C C 1.635 -4.058 3.790 1.00 . A A . 9 LYS C 1 1 14 4644 1 1 9 LYS CA C 1.417 -4.136 5.298 1.00 . A A . 9 LYS CA 1 1 14 4645 1 1 9 LYS CB C -0.030 -3.763 5.780 1.00 . A A . 9 LYS CB 1 1 14 4646 1 1 9 LYS CD C -1.930 -4.687 4.072 1.00 . A A . 9 LYS CD 1 1 14 4647 1 1 9 LYS CE C -1.085 -4.978 2.838 1.00 . A A . 9 LYS CE 1 1 14 4648 1 1 9 LYS CG C -1.203 -4.762 5.459 1.00 . A A . 9 LYS CG 1 1 14 4649 1 1 9 LYS H H 1.922 -2.394 6.436 1.00 . A A . 9 LYS H 1 1 14 4650 1 1 9 LYS HA H 1.697 -5.117 5.654 1.00 . A A . 9 LYS HA 1 1 14 4651 1 1 9 LYS HB2 H 0.002 -3.621 6.851 1.00 . A A . 9 LYS HB2 1 1 14 4652 1 1 9 LYS HB3 H -0.283 -2.814 5.336 1.00 . A A . 9 LYS HB3 1 1 14 4653 1 1 9 LYS HD2 H -2.750 -5.388 4.089 1.00 . A A . 9 LYS HD2 1 1 14 4654 1 1 9 LYS HD3 H -2.354 -3.699 3.965 1.00 . A A . 9 LYS HD3 1 1 14 4655 1 1 9 LYS HE2 H -0.379 -4.187 2.700 1.00 . A A . 9 LYS HE2 1 1 14 4656 1 1 9 LYS HE3 H -0.578 -5.928 2.912 1.00 . A A . 9 LYS HE3 1 1 14 4657 1 1 9 LYS HG2 H -0.816 -5.765 5.568 1.00 . A A . 9 LYS HG2 1 1 14 4658 1 1 9 LYS HG3 H -1.955 -4.632 6.223 1.00 . A A . 9 LYS HG3 1 1 14 4659 1 1 9 LYS HZ1 H -1.392 -4.647 0.809 1.00 . A A . 9 LYS HZ1 1 1 14 4660 1 1 9 LYS HZ2 H -2.751 -4.321 1.773 1.00 . A A . 9 LYS HZ2 1 1 14 4661 1 1 9 LYS HZ3 H -2.307 -5.929 1.447 1.00 . A A . 9 LYS HZ3 1 1 14 4662 1 1 9 LYS N N 2.318 -3.119 5.910 1.00 . A A . 9 LYS N 1 1 14 4663 1 1 9 LYS NZ N -1.950 -4.968 1.626 1.00 . A A . 9 LYS NZ 1 1 14 4664 1 1 9 LYS O O 1.853 -5.078 3.163 1.00 . A A . 9 LYS O 1 1 14 4665 1 1 10 SER C C 3.241 -2.378 1.439 1.00 . A A . 10 SER C 1 1 14 4666 1 1 10 SER CA C 1.787 -2.719 1.771 1.00 . A A . 10 SER CA 1 1 14 4667 1 1 10 SER CB C 0.844 -1.621 1.250 1.00 . A A . 10 SER CB 1 1 14 4668 1 1 10 SER H H 1.423 -2.057 3.790 1.00 . A A . 10 SER H 1 1 14 4669 1 1 10 SER HA H 1.535 -3.650 1.281 1.00 . A A . 10 SER HA 1 1 14 4670 1 1 10 SER HB2 H 0.958 -0.706 1.807 1.00 . A A . 10 SER HB2 1 1 14 4671 1 1 10 SER HB3 H 0.969 -1.440 0.193 1.00 . A A . 10 SER HB3 1 1 14 4672 1 1 10 SER HG H -0.539 -2.971 1.018 1.00 . A A . 10 SER HG 1 1 14 4673 1 1 10 SER N N 1.585 -2.862 3.246 1.00 . A A . 10 SER N 1 1 14 4674 1 1 10 SER O O 3.809 -2.996 0.565 1.00 . A A . 10 SER O 1 1 14 4675 1 1 10 SER OG O -0.457 -2.138 1.490 1.00 . A A . 10 SER OG 1 1 14 4676 1 1 11 CYS C C 6.256 -2.020 1.635 1.00 . A A . 11 CYS C 1 1 14 4677 1 1 11 CYS CA C 5.205 -0.940 1.962 1.00 . A A . 11 CYS CA 1 1 14 4678 1 1 11 CYS CB C 5.595 -0.218 3.240 1.00 . A A . 11 CYS CB 1 1 14 4679 1 1 11 CYS H H 3.238 -0.989 2.834 1.00 . A A . 11 CYS H 1 1 14 4680 1 1 11 CYS HA H 5.210 -0.216 1.167 1.00 . A A . 11 CYS HA 1 1 14 4681 1 1 11 CYS HB2 H 4.852 0.537 3.432 1.00 . A A . 11 CYS HB2 1 1 14 4682 1 1 11 CYS HB3 H 5.513 -0.946 4.027 1.00 . A A . 11 CYS HB3 1 1 14 4683 1 1 11 CYS N N 3.786 -1.419 2.146 1.00 . A A . 11 CYS N 1 1 14 4684 1 1 11 CYS O O 7.266 -1.728 1.023 1.00 . A A . 11 CYS O 1 1 14 4685 1 1 11 CYS SG S 7.213 0.564 3.452 1.00 . A A . 11 CYS SG 1 1 14 4686 1 1 12 ARG C C 6.643 -5.033 0.432 1.00 . A A . 12 ARG C 1 1 14 4687 1 1 12 ARG CA C 6.910 -4.378 1.810 1.00 . A A . 12 ARG CA 1 1 14 4688 1 1 12 ARG CB C 6.691 -5.359 3.003 1.00 . A A . 12 ARG CB 1 1 14 4689 1 1 12 ARG CD C 9.099 -6.335 3.053 1.00 . A A . 12 ARG CD 1 1 14 4690 1 1 12 ARG CG C 7.582 -6.644 3.013 1.00 . A A . 12 ARG CG 1 1 14 4691 1 1 12 ARG CZ C 10.638 -4.998 1.683 1.00 . A A . 12 ARG CZ 1 1 14 4692 1 1 12 ARG H H 5.143 -3.388 2.530 1.00 . A A . 12 ARG H 1 1 14 4693 1 1 12 ARG HA H 7.919 -3.995 1.824 1.00 . A A . 12 ARG HA 1 1 14 4694 1 1 12 ARG HB2 H 6.864 -4.819 3.922 1.00 . A A . 12 ARG HB2 1 1 14 4695 1 1 12 ARG HB3 H 5.655 -5.668 3.000 1.00 . A A . 12 ARG HB3 1 1 14 4696 1 1 12 ARG HD2 H 9.319 -5.691 3.893 1.00 . A A . 12 ARG HD2 1 1 14 4697 1 1 12 ARG HD3 H 9.664 -7.250 3.150 1.00 . A A . 12 ARG HD3 1 1 14 4698 1 1 12 ARG HE H 8.910 -5.683 1.011 1.00 . A A . 12 ARG HE 1 1 14 4699 1 1 12 ARG HG2 H 7.337 -7.205 3.903 1.00 . A A . 12 ARG HG2 1 1 14 4700 1 1 12 ARG HG3 H 7.355 -7.275 2.167 1.00 . A A . 12 ARG HG3 1 1 14 4701 1 1 12 ARG HH11 H 11.237 -5.374 3.560 1.00 . A A . 12 ARG HH11 1 1 14 4702 1 1 12 ARG HH12 H 12.323 -4.428 2.599 1.00 . A A . 12 ARG HH12 1 1 14 4703 1 1 12 ARG HH21 H 10.259 -4.494 -0.216 1.00 . A A . 12 ARG HH21 1 1 14 4704 1 1 12 ARG HH22 H 11.762 -3.922 0.427 1.00 . A A . 12 ARG HH22 1 1 14 4705 1 1 12 ARG N N 5.981 -3.230 2.052 1.00 . A A . 12 ARG N 1 1 14 4706 1 1 12 ARG NE N 9.506 -5.649 1.787 1.00 . A A . 12 ARG NE 1 1 14 4707 1 1 12 ARG NH1 N 11.463 -4.928 2.693 1.00 . A A . 12 ARG NH1 1 1 14 4708 1 1 12 ARG NH2 N 10.907 -4.428 0.542 1.00 . A A . 12 ARG NH2 1 1 14 4709 1 1 12 ARG O O 7.075 -6.140 0.176 1.00 . A A . 12 ARG O 1 1 14 4710 1 1 13 SER C C 6.368 -4.098 -2.889 1.00 . A A . 13 SER C 1 1 14 4711 1 1 13 SER CA C 5.622 -4.865 -1.790 1.00 . A A . 13 SER CA 1 1 14 4712 1 1 13 SER CB C 4.106 -4.755 -2.056 1.00 . A A . 13 SER CB 1 1 14 4713 1 1 13 SER H H 5.626 -3.440 -0.162 1.00 . A A . 13 SER H 1 1 14 4714 1 1 13 SER HA H 5.906 -5.905 -1.847 1.00 . A A . 13 SER HA 1 1 14 4715 1 1 13 SER HB2 H 3.839 -5.172 -3.017 1.00 . A A . 13 SER HB2 1 1 14 4716 1 1 13 SER HB3 H 3.536 -5.238 -1.276 1.00 . A A . 13 SER HB3 1 1 14 4717 1 1 13 SER HG H 3.090 -3.211 -1.450 1.00 . A A . 13 SER HG 1 1 14 4718 1 1 13 SER N N 5.942 -4.328 -0.424 1.00 . A A . 13 SER N 1 1 14 4719 1 1 13 SER O O 6.762 -2.961 -2.708 1.00 . A A . 13 SER O 1 1 14 4720 1 1 13 SER OG O 3.823 -3.364 -2.051 1.00 . A A . 13 SER OG 1 1 14 4721 1 1 14 ARG C C 6.498 -2.903 -5.574 1.00 . A A . 14 ARG C 1 1 14 4722 1 1 14 ARG CA C 7.222 -4.207 -5.197 1.00 . A A . 14 ARG CA 1 1 14 4723 1 1 14 ARG CB C 7.138 -5.272 -6.323 1.00 . A A . 14 ARG CB 1 1 14 4724 1 1 14 ARG CD C 7.530 -3.633 -8.319 1.00 . A A . 14 ARG CD 1 1 14 4725 1 1 14 ARG CG C 7.947 -4.948 -7.620 1.00 . A A . 14 ARG CG 1 1 14 4726 1 1 14 ARG CZ C 5.479 -4.312 -9.502 1.00 . A A . 14 ARG CZ 1 1 14 4727 1 1 14 ARG H H 6.166 -5.687 -4.049 1.00 . A A . 14 ARG H 1 1 14 4728 1 1 14 ARG HA H 8.248 -3.998 -4.944 1.00 . A A . 14 ARG HA 1 1 14 4729 1 1 14 ARG HB2 H 7.504 -6.210 -5.930 1.00 . A A . 14 ARG HB2 1 1 14 4730 1 1 14 ARG HB3 H 6.102 -5.418 -6.590 1.00 . A A . 14 ARG HB3 1 1 14 4731 1 1 14 ARG HD2 H 7.820 -2.766 -7.752 1.00 . A A . 14 ARG HD2 1 1 14 4732 1 1 14 ARG HD3 H 8.021 -3.570 -9.280 1.00 . A A . 14 ARG HD3 1 1 14 4733 1 1 14 ARG HE H 5.484 -3.093 -7.946 1.00 . A A . 14 ARG HE 1 1 14 4734 1 1 14 ARG HG2 H 8.994 -4.880 -7.364 1.00 . A A . 14 ARG HG2 1 1 14 4735 1 1 14 ARG HG3 H 7.830 -5.768 -8.314 1.00 . A A . 14 ARG HG3 1 1 14 4736 1 1 14 ARG HH11 H 7.184 -5.083 -10.219 1.00 . A A . 14 ARG HH11 1 1 14 4737 1 1 14 ARG HH12 H 5.740 -5.555 -11.047 1.00 . A A . 14 ARG HH12 1 1 14 4738 1 1 14 ARG HH21 H 3.658 -3.675 -8.970 1.00 . A A . 14 ARG HH21 1 1 14 4739 1 1 14 ARG HH22 H 3.711 -4.748 -10.330 1.00 . A A . 14 ARG HH22 1 1 14 4740 1 1 14 ARG N N 6.523 -4.775 -4.001 1.00 . A A . 14 ARG N 1 1 14 4741 1 1 14 ARG NE N 6.048 -3.628 -8.540 1.00 . A A . 14 ARG NE 1 1 14 4742 1 1 14 ARG NH1 N 6.191 -5.040 -10.320 1.00 . A A . 14 ARG NH1 1 1 14 4743 1 1 14 ARG NH2 N 4.181 -4.239 -9.609 1.00 . A A . 14 ARG NH2 1 1 14 4744 1 1 14 ARG O O 7.119 -1.881 -5.789 1.00 . A A . 14 ARG O 1 1 14 4745 1 1 15 GLN C C 4.628 -0.632 -5.073 1.00 . A A . 15 GLN C 1 1 14 4746 1 1 15 GLN CA C 4.318 -1.836 -5.976 1.00 . A A . 15 GLN CA 1 1 14 4747 1 1 15 GLN CB C 2.853 -2.284 -5.815 1.00 . A A . 15 GLN CB 1 1 14 4748 1 1 15 GLN CD C 0.445 -1.635 -6.011 1.00 . A A . 15 GLN CD 1 1 14 4749 1 1 15 GLN CG C 1.885 -1.139 -6.183 1.00 . A A . 15 GLN CG 1 1 14 4750 1 1 15 GLN H H 4.770 -3.859 -5.421 1.00 . A A . 15 GLN H 1 1 14 4751 1 1 15 GLN HA H 4.512 -1.561 -7.003 1.00 . A A . 15 GLN HA 1 1 14 4752 1 1 15 GLN HB2 H 2.671 -3.129 -6.463 1.00 . A A . 15 GLN HB2 1 1 14 4753 1 1 15 GLN HB3 H 2.682 -2.594 -4.794 1.00 . A A . 15 GLN HB3 1 1 14 4754 1 1 15 GLN HE21 H 0.552 -1.628 -4.029 1.00 . A A . 15 GLN HE21 1 1 14 4755 1 1 15 GLN HE22 H -0.936 -2.131 -4.674 1.00 . A A . 15 GLN HE22 1 1 14 4756 1 1 15 GLN HG2 H 2.031 -0.287 -5.535 1.00 . A A . 15 GLN HG2 1 1 14 4757 1 1 15 GLN HG3 H 2.032 -0.831 -7.209 1.00 . A A . 15 GLN HG3 1 1 14 4758 1 1 15 GLN N N 5.191 -2.999 -5.625 1.00 . A A . 15 GLN N 1 1 14 4759 1 1 15 GLN NE2 N -0.019 -1.813 -4.805 1.00 . A A . 15 GLN NE2 1 1 14 4760 1 1 15 GLN O O 4.566 0.500 -5.514 1.00 . A A . 15 GLN O 1 1 14 4761 1 1 15 GLN OE1 O -0.268 -1.865 -6.968 1.00 . A A . 15 GLN OE1 1 1 14 4762 1 1 16 CYS C C 6.724 0.658 -2.922 1.00 . A A . 16 CYS C 1 1 14 4763 1 1 16 CYS CA C 5.275 0.154 -2.862 1.00 . A A . 16 CYS CA 1 1 14 4764 1 1 16 CYS CB C 5.014 -0.331 -1.454 1.00 . A A . 16 CYS CB 1 1 14 4765 1 1 16 CYS H H 4.968 -1.863 -3.558 1.00 . A A . 16 CYS H 1 1 14 4766 1 1 16 CYS HA H 4.614 0.983 -3.045 1.00 . A A . 16 CYS HA 1 1 14 4767 1 1 16 CYS HB2 H 5.640 -1.176 -1.237 1.00 . A A . 16 CYS HB2 1 1 14 4768 1 1 16 CYS HB3 H 5.317 0.463 -0.789 1.00 . A A . 16 CYS HB3 1 1 14 4769 1 1 16 CYS N N 4.949 -0.925 -3.838 1.00 . A A . 16 CYS N 1 1 14 4770 1 1 16 CYS O O 6.990 1.751 -2.461 1.00 . A A . 16 CYS O 1 1 14 4771 1 1 16 CYS SG S 3.325 -0.778 -0.999 1.00 . A A . 16 CYS SG 1 1 14 4772 1 1 17 LYS C C 9.239 1.723 -4.199 1.00 . A A . 17 LYS C 1 1 14 4773 1 1 17 LYS CA C 9.050 0.322 -3.559 1.00 . A A . 17 LYS CA 1 1 14 4774 1 1 17 LYS CB C 9.879 -0.707 -4.370 1.00 . A A . 17 LYS CB 1 1 14 4775 1 1 17 LYS CD C 10.728 -3.122 -4.387 1.00 . A A . 17 LYS CD 1 1 14 4776 1 1 17 LYS CE C 12.212 -2.708 -4.467 1.00 . A A . 17 LYS CE 1 1 14 4777 1 1 17 LYS CG C 9.890 -2.064 -3.627 1.00 . A A . 17 LYS CG 1 1 14 4778 1 1 17 LYS H H 7.354 -1.005 -3.823 1.00 . A A . 17 LYS H 1 1 14 4779 1 1 17 LYS HA H 9.445 0.349 -2.555 1.00 . A A . 17 LYS HA 1 1 14 4780 1 1 17 LYS HB2 H 9.460 -0.839 -5.355 1.00 . A A . 17 LYS HB2 1 1 14 4781 1 1 17 LYS HB3 H 10.888 -0.336 -4.473 1.00 . A A . 17 LYS HB3 1 1 14 4782 1 1 17 LYS HD2 H 10.650 -4.070 -3.876 1.00 . A A . 17 LYS HD2 1 1 14 4783 1 1 17 LYS HD3 H 10.339 -3.241 -5.388 1.00 . A A . 17 LYS HD3 1 1 14 4784 1 1 17 LYS HE2 H 12.327 -1.786 -5.015 1.00 . A A . 17 LYS HE2 1 1 14 4785 1 1 17 LYS HE3 H 12.626 -2.586 -3.476 1.00 . A A . 17 LYS HE3 1 1 14 4786 1 1 17 LYS HG2 H 10.297 -1.931 -2.635 1.00 . A A . 17 LYS HG2 1 1 14 4787 1 1 17 LYS HG3 H 8.881 -2.426 -3.531 1.00 . A A . 17 LYS HG3 1 1 14 4788 1 1 17 LYS HZ1 H 13.975 -3.749 -4.846 1.00 . A A . 17 LYS HZ1 1 1 14 4789 1 1 17 LYS HZ2 H 12.962 -3.584 -6.200 1.00 . A A . 17 LYS HZ2 1 1 14 4790 1 1 17 LYS HZ3 H 12.572 -4.696 -4.977 1.00 . A A . 17 LYS HZ3 1 1 14 4791 1 1 17 LYS N N 7.620 -0.127 -3.473 1.00 . A A . 17 LYS N 1 1 14 4792 1 1 17 LYS NZ N 12.989 -3.764 -5.176 1.00 . A A . 17 LYS NZ 1 1 14 4793 1 1 17 LYS O O 9.976 2.520 -3.649 1.00 . A A . 17 LYS O 1 1 14 4794 1 1 18 HYP C C 8.125 4.505 -5.159 1.00 . A A . 18 HYP C 1 1 14 4795 1 1 18 HYP CA C 8.722 3.332 -5.969 1.00 . A A . 18 HYP CA 1 1 14 4796 1 1 18 HYP CB C 8.048 3.148 -7.330 1.00 . A A . 18 HYP CB 1 1 14 4797 1 1 18 HYP CD C 7.695 1.137 -6.100 1.00 . A A . 18 HYP CD 1 1 14 4798 1 1 18 HYP CG C 7.054 2.070 -7.091 1.00 . A A . 18 HYP CG 1 1 14 4799 1 1 18 HYP HA H 9.762 3.558 -6.152 1.00 . A A . 18 HYP HA 1 1 14 4800 1 1 18 HYP HB2 H 8.784 2.869 -8.070 1.00 . A A . 18 HYP HB2 1 1 14 4801 1 1 18 HYP HB3 H 7.580 4.065 -7.658 1.00 . A A . 18 HYP HB3 1 1 14 4802 1 1 18 HYP HD1 H 7.550 0.915 -8.576 1.00 . A A . 18 HYP HD1 1 1 14 4803 1 1 18 HYP HD22 H 8.250 0.366 -6.611 1.00 . A A . 18 HYP HD22 1 1 14 4804 1 1 18 HYP HD23 H 6.928 0.704 -5.485 1.00 . A A . 18 HYP HD23 1 1 14 4805 1 1 18 HYP HG H 6.149 2.493 -6.681 1.00 . A A . 18 HYP HG 1 1 14 4806 1 1 18 HYP N N 8.598 2.009 -5.316 1.00 . A A . 18 HYP N 1 1 14 4807 1 1 18 HYP O O 8.222 5.634 -5.604 1.00 . A A . 18 HYP O 1 1 14 4808 1 1 18 HYP OD1 O 6.760 1.385 -8.300 1.00 . A A . 18 HYP OD1 1 1 14 4809 1 1 19 HIS C C 8.054 6.062 -2.448 1.00 . A A . 19 HIS C 1 1 14 4810 1 1 19 HIS CA C 6.944 5.319 -3.189 1.00 . A A . 19 HIS CA 1 1 14 4811 1 1 19 HIS CB C 5.955 4.732 -2.157 1.00 . A A . 19 HIS CB 1 1 14 4812 1 1 19 HIS CD2 C 4.684 3.281 -3.998 1.00 . A A . 19 HIS CD2 1 1 14 4813 1 1 19 HIS CE1 C 2.761 3.494 -3.255 1.00 . A A . 19 HIS CE1 1 1 14 4814 1 1 19 HIS CG C 4.761 4.068 -2.860 1.00 . A A . 19 HIS CG 1 1 14 4815 1 1 19 HIS H H 7.492 3.297 -3.699 1.00 . A A . 19 HIS H 1 1 14 4816 1 1 19 HIS HA H 6.427 6.013 -3.837 1.00 . A A . 19 HIS HA 1 1 14 4817 1 1 19 HIS HB2 H 6.449 3.995 -1.542 1.00 . A A . 19 HIS HB2 1 1 14 4818 1 1 19 HIS HB3 H 5.580 5.519 -1.518 1.00 . A A . 19 HIS HB3 1 1 14 4819 1 1 19 HIS HD1 H 3.238 4.649 -1.665 1.00 . A A . 19 HIS HD1 1 1 14 4820 1 1 19 HIS HD2 H 5.523 2.989 -4.608 1.00 . A A . 19 HIS HD2 1 1 14 4821 1 1 19 HIS HE1 H 1.691 3.414 -3.134 1.00 . A A . 19 HIS HE1 1 1 14 4822 1 1 19 HIS N N 7.540 4.222 -4.019 1.00 . A A . 19 HIS N 1 1 14 4823 1 1 19 HIS ND1 N 3.536 4.155 -2.457 1.00 . A A . 19 HIS ND1 1 1 14 4824 1 1 19 HIS NE2 N 3.434 2.933 -4.229 1.00 . A A . 19 HIS NE2 1 1 14 4825 1 1 19 HIS O O 9.036 5.463 -2.059 1.00 . A A . 19 HIS O 1 1 14 4826 1 1 20 ARG C C 8.953 7.820 -0.067 1.00 . A A . 20 ARG C 1 1 14 4827 1 1 20 ARG CA C 8.895 8.174 -1.563 1.00 . A A . 20 ARG CA 1 1 14 4828 1 1 20 ARG CB C 8.538 9.665 -1.729 1.00 . A A . 20 ARG CB 1 1 14 4829 1 1 20 ARG CD C 8.212 11.534 -3.402 1.00 . A A . 20 ARG CD 1 1 14 4830 1 1 20 ARG CG C 8.538 10.038 -3.233 1.00 . A A . 20 ARG CG 1 1 14 4831 1 1 20 ARG CZ C 9.266 13.642 -2.722 1.00 . A A . 20 ARG CZ 1 1 14 4832 1 1 20 ARG H H 7.056 7.768 -2.617 1.00 . A A . 20 ARG H 1 1 14 4833 1 1 20 ARG HA H 9.865 7.982 -2.000 1.00 . A A . 20 ARG HA 1 1 14 4834 1 1 20 ARG HB2 H 7.560 9.851 -1.309 1.00 . A A . 20 ARG HB2 1 1 14 4835 1 1 20 ARG HB3 H 9.262 10.268 -1.200 1.00 . A A . 20 ARG HB3 1 1 14 4836 1 1 20 ARG HD2 H 8.202 11.797 -4.451 1.00 . A A . 20 ARG HD2 1 1 14 4837 1 1 20 ARG HD3 H 7.251 11.768 -2.966 1.00 . A A . 20 ARG HD3 1 1 14 4838 1 1 20 ARG HE H 9.990 11.865 -2.234 1.00 . A A . 20 ARG HE 1 1 14 4839 1 1 20 ARG HG2 H 9.507 9.829 -3.662 1.00 . A A . 20 ARG HG2 1 1 14 4840 1 1 20 ARG HG3 H 7.796 9.454 -3.758 1.00 . A A . 20 ARG HG3 1 1 14 4841 1 1 20 ARG HH11 H 7.596 13.802 -3.822 1.00 . A A . 20 ARG HH11 1 1 14 4842 1 1 20 ARG HH12 H 8.331 15.298 -3.350 1.00 . A A . 20 ARG HH12 1 1 14 4843 1 1 20 ARG HH21 H 10.935 13.741 -1.623 1.00 . A A . 20 ARG HH21 1 1 14 4844 1 1 20 ARG HH22 H 10.250 15.265 -2.086 1.00 . A A . 20 ARG HH22 1 1 14 4845 1 1 20 ARG N N 7.871 7.346 -2.276 1.00 . A A . 20 ARG N 1 1 14 4846 1 1 20 ARG NE N 9.272 12.333 -2.710 1.00 . A A . 20 ARG NE 1 1 14 4847 1 1 20 ARG NH1 N 8.323 14.298 -3.347 1.00 . A A . 20 ARG NH1 1 1 14 4848 1 1 20 ARG NH2 N 10.225 14.264 -2.095 1.00 . A A . 20 ARG NH2 1 1 14 4849 1 1 20 ARG O O 9.901 8.163 0.613 1.00 . A A . 20 ARG O 1 1 14 4850 1 1 21 CYS C C 8.456 5.321 2.010 1.00 . A A . 21 CYS C 1 1 14 4851 1 1 21 CYS CA C 7.841 6.721 1.827 1.00 . A A . 21 CYS CA 1 1 14 4852 1 1 21 CYS CB C 6.379 6.651 2.253 1.00 . A A . 21 CYS CB 1 1 14 4853 1 1 21 CYS H H 7.206 6.896 -0.223 1.00 . A A . 21 CYS H 1 1 14 4854 1 1 21 CYS HA H 8.383 7.423 2.442 1.00 . A A . 21 CYS HA 1 1 14 4855 1 1 21 CYS HB2 H 5.921 5.836 1.712 1.00 . A A . 21 CYS HB2 1 1 14 4856 1 1 21 CYS HB3 H 6.358 6.386 3.300 1.00 . A A . 21 CYS HB3 1 1 14 4857 1 1 21 CYS N N 7.930 7.140 0.390 1.00 . A A . 21 CYS N 1 1 14 4858 1 1 21 CYS O O 8.810 4.941 3.110 1.00 . A A . 21 CYS O 1 1 14 4859 1 1 21 CYS SG S 5.284 8.076 2.049 1.00 . A A . 21 CYS SG 1 1 14 4860 1 1 22 . C C 9.956 3.023 -0.339 1.00 . A A . 22 CY3 C 1 1 14 4861 1 1 22 . CA C 9.123 3.227 0.919 1.00 . A A . 22 CY3 CA 1 1 14 4862 1 1 22 . CB C 7.916 2.266 1.010 1.00 . A A . 22 CY3 CB 1 1 14 4863 1 1 22 . H H 8.263 4.984 0.060 1.00 . A A . 22 CY3 H 1 1 14 4864 1 1 22 . HA H 9.766 3.100 1.779 1.00 . A A . 22 CY3 HA 1 1 14 4865 1 1 22 . HB2 H 8.240 1.250 0.848 1.00 . A A . 22 CY3 HB2 1 1 14 4866 1 1 22 . HB3 H 7.219 2.512 0.221 1.00 . A A . 22 CY3 HB3 1 1 14 4867 1 1 22 . HN11 H 10.731 4.842 -0.203 1.00 . A A . 22 CY3 HN11 1 1 14 4868 1 1 22 . HN12 H 11.262 3.928 -1.525 1.00 . A A . 22 CY3 HN12 1 1 14 4869 1 1 22 . N N 8.558 4.608 0.917 1.00 . A A . 22 CY3 N 1 1 14 4870 1 1 22 . N1 N 10.715 4.011 -0.723 1.00 . A A . 22 CY3 N1 1 1 14 4871 1 1 22 . O O 9.930 1.991 -0.978 1.00 . A A . 22 CY3 O 1 1 14 4872 1 1 22 . SG S 7.021 2.377 2.580 1.00 . A A . 22 CY3 SG 1 1 15 4873 1 1 1 PCA C C -3.373 6.583 1.463 1.00 . A A . 1 PCA C 1 1 15 4874 1 1 1 PCA CA C -4.569 6.798 0.523 1.00 . A A . 1 PCA CA 1 1 15 4875 1 1 1 PCA CB C -4.214 6.552 -0.955 1.00 . A A . 1 PCA CB 1 1 15 4876 1 1 1 PCA CD C -4.998 8.790 -0.732 1.00 . A A . 1 PCA CD 1 1 15 4877 1 1 1 PCA CG C -4.155 7.920 -1.624 1.00 . A A . 1 PCA CG 1 1 15 4878 1 1 1 PCA HA H -5.373 6.135 0.810 1.00 . A A . 1 PCA HA 1 1 15 4879 1 1 1 PCA HB2 H -4.965 5.921 -1.406 1.00 . A A . 1 PCA HB2 1 1 15 4880 1 1 1 PCA HB3 H -3.268 6.035 -1.038 1.00 . A A . 1 PCA HB3 1 1 15 4881 1 1 1 PCA HG2 H -4.570 7.873 -2.620 1.00 . A A . 1 PCA HG2 1 1 15 4882 1 1 1 PCA HG3 H -3.138 8.282 -1.651 1.00 . A A . 1 PCA HG3 1 1 15 4883 1 1 1 PCA N N -5.069 8.186 0.595 1.00 . A A . 1 PCA N 1 1 15 4884 1 1 1 PCA O O -2.321 7.153 1.244 1.00 . A A . 1 PCA O 1 1 15 4885 1 1 1 PCA OE O -5.531 9.826 -1.072 1.00 . A A . 1 PCA OE 1 1 15 4886 1 1 2 ARG C C -2.214 3.949 3.482 1.00 . A A . 2 ARG C 1 1 15 4887 1 1 2 ARG CA C -2.531 5.457 3.469 1.00 . A A . 2 ARG CA 1 1 15 4888 1 1 2 ARG CB C -2.987 5.926 4.908 1.00 . A A . 2 ARG CB 1 1 15 4889 1 1 2 ARG CD C -5.581 6.041 4.783 1.00 . A A . 2 ARG CD 1 1 15 4890 1 1 2 ARG CG C -4.348 5.328 5.390 1.00 . A A . 2 ARG CG 1 1 15 4891 1 1 2 ARG CZ C -5.285 8.496 4.585 1.00 . A A . 2 ARG CZ 1 1 15 4892 1 1 2 ARG H H -4.474 5.354 2.556 1.00 . A A . 2 ARG H 1 1 15 4893 1 1 2 ARG HA H -1.621 5.980 3.206 1.00 . A A . 2 ARG HA 1 1 15 4894 1 1 2 ARG HB2 H -2.230 5.658 5.630 1.00 . A A . 2 ARG HB2 1 1 15 4895 1 1 2 ARG HB3 H -3.056 7.004 4.903 1.00 . A A . 2 ARG HB3 1 1 15 4896 1 1 2 ARG HD2 H -5.589 6.041 3.708 1.00 . A A . 2 ARG HD2 1 1 15 4897 1 1 2 ARG HD3 H -6.479 5.547 5.126 1.00 . A A . 2 ARG HD3 1 1 15 4898 1 1 2 ARG HE H -5.851 7.594 6.244 1.00 . A A . 2 ARG HE 1 1 15 4899 1 1 2 ARG HG2 H -4.399 4.282 5.131 1.00 . A A . 2 ARG HG2 1 1 15 4900 1 1 2 ARG HG3 H -4.397 5.403 6.467 1.00 . A A . 2 ARG HG3 1 1 15 4901 1 1 2 ARG HH11 H -4.905 7.477 2.902 1.00 . A A . 2 ARG HH11 1 1 15 4902 1 1 2 ARG HH12 H -4.701 9.190 2.803 1.00 . A A . 2 ARG HH12 1 1 15 4903 1 1 2 ARG HH21 H -5.599 9.744 6.118 1.00 . A A . 2 ARG HH21 1 1 15 4904 1 1 2 ARG HH22 H -5.100 10.488 4.636 1.00 . A A . 2 ARG HH22 1 1 15 4905 1 1 2 ARG N N -3.593 5.770 2.467 1.00 . A A . 2 ARG N 1 1 15 4906 1 1 2 ARG NE N -5.597 7.448 5.309 1.00 . A A . 2 ARG NE 1 1 15 4907 1 1 2 ARG NH1 N -4.937 8.376 3.334 1.00 . A A . 2 ARG NH1 1 1 15 4908 1 1 2 ARG NH2 N -5.332 9.667 5.158 1.00 . A A . 2 ARG NH2 1 1 15 4909 1 1 2 ARG O O -2.187 3.315 4.518 1.00 . A A . 2 ARG O 1 1 15 4910 1 1 3 LEU C C -0.116 1.842 2.278 1.00 . A A . 3 LEU C 1 1 15 4911 1 1 3 LEU CA C -1.652 1.962 2.166 1.00 . A A . 3 LEU CA 1 1 15 4912 1 1 3 LEU CB C -2.221 1.518 0.783 1.00 . A A . 3 LEU CB 1 1 15 4913 1 1 3 LEU CD1 C -2.831 -0.845 1.541 1.00 . A A . 3 LEU CD1 1 1 15 4914 1 1 3 LEU CD2 C -2.588 -0.329 -0.906 1.00 . A A . 3 LEU CD2 1 1 15 4915 1 1 3 LEU CG C -2.054 -0.009 0.505 1.00 . A A . 3 LEU CG 1 1 15 4916 1 1 3 LEU H H -2.011 3.984 1.510 1.00 . A A . 3 LEU H 1 1 15 4917 1 1 3 LEU HA H -2.104 1.413 2.976 1.00 . A A . 3 LEU HA 1 1 15 4918 1 1 3 LEU HB2 H -3.272 1.770 0.748 1.00 . A A . 3 LEU HB2 1 1 15 4919 1 1 3 LEU HB3 H -1.727 2.082 0.004 1.00 . A A . 3 LEU HB3 1 1 15 4920 1 1 3 LEU HD11 H -2.450 -0.646 2.527 1.00 . A A . 3 LEU HD11 1 1 15 4921 1 1 3 LEU HD12 H -2.718 -1.899 1.336 1.00 . A A . 3 LEU HD12 1 1 15 4922 1 1 3 LEU HD13 H -3.883 -0.600 1.514 1.00 . A A . 3 LEU HD13 1 1 15 4923 1 1 3 LEU HD21 H -3.633 -0.065 -0.987 1.00 . A A . 3 LEU HD21 1 1 15 4924 1 1 3 LEU HD22 H -2.482 -1.385 -1.111 1.00 . A A . 3 LEU HD22 1 1 15 4925 1 1 3 LEU HD23 H -2.032 0.227 -1.645 1.00 . A A . 3 LEU HD23 1 1 15 4926 1 1 3 LEU HG H -1.012 -0.289 0.542 1.00 . A A . 3 LEU HG 1 1 15 4927 1 1 3 LEU N N -1.977 3.418 2.309 1.00 . A A . 3 LEU N 1 1 15 4928 1 1 3 LEU O O 0.420 2.088 3.340 1.00 . A A . 3 LEU O 1 1 15 4929 1 1 4 CYS C C 2.817 2.300 1.957 1.00 . A A . 4 CYS C 1 1 15 4930 1 1 4 CYS CA C 2.013 1.309 1.110 1.00 . A A . 4 CYS CA 1 1 15 4931 1 1 4 CYS CB C 2.458 1.493 -0.336 1.00 . A A . 4 CYS CB 1 1 15 4932 1 1 4 CYS H H 0.015 1.272 0.399 1.00 . A A . 4 CYS H 1 1 15 4933 1 1 4 CYS HA H 2.300 0.317 1.407 1.00 . A A . 4 CYS HA 1 1 15 4934 1 1 4 CYS HB2 H 2.278 2.512 -0.613 1.00 . A A . 4 CYS HB2 1 1 15 4935 1 1 4 CYS HB3 H 3.530 1.384 -0.346 1.00 . A A . 4 CYS HB3 1 1 15 4936 1 1 4 CYS N N 0.529 1.471 1.200 1.00 . A A . 4 CYS N 1 1 15 4937 1 1 4 CYS O O 3.610 1.915 2.793 1.00 . A A . 4 CYS O 1 1 15 4938 1 1 4 CYS SG S 1.815 0.515 -1.716 1.00 . A A . 4 CYS SG 1 1 15 4939 1 1 5 CYS C C 2.667 4.877 3.813 1.00 . A A . 5 CYS C 1 1 15 4940 1 1 5 CYS CA C 3.278 4.638 2.429 1.00 . A A . 5 CYS CA 1 1 15 4941 1 1 5 CYS CB C 3.209 5.900 1.548 1.00 . A A . 5 CYS CB 1 1 15 4942 1 1 5 CYS H H 1.889 3.777 1.022 1.00 . A A . 5 CYS H 1 1 15 4943 1 1 5 CYS HA H 4.301 4.330 2.553 1.00 . A A . 5 CYS HA 1 1 15 4944 1 1 5 CYS HB2 H 3.376 5.594 0.525 1.00 . A A . 5 CYS HB2 1 1 15 4945 1 1 5 CYS HB3 H 2.202 6.288 1.603 1.00 . A A . 5 CYS HB3 1 1 15 4946 1 1 5 CYS N N 2.562 3.556 1.699 1.00 . A A . 5 CYS N 1 1 15 4947 1 1 5 CYS O O 3.383 5.124 4.765 1.00 . A A . 5 CYS O 1 1 15 4948 1 1 5 CYS SG S 4.334 7.284 1.875 1.00 . A A . 5 CYS SG 1 1 15 4949 1 1 6 GLY C C 1.171 4.039 6.270 1.00 . A A . 6 GLY C 1 1 15 4950 1 1 6 GLY CA C 0.666 5.011 5.199 1.00 . A A . 6 GLY CA 1 1 15 4951 1 1 6 GLY H H 0.835 4.588 3.091 1.00 . A A . 6 GLY H 1 1 15 4952 1 1 6 GLY HA2 H 0.832 6.027 5.526 1.00 . A A . 6 GLY HA2 1 1 15 4953 1 1 6 GLY HA3 H -0.388 4.852 5.063 1.00 . A A . 6 GLY HA3 1 1 15 4954 1 1 6 GLY N N 1.361 4.794 3.893 1.00 . A A . 6 GLY N 1 1 15 4955 1 1 6 GLY O O 1.227 4.378 7.436 1.00 . A A . 6 GLY O 1 1 15 4956 1 1 7 PHE C C 2.833 0.695 6.043 1.00 . A A . 7 PHE C 1 1 15 4957 1 1 7 PHE CA C 2.033 1.810 6.755 1.00 . A A . 7 PHE CA 1 1 15 4958 1 1 7 PHE CB C 0.818 1.217 7.542 1.00 . A A . 7 PHE CB 1 1 15 4959 1 1 7 PHE CD1 C -0.205 -0.390 5.832 1.00 . A A . 7 PHE CD1 1 1 15 4960 1 1 7 PHE CD2 C -1.562 1.360 6.703 1.00 . A A . 7 PHE CD2 1 1 15 4961 1 1 7 PHE CE1 C -1.265 -0.830 5.068 1.00 . A A . 7 PHE CE1 1 1 15 4962 1 1 7 PHE CE2 C -2.622 0.920 5.940 1.00 . A A . 7 PHE CE2 1 1 15 4963 1 1 7 PHE CG C -0.341 0.709 6.659 1.00 . A A . 7 PHE CG 1 1 15 4964 1 1 7 PHE CZ C -2.476 -0.176 5.122 1.00 . A A . 7 PHE CZ 1 1 15 4965 1 1 7 PHE H H 1.452 2.659 4.874 1.00 . A A . 7 PHE H 1 1 15 4966 1 1 7 PHE HA H 2.685 2.305 7.457 1.00 . A A . 7 PHE HA 1 1 15 4967 1 1 7 PHE HB2 H 1.162 0.388 8.145 1.00 . A A . 7 PHE HB2 1 1 15 4968 1 1 7 PHE HB3 H 0.435 1.971 8.214 1.00 . A A . 7 PHE HB3 1 1 15 4969 1 1 7 PHE HD1 H 0.734 -0.914 5.783 1.00 . A A . 7 PHE HD1 1 1 15 4970 1 1 7 PHE HD2 H -1.690 2.222 7.340 1.00 . A A . 7 PHE HD2 1 1 15 4971 1 1 7 PHE HE1 H -1.148 -1.690 4.426 1.00 . A A . 7 PHE HE1 1 1 15 4972 1 1 7 PHE HE2 H -3.570 1.437 5.984 1.00 . A A . 7 PHE HE2 1 1 15 4973 1 1 7 PHE HZ H -3.310 -0.518 4.528 1.00 . A A . 7 PHE HZ 1 1 15 4974 1 1 7 PHE N N 1.522 2.857 5.828 1.00 . A A . 7 PHE N 1 1 15 4975 1 1 7 PHE O O 2.503 0.268 4.948 1.00 . A A . 7 PHE O 1 1 15 4976 1 1 8 HYP C C 4.330 -2.022 5.763 1.00 . A A . 8 HYP C 1 1 15 4977 1 1 8 HYP CA C 4.888 -0.634 6.101 1.00 . A A . 8 HYP CA 1 1 15 4978 1 1 8 HYP CB C 6.023 -0.678 7.116 1.00 . A A . 8 HYP CB 1 1 15 4979 1 1 8 HYP CD C 4.229 0.527 8.122 1.00 . A A . 8 HYP CD 1 1 15 4980 1 1 8 HYP CG C 5.334 -0.456 8.417 1.00 . A A . 8 HYP CG 1 1 15 4981 1 1 8 HYP HA H 5.271 -0.192 5.193 1.00 . A A . 8 HYP HA 1 1 15 4982 1 1 8 HYP HB2 H 6.748 0.094 6.900 1.00 . A A . 8 HYP HB2 1 1 15 4983 1 1 8 HYP HB3 H 6.533 -1.630 7.085 1.00 . A A . 8 HYP HB3 1 1 15 4984 1 1 8 HYP HD1 H 6.005 -0.290 10.235 1.00 . A A . 8 HYP HD1 1 1 15 4985 1 1 8 HYP HD22 H 4.583 1.541 8.243 1.00 . A A . 8 HYP HD22 1 1 15 4986 1 1 8 HYP HD23 H 3.389 0.339 8.775 1.00 . A A . 8 HYP HD23 1 1 15 4987 1 1 8 HYP HG H 4.917 -1.387 8.772 1.00 . A A . 8 HYP HG 1 1 15 4988 1 1 8 HYP N N 3.879 0.250 6.709 1.00 . A A . 8 HYP N 1 1 15 4989 1 1 8 HYP O O 5.029 -2.811 5.155 1.00 . A A . 8 HYP O 1 1 15 4990 1 1 8 HYP OD1 O 6.244 0.065 9.375 1.00 . A A . 8 HYP OD1 1 1 15 4991 1 1 9 LYS C C 2.399 -3.765 4.359 1.00 . A A . 9 LYS C 1 1 15 4992 1 1 9 LYS CA C 2.481 -3.591 5.878 1.00 . A A . 9 LYS CA 1 1 15 4993 1 1 9 LYS CB C 1.066 -3.652 6.503 1.00 . A A . 9 LYS CB 1 1 15 4994 1 1 9 LYS CD C -0.991 -5.148 6.862 1.00 . A A . 9 LYS CD 1 1 15 4995 1 1 9 LYS CE C -1.949 -4.068 6.311 1.00 . A A . 9 LYS CE 1 1 15 4996 1 1 9 LYS CG C 0.420 -5.039 6.225 1.00 . A A . 9 LYS CG 1 1 15 4997 1 1 9 LYS H H 2.595 -1.583 6.648 1.00 . A A . 9 LYS H 1 1 15 4998 1 1 9 LYS HA H 3.108 -4.367 6.294 1.00 . A A . 9 LYS HA 1 1 15 4999 1 1 9 LYS HB2 H 1.123 -3.479 7.568 1.00 . A A . 9 LYS HB2 1 1 15 5000 1 1 9 LYS HB3 H 0.452 -2.888 6.059 1.00 . A A . 9 LYS HB3 1 1 15 5001 1 1 9 LYS HD2 H -1.400 -6.124 6.646 1.00 . A A . 9 LYS HD2 1 1 15 5002 1 1 9 LYS HD3 H -0.911 -5.048 7.934 1.00 . A A . 9 LYS HD3 1 1 15 5003 1 1 9 LYS HE2 H -2.933 -4.213 6.729 1.00 . A A . 9 LYS HE2 1 1 15 5004 1 1 9 LYS HE3 H -1.610 -3.077 6.570 1.00 . A A . 9 LYS HE3 1 1 15 5005 1 1 9 LYS HG2 H 0.333 -5.199 5.161 1.00 . A A . 9 LYS HG2 1 1 15 5006 1 1 9 LYS HG3 H 1.051 -5.817 6.632 1.00 . A A . 9 LYS HG3 1 1 15 5007 1 1 9 LYS HZ1 H -1.159 -3.864 4.397 1.00 . A A . 9 LYS HZ1 1 1 15 5008 1 1 9 LYS HZ2 H -2.830 -3.574 4.488 1.00 . A A . 9 LYS HZ2 1 1 15 5009 1 1 9 LYS HZ3 H -2.239 -5.164 4.566 1.00 . A A . 9 LYS HZ3 1 1 15 5010 1 1 9 LYS N N 3.104 -2.267 6.164 1.00 . A A . 9 LYS N 1 1 15 5011 1 1 9 LYS NZ N -2.053 -4.175 4.828 1.00 . A A . 9 LYS NZ 1 1 15 5012 1 1 9 LYS O O 2.622 -4.860 3.879 1.00 . A A . 9 LYS O 1 1 15 5013 1 1 10 SER C C 3.379 -2.635 1.478 1.00 . A A . 10 SER C 1 1 15 5014 1 1 10 SER CA C 2.011 -2.863 2.157 1.00 . A A . 10 SER CA 1 1 15 5015 1 1 10 SER CB C 0.931 -1.881 1.665 1.00 . A A . 10 SER CB 1 1 15 5016 1 1 10 SER H H 1.913 -1.816 4.030 1.00 . A A . 10 SER H 1 1 15 5017 1 1 10 SER HA H 1.686 -3.868 1.920 1.00 . A A . 10 SER HA 1 1 15 5018 1 1 10 SER HB2 H 1.058 -0.908 2.102 1.00 . A A . 10 SER HB2 1 1 15 5019 1 1 10 SER HB3 H 0.860 -1.826 0.588 1.00 . A A . 10 SER HB3 1 1 15 5020 1 1 10 SER HG H -0.105 -2.653 3.119 1.00 . A A . 10 SER HG 1 1 15 5021 1 1 10 SER N N 2.091 -2.705 3.639 1.00 . A A . 10 SER N 1 1 15 5022 1 1 10 SER O O 3.556 -3.057 0.354 1.00 . A A . 10 SER O 1 1 15 5023 1 1 10 SER OG O -0.271 -2.410 2.205 1.00 . A A . 10 SER OG 1 1 15 5024 1 1 11 CYS C C 6.445 -2.996 1.098 1.00 . A A . 11 CYS C 1 1 15 5025 1 1 11 CYS CA C 5.670 -1.742 1.555 1.00 . A A . 11 CYS CA 1 1 15 5026 1 1 11 CYS CB C 6.545 -0.968 2.570 1.00 . A A . 11 CYS CB 1 1 15 5027 1 1 11 CYS H H 4.115 -1.675 3.063 1.00 . A A . 11 CYS H 1 1 15 5028 1 1 11 CYS HA H 5.540 -1.106 0.693 1.00 . A A . 11 CYS HA 1 1 15 5029 1 1 11 CYS HB2 H 6.452 -1.456 3.528 1.00 . A A . 11 CYS HB2 1 1 15 5030 1 1 11 CYS HB3 H 7.579 -1.047 2.269 1.00 . A A . 11 CYS HB3 1 1 15 5031 1 1 11 CYS N N 4.309 -1.994 2.155 1.00 . A A . 11 CYS N 1 1 15 5032 1 1 11 CYS O O 7.502 -2.870 0.508 1.00 . A A . 11 CYS O 1 1 15 5033 1 1 11 CYS SG S 6.215 0.794 2.828 1.00 . A A . 11 CYS SG 1 1 15 5034 1 1 12 ARG C C 6.358 -5.683 -0.547 1.00 . A A . 12 ARG C 1 1 15 5035 1 1 12 ARG CA C 6.609 -5.429 0.955 1.00 . A A . 12 ARG CA 1 1 15 5036 1 1 12 ARG CB C 6.046 -6.588 1.814 1.00 . A A . 12 ARG CB 1 1 15 5037 1 1 12 ARG CD C 6.182 -9.058 2.325 1.00 . A A . 12 ARG CD 1 1 15 5038 1 1 12 ARG CG C 6.729 -7.925 1.439 1.00 . A A . 12 ARG CG 1 1 15 5039 1 1 12 ARG CZ C 8.059 -10.639 2.133 1.00 . A A . 12 ARG CZ 1 1 15 5040 1 1 12 ARG H H 5.060 -4.215 1.842 1.00 . A A . 12 ARG H 1 1 15 5041 1 1 12 ARG HA H 7.671 -5.326 1.122 1.00 . A A . 12 ARG HA 1 1 15 5042 1 1 12 ARG HB2 H 6.211 -6.377 2.859 1.00 . A A . 12 ARG HB2 1 1 15 5043 1 1 12 ARG HB3 H 4.982 -6.672 1.647 1.00 . A A . 12 ARG HB3 1 1 15 5044 1 1 12 ARG HD2 H 6.416 -8.886 3.366 1.00 . A A . 12 ARG HD2 1 1 15 5045 1 1 12 ARG HD3 H 5.110 -9.140 2.211 1.00 . A A . 12 ARG HD3 1 1 15 5046 1 1 12 ARG HE H 6.262 -10.989 1.383 1.00 . A A . 12 ARG HE 1 1 15 5047 1 1 12 ARG HG2 H 6.534 -8.180 0.409 1.00 . A A . 12 ARG HG2 1 1 15 5048 1 1 12 ARG HG3 H 7.797 -7.835 1.576 1.00 . A A . 12 ARG HG3 1 1 15 5049 1 1 12 ARG HH11 H 8.455 -8.940 3.118 1.00 . A A . 12 ARG HH11 1 1 15 5050 1 1 12 ARG HH12 H 9.775 -10.052 2.979 1.00 . A A . 12 ARG HH12 1 1 15 5051 1 1 12 ARG HH21 H 7.909 -12.399 1.193 1.00 . A A . 12 ARG HH21 1 1 15 5052 1 1 12 ARG HH22 H 9.462 -12.040 1.871 1.00 . A A . 12 ARG HH22 1 1 15 5053 1 1 12 ARG N N 5.916 -4.165 1.368 1.00 . A A . 12 ARG N 1 1 15 5054 1 1 12 ARG NE N 6.807 -10.344 1.882 1.00 . A A . 12 ARG NE 1 1 15 5055 1 1 12 ARG NH1 N 8.822 -9.812 2.795 1.00 . A A . 12 ARG NH1 1 1 15 5056 1 1 12 ARG NH2 N 8.513 -11.782 1.699 1.00 . A A . 12 ARG NH2 1 1 15 5057 1 1 12 ARG O O 7.040 -6.474 -1.170 1.00 . A A . 12 ARG O 1 1 15 5058 1 1 13 SER C C 5.986 -4.334 -3.412 1.00 . A A . 13 SER C 1 1 15 5059 1 1 13 SER CA C 5.022 -5.130 -2.521 1.00 . A A . 13 SER CA 1 1 15 5060 1 1 13 SER CB C 3.582 -4.623 -2.701 1.00 . A A . 13 SER CB 1 1 15 5061 1 1 13 SER H H 4.879 -4.364 -0.522 1.00 . A A . 13 SER H 1 1 15 5062 1 1 13 SER HA H 5.070 -6.175 -2.791 1.00 . A A . 13 SER HA 1 1 15 5063 1 1 13 SER HB2 H 2.886 -5.213 -2.123 1.00 . A A . 13 SER HB2 1 1 15 5064 1 1 13 SER HB3 H 3.492 -3.581 -2.435 1.00 . A A . 13 SER HB3 1 1 15 5065 1 1 13 SER HG H 3.379 -5.717 -4.297 1.00 . A A . 13 SER HG 1 1 15 5066 1 1 13 SER N N 5.383 -4.991 -1.080 1.00 . A A . 13 SER N 1 1 15 5067 1 1 13 SER O O 6.357 -3.223 -3.086 1.00 . A A . 13 SER O 1 1 15 5068 1 1 13 SER OG O 3.303 -4.784 -4.085 1.00 . A A . 13 SER OG 1 1 15 5069 1 1 14 ARG C C 6.695 -2.968 -5.952 1.00 . A A . 14 ARG C 1 1 15 5070 1 1 14 ARG CA C 7.287 -4.314 -5.501 1.00 . A A . 14 ARG CA 1 1 15 5071 1 1 14 ARG CB C 7.441 -5.288 -6.691 1.00 . A A . 14 ARG CB 1 1 15 5072 1 1 14 ARG CD C 8.552 -5.720 -8.923 1.00 . A A . 14 ARG CD 1 1 15 5073 1 1 14 ARG CG C 8.422 -4.724 -7.749 1.00 . A A . 14 ARG CG 1 1 15 5074 1 1 14 ARG CZ C 7.050 -6.605 -10.651 1.00 . A A . 14 ARG CZ 1 1 15 5075 1 1 14 ARG H H 6.005 -5.844 -4.693 1.00 . A A . 14 ARG H 1 1 15 5076 1 1 14 ARG HA H 8.244 -4.141 -5.035 1.00 . A A . 14 ARG HA 1 1 15 5077 1 1 14 ARG HB2 H 7.818 -6.232 -6.326 1.00 . A A . 14 ARG HB2 1 1 15 5078 1 1 14 ARG HB3 H 6.473 -5.461 -7.140 1.00 . A A . 14 ARG HB3 1 1 15 5079 1 1 14 ARG HD2 H 9.255 -5.347 -9.655 1.00 . A A . 14 ARG HD2 1 1 15 5080 1 1 14 ARG HD3 H 8.888 -6.683 -8.568 1.00 . A A . 14 ARG HD3 1 1 15 5081 1 1 14 ARG HE H 6.432 -5.434 -9.178 1.00 . A A . 14 ARG HE 1 1 15 5082 1 1 14 ARG HG2 H 8.063 -3.777 -8.125 1.00 . A A . 14 ARG HG2 1 1 15 5083 1 1 14 ARG HG3 H 9.394 -4.571 -7.301 1.00 . A A . 14 ARG HG3 1 1 15 5084 1 1 14 ARG HH11 H 8.978 -7.137 -10.798 1.00 . A A . 14 ARG HH11 1 1 15 5085 1 1 14 ARG HH12 H 7.931 -7.764 -12.026 1.00 . A A . 14 ARG HH12 1 1 15 5086 1 1 14 ARG HH21 H 5.088 -6.217 -10.717 1.00 . A A . 14 ARG HH21 1 1 15 5087 1 1 14 ARG HH22 H 5.693 -7.237 -11.980 1.00 . A A . 14 ARG HH22 1 1 15 5088 1 1 14 ARG N N 6.352 -4.946 -4.512 1.00 . A A . 14 ARG N 1 1 15 5089 1 1 14 ARG NE N 7.210 -5.880 -9.570 1.00 . A A . 14 ARG NE 1 1 15 5090 1 1 14 ARG NH1 N 8.067 -7.216 -11.200 1.00 . A A . 14 ARG NH1 1 1 15 5091 1 1 14 ARG NH2 N 5.850 -6.694 -11.155 1.00 . A A . 14 ARG NH2 1 1 15 5092 1 1 14 ARG O O 7.405 -2.006 -6.169 1.00 . A A . 14 ARG O 1 1 15 5093 1 1 15 GLN C C 4.715 -0.662 -5.414 1.00 . A A . 15 GLN C 1 1 15 5094 1 1 15 GLN CA C 4.632 -1.757 -6.494 1.00 . A A . 15 GLN CA 1 1 15 5095 1 1 15 GLN CB C 3.173 -2.188 -6.740 1.00 . A A . 15 GLN CB 1 1 15 5096 1 1 15 GLN CD C 0.884 -1.471 -7.457 1.00 . A A . 15 GLN CD 1 1 15 5097 1 1 15 GLN CG C 2.318 -0.991 -7.205 1.00 . A A . 15 GLN CG 1 1 15 5098 1 1 15 GLN H H 4.897 -3.794 -5.873 1.00 . A A . 15 GLN H 1 1 15 5099 1 1 15 GLN HA H 5.064 -1.383 -7.411 1.00 . A A . 15 GLN HA 1 1 15 5100 1 1 15 GLN HB2 H 3.153 -2.960 -7.496 1.00 . A A . 15 GLN HB2 1 1 15 5101 1 1 15 GLN HB3 H 2.762 -2.595 -5.828 1.00 . A A . 15 GLN HB3 1 1 15 5102 1 1 15 GLN HE21 H 0.613 -2.037 -5.573 1.00 . A A . 15 GLN HE21 1 1 15 5103 1 1 15 GLN HE22 H -0.716 -2.283 -6.602 1.00 . A A . 15 GLN HE22 1 1 15 5104 1 1 15 GLN HG2 H 2.291 -0.222 -6.448 1.00 . A A . 15 GLN HG2 1 1 15 5105 1 1 15 GLN HG3 H 2.717 -0.576 -8.119 1.00 . A A . 15 GLN HG3 1 1 15 5106 1 1 15 GLN N N 5.391 -2.970 -6.069 1.00 . A A . 15 GLN N 1 1 15 5107 1 1 15 GLN NE2 N 0.202 -1.972 -6.461 1.00 . A A . 15 GLN NE2 1 1 15 5108 1 1 15 GLN O O 4.681 0.512 -5.730 1.00 . A A . 15 GLN O 1 1 15 5109 1 1 15 GLN OE1 O 0.371 -1.394 -8.555 1.00 . A A . 15 GLN OE1 1 1 15 5110 1 1 16 CYS C C 6.304 0.485 -2.795 1.00 . A A . 16 CYS C 1 1 15 5111 1 1 16 CYS CA C 4.909 -0.108 -3.043 1.00 . A A . 16 CYS CA 1 1 15 5112 1 1 16 CYS CB C 4.464 -0.767 -1.745 1.00 . A A . 16 CYS CB 1 1 15 5113 1 1 16 CYS H H 4.841 -2.042 -3.991 1.00 . A A . 16 CYS H 1 1 15 5114 1 1 16 CYS HA H 4.228 0.701 -3.244 1.00 . A A . 16 CYS HA 1 1 15 5115 1 1 16 CYS HB2 H 5.057 -1.644 -1.586 1.00 . A A . 16 CYS HB2 1 1 15 5116 1 1 16 CYS HB3 H 4.709 -0.094 -0.940 1.00 . A A . 16 CYS HB3 1 1 15 5117 1 1 16 CYS N N 4.820 -1.081 -4.176 1.00 . A A . 16 CYS N 1 1 15 5118 1 1 16 CYS O O 6.406 1.581 -2.279 1.00 . A A . 16 CYS O 1 1 15 5119 1 1 16 CYS SG S 2.743 -1.259 -1.495 1.00 . A A . 16 CYS SG 1 1 15 5120 1 1 17 LYS C C 8.982 1.694 -3.531 1.00 . A A . 17 LYS C 1 1 15 5121 1 1 17 LYS CA C 8.729 0.282 -2.938 1.00 . A A . 17 LYS CA 1 1 15 5122 1 1 17 LYS CB C 9.727 -0.730 -3.548 1.00 . A A . 17 LYS CB 1 1 15 5123 1 1 17 LYS CD C 10.526 -3.129 -3.407 1.00 . A A . 17 LYS CD 1 1 15 5124 1 1 17 LYS CE C 10.349 -4.473 -2.666 1.00 . A A . 17 LYS CE 1 1 15 5125 1 1 17 LYS CG C 9.566 -2.077 -2.814 1.00 . A A . 17 LYS CG 1 1 15 5126 1 1 17 LYS H H 7.195 -1.118 -3.558 1.00 . A A . 17 LYS H 1 1 15 5127 1 1 17 LYS HA H 8.899 0.337 -1.871 1.00 . A A . 17 LYS HA 1 1 15 5128 1 1 17 LYS HB2 H 9.541 -0.861 -4.604 1.00 . A A . 17 LYS HB2 1 1 15 5129 1 1 17 LYS HB3 H 10.736 -0.366 -3.416 1.00 . A A . 17 LYS HB3 1 1 15 5130 1 1 17 LYS HD2 H 10.327 -3.267 -4.459 1.00 . A A . 17 LYS HD2 1 1 15 5131 1 1 17 LYS HD3 H 11.546 -2.792 -3.291 1.00 . A A . 17 LYS HD3 1 1 15 5132 1 1 17 LYS HE2 H 11.002 -5.218 -3.096 1.00 . A A . 17 LYS HE2 1 1 15 5133 1 1 17 LYS HE3 H 10.588 -4.361 -1.617 1.00 . A A . 17 LYS HE3 1 1 15 5134 1 1 17 LYS HG2 H 9.777 -1.946 -1.763 1.00 . A A . 17 LYS HG2 1 1 15 5135 1 1 17 LYS HG3 H 8.549 -2.414 -2.917 1.00 . A A . 17 LYS HG3 1 1 15 5136 1 1 17 LYS HZ1 H 8.594 -5.242 -1.851 1.00 . A A . 17 LYS HZ1 1 1 15 5137 1 1 17 LYS HZ2 H 8.909 -5.772 -3.434 1.00 . A A . 17 LYS HZ2 1 1 15 5138 1 1 17 LYS HZ3 H 8.345 -4.197 -3.161 1.00 . A A . 17 LYS HZ3 1 1 15 5139 1 1 17 LYS N N 7.336 -0.236 -3.152 1.00 . A A . 17 LYS N 1 1 15 5140 1 1 17 LYS NZ N 8.945 -4.958 -2.786 1.00 . A A . 17 LYS NZ 1 1 15 5141 1 1 17 LYS O O 9.593 2.503 -2.863 1.00 . A A . 17 LYS O 1 1 15 5142 1 1 18 HYP C C 7.810 4.434 -4.592 1.00 . A A . 18 HYP C 1 1 15 5143 1 1 18 HYP CA C 8.642 3.341 -5.314 1.00 . A A . 18 HYP CA 1 1 15 5144 1 1 18 HYP CB C 8.243 3.155 -6.781 1.00 . A A . 18 HYP CB 1 1 15 5145 1 1 18 HYP CD C 7.883 1.068 -5.704 1.00 . A A . 18 HYP CD 1 1 15 5146 1 1 18 HYP CG C 7.327 1.985 -6.751 1.00 . A A . 18 HYP CG 1 1 15 5147 1 1 18 HYP HA H 9.674 3.665 -5.306 1.00 . A A . 18 HYP HA 1 1 15 5148 1 1 18 HYP HB2 H 9.121 2.969 -7.382 1.00 . A A . 18 HYP HB2 1 1 15 5149 1 1 18 HYP HB3 H 7.755 4.035 -7.173 1.00 . A A . 18 HYP HB3 1 1 15 5150 1 1 18 HYP HD1 H 6.861 0.483 -7.894 1.00 . A A . 18 HYP HD1 1 1 15 5151 1 1 18 HYP HD22 H 8.606 0.394 -6.139 1.00 . A A . 18 HYP HD22 1 1 15 5152 1 1 18 HYP HD23 H 7.076 0.518 -5.260 1.00 . A A . 18 HYP HD23 1 1 15 5153 1 1 18 HYP HG H 6.333 2.311 -6.479 1.00 . A A . 18 HYP HG 1 1 15 5154 1 1 18 HYP N N 8.532 1.980 -4.736 1.00 . A A . 18 HYP N 1 1 15 5155 1 1 18 HYP O O 7.617 5.491 -5.162 1.00 . A A . 18 HYP O 1 1 15 5156 1 1 18 HYP OD1 O 7.293 1.332 -8.012 1.00 . A A . 18 HYP OD1 1 1 15 5157 1 1 19 HIS C C 7.442 6.019 -1.730 1.00 . A A . 19 HIS C 1 1 15 5158 1 1 19 HIS CA C 6.542 5.192 -2.647 1.00 . A A . 19 HIS CA 1 1 15 5159 1 1 19 HIS CB C 5.453 4.482 -1.819 1.00 . A A . 19 HIS CB 1 1 15 5160 1 1 19 HIS CD2 C 4.554 3.170 -3.970 1.00 . A A . 19 HIS CD2 1 1 15 5161 1 1 19 HIS CE1 C 2.540 3.210 -3.495 1.00 . A A . 19 HIS CE1 1 1 15 5162 1 1 19 HIS CG C 4.424 3.835 -2.759 1.00 . A A . 19 HIS CG 1 1 15 5163 1 1 19 HIS H H 7.534 3.302 -2.962 1.00 . A A . 19 HIS H 1 1 15 5164 1 1 19 HIS HA H 6.071 5.858 -3.355 1.00 . A A . 19 HIS HA 1 1 15 5165 1 1 19 HIS HB2 H 5.890 3.720 -1.194 1.00 . A A . 19 HIS HB2 1 1 15 5166 1 1 19 HIS HB3 H 4.941 5.195 -1.190 1.00 . A A . 19 HIS HB3 1 1 15 5167 1 1 19 HIS HD1 H 2.719 4.212 -1.747 1.00 . A A . 19 HIS HD1 1 1 15 5168 1 1 19 HIS HD2 H 5.484 2.985 -4.484 1.00 . A A . 19 HIS HD2 1 1 15 5169 1 1 19 HIS HE1 H 1.471 3.065 -3.538 1.00 . A A . 19 HIS HE1 1 1 15 5170 1 1 19 HIS N N 7.351 4.166 -3.389 1.00 . A A . 19 HIS N 1 1 15 5171 1 1 19 HIS ND1 N 3.153 3.819 -2.533 1.00 . A A . 19 HIS ND1 1 1 15 5172 1 1 19 HIS NE2 N 3.373 2.788 -4.413 1.00 . A A . 19 HIS NE2 1 1 15 5173 1 1 19 HIS O O 8.448 5.540 -1.250 1.00 . A A . 19 HIS O 1 1 15 5174 1 1 20 ARG C C 8.220 7.685 0.741 1.00 . A A . 20 ARG C 1 1 15 5175 1 1 20 ARG CA C 7.800 8.202 -0.648 1.00 . A A . 20 ARG CA 1 1 15 5176 1 1 20 ARG CB C 6.939 9.475 -0.469 1.00 . A A . 20 ARG CB 1 1 15 5177 1 1 20 ARG CD C 7.944 10.695 -2.498 1.00 . A A . 20 ARG CD 1 1 15 5178 1 1 20 ARG CG C 6.649 10.173 -1.830 1.00 . A A . 20 ARG CG 1 1 15 5179 1 1 20 ARG CZ C 9.696 11.503 -0.944 1.00 . A A . 20 ARG CZ 1 1 15 5180 1 1 20 ARG H H 6.210 7.546 -1.942 1.00 . A A . 20 ARG H 1 1 15 5181 1 1 20 ARG HA H 8.704 8.455 -1.176 1.00 . A A . 20 ARG HA 1 1 15 5182 1 1 20 ARG HB2 H 5.998 9.205 -0.012 1.00 . A A . 20 ARG HB2 1 1 15 5183 1 1 20 ARG HB3 H 7.443 10.166 0.190 1.00 . A A . 20 ARG HB3 1 1 15 5184 1 1 20 ARG HD2 H 8.634 9.896 -2.721 1.00 . A A . 20 ARG HD2 1 1 15 5185 1 1 20 ARG HD3 H 7.691 11.189 -3.425 1.00 . A A . 20 ARG HD3 1 1 15 5186 1 1 20 ARG HE H 8.114 12.566 -1.457 1.00 . A A . 20 ARG HE 1 1 15 5187 1 1 20 ARG HG2 H 6.160 9.483 -2.500 1.00 . A A . 20 ARG HG2 1 1 15 5188 1 1 20 ARG HG3 H 5.981 11.004 -1.662 1.00 . A A . 20 ARG HG3 1 1 15 5189 1 1 20 ARG HH11 H 10.026 9.653 -1.659 1.00 . A A . 20 ARG HH11 1 1 15 5190 1 1 20 ARG HH12 H 11.213 10.260 -0.559 1.00 . A A . 20 ARG HH12 1 1 15 5191 1 1 20 ARG HH21 H 9.616 13.311 -0.090 1.00 . A A . 20 ARG HH21 1 1 15 5192 1 1 20 ARG HH22 H 10.988 12.340 0.332 1.00 . A A . 20 ARG HH22 1 1 15 5193 1 1 20 ARG N N 7.039 7.244 -1.516 1.00 . A A . 20 ARG N 1 1 15 5194 1 1 20 ARG NE N 8.569 11.708 -1.585 1.00 . A A . 20 ARG NE 1 1 15 5195 1 1 20 ARG NH1 N 10.360 10.384 -1.066 1.00 . A A . 20 ARG NH1 1 1 15 5196 1 1 20 ARG NH2 N 10.134 12.459 -0.174 1.00 . A A . 20 ARG NH2 1 1 15 5197 1 1 20 ARG O O 9.229 8.125 1.259 1.00 . A A . 20 ARG O 1 1 15 5198 1 1 21 CYS C C 8.752 5.024 2.619 1.00 . A A . 21 CYS C 1 1 15 5199 1 1 21 CYS CA C 7.799 6.231 2.658 1.00 . A A . 21 CYS CA 1 1 15 5200 1 1 21 CYS CB C 6.522 5.790 3.364 1.00 . A A . 21 CYS CB 1 1 15 5201 1 1 21 CYS H H 6.659 6.460 0.831 1.00 . A A . 21 CYS H 1 1 15 5202 1 1 21 CYS HA H 8.271 7.010 3.237 1.00 . A A . 21 CYS HA 1 1 15 5203 1 1 21 CYS HB2 H 6.121 4.976 2.786 1.00 . A A . 21 CYS HB2 1 1 15 5204 1 1 21 CYS HB3 H 6.803 5.385 4.325 1.00 . A A . 21 CYS HB3 1 1 15 5205 1 1 21 CYS N N 7.457 6.780 1.302 1.00 . A A . 21 CYS N 1 1 15 5206 1 1 21 CYS O O 9.424 4.753 3.597 1.00 . A A . 21 CYS O 1 1 15 5207 1 1 21 CYS SG S 5.180 6.965 3.681 1.00 . A A . 21 CYS SG 1 1 15 5208 1 1 22 . C C 10.398 3.166 0.006 1.00 . A A . 22 CY3 C 1 1 15 5209 1 1 22 . CA C 9.669 3.143 1.345 1.00 . A A . 22 CY3 CA 1 1 15 5210 1 1 22 . CB C 8.784 1.879 1.479 1.00 . A A . 22 CY3 CB 1 1 15 5211 1 1 22 . H H 8.230 4.615 0.743 1.00 . A A . 22 CY3 H 1 1 15 5212 1 1 22 . HA H 10.414 3.137 2.128 1.00 . A A . 22 CY3 HA 1 1 15 5213 1 1 22 . HB2 H 9.348 1.015 1.164 1.00 . A A . 22 CY3 HB2 1 1 15 5214 1 1 22 . HB3 H 7.961 1.984 0.788 1.00 . A A . 22 CY3 HB3 1 1 15 5215 1 1 22 . HN11 H 10.257 5.136 -0.124 1.00 . A A . 22 CY3 HN11 1 1 15 5216 1 1 22 . HN12 H 11.042 4.384 -1.421 1.00 . A A . 22 CY3 HN12 1 1 15 5217 1 1 22 . N N 8.786 4.341 1.503 1.00 . A A . 22 CY3 N 1 1 15 5218 1 1 22 . N1 N 10.583 4.323 -0.562 1.00 . A A . 22 CY3 N1 1 1 15 5219 1 1 22 . O O 10.802 2.155 -0.534 1.00 . A A . 22 CY3 O 1 1 15 5220 1 1 22 . SG S 8.072 1.541 3.111 1.00 . A A . 22 CY3 SG 1 1 16 5221 1 1 1 PCA C C -4.688 6.245 2.982 1.00 . A A . 1 PCA C 1 1 16 5222 1 1 1 PCA CA C -5.916 6.712 3.774 1.00 . A A . 1 PCA CA 1 1 16 5223 1 1 1 PCA CB C -5.990 6.103 5.183 1.00 . A A . 1 PCA CB 1 1 16 5224 1 1 1 PCA CD C -8.077 5.750 4.107 1.00 . A A . 1 PCA CD 1 1 16 5225 1 1 1 PCA CG C -7.474 5.930 5.477 1.00 . A A . 1 PCA CG 1 1 16 5226 1 1 1 PCA HA H -5.895 7.790 3.849 1.00 . A A . 1 PCA HA 1 1 16 5227 1 1 1 PCA HB2 H -5.517 6.765 5.895 1.00 . A A . 1 PCA HB2 1 1 16 5228 1 1 1 PCA HB3 H -5.470 5.157 5.216 1.00 . A A . 1 PCA HB3 1 1 16 5229 1 1 1 PCA HG2 H -7.872 6.814 5.954 1.00 . A A . 1 PCA HG2 1 1 16 5230 1 1 1 PCA HG3 H -7.642 5.057 6.089 1.00 . A A . 1 PCA HG3 1 1 16 5231 1 1 1 PCA N N -7.174 6.319 3.108 1.00 . A A . 1 PCA N 1 1 16 5232 1 1 1 PCA O O -4.820 5.814 1.852 1.00 . A A . 1 PCA O 1 1 16 5233 1 1 1 PCA OE O -9.144 5.214 3.882 1.00 . A A . 1 PCA OE 1 1 16 5234 1 1 2 ARG C C -2.055 4.418 3.107 1.00 . A A . 2 ARG C 1 1 16 5235 1 1 2 ARG CA C -2.276 5.927 2.940 1.00 . A A . 2 ARG CA 1 1 16 5236 1 1 2 ARG CB C -1.098 6.715 3.565 1.00 . A A . 2 ARG CB 1 1 16 5237 1 1 2 ARG CD C -1.444 8.667 1.950 1.00 . A A . 2 ARG CD 1 1 16 5238 1 1 2 ARG CG C -1.327 8.240 3.432 1.00 . A A . 2 ARG CG 1 1 16 5239 1 1 2 ARG CZ C -2.901 10.632 2.126 1.00 . A A . 2 ARG CZ 1 1 16 5240 1 1 2 ARG H H -3.515 6.705 4.520 1.00 . A A . 2 ARG H 1 1 16 5241 1 1 2 ARG HA H -2.341 6.144 1.883 1.00 . A A . 2 ARG HA 1 1 16 5242 1 1 2 ARG HB2 H -1.013 6.473 4.613 1.00 . A A . 2 ARG HB2 1 1 16 5243 1 1 2 ARG HB3 H -0.176 6.443 3.073 1.00 . A A . 2 ARG HB3 1 1 16 5244 1 1 2 ARG HD2 H -0.521 8.464 1.428 1.00 . A A . 2 ARG HD2 1 1 16 5245 1 1 2 ARG HD3 H -2.251 8.155 1.448 1.00 . A A . 2 ARG HD3 1 1 16 5246 1 1 2 ARG HE H -0.968 10.749 1.695 1.00 . A A . 2 ARG HE 1 1 16 5247 1 1 2 ARG HG2 H -2.222 8.523 3.966 1.00 . A A . 2 ARG HG2 1 1 16 5248 1 1 2 ARG HG3 H -0.493 8.760 3.881 1.00 . A A . 2 ARG HG3 1 1 16 5249 1 1 2 ARG HH11 H -3.778 8.855 2.453 1.00 . A A . 2 ARG HH11 1 1 16 5250 1 1 2 ARG HH12 H -4.813 10.237 2.570 1.00 . A A . 2 ARG HH12 1 1 16 5251 1 1 2 ARG HH21 H -2.264 12.506 1.845 1.00 . A A . 2 ARG HH21 1 1 16 5252 1 1 2 ARG HH22 H -3.945 12.336 2.224 1.00 . A A . 2 ARG HH22 1 1 16 5253 1 1 2 ARG N N -3.543 6.349 3.608 1.00 . A A . 2 ARG N 1 1 16 5254 1 1 2 ARG NE N -1.706 10.138 1.901 1.00 . A A . 2 ARG NE 1 1 16 5255 1 1 2 ARG NH1 N -3.908 9.846 2.405 1.00 . A A . 2 ARG NH1 1 1 16 5256 1 1 2 ARG NH2 N -3.049 11.926 2.060 1.00 . A A . 2 ARG NH2 1 1 16 5257 1 1 2 ARG O O -2.110 3.886 4.198 1.00 . A A . 2 ARG O 1 1 16 5258 1 1 3 LEU C C -0.106 2.090 2.389 1.00 . A A . 3 LEU C 1 1 16 5259 1 1 3 LEU CA C -1.572 2.310 1.938 1.00 . A A . 3 LEU CA 1 1 16 5260 1 1 3 LEU CB C -1.868 1.890 0.462 1.00 . A A . 3 LEU CB 1 1 16 5261 1 1 3 LEU CD1 C -2.730 -0.436 1.031 1.00 . A A . 3 LEU CD1 1 1 16 5262 1 1 3 LEU CD2 C -1.947 0.087 -1.301 1.00 . A A . 3 LEU CD2 1 1 16 5263 1 1 3 LEU CG C -1.713 0.368 0.198 1.00 . A A . 3 LEU CG 1 1 16 5264 1 1 3 LEU H H -1.803 4.300 1.154 1.00 . A A . 3 LEU H 1 1 16 5265 1 1 3 LEU HA H -2.237 1.818 2.630 1.00 . A A . 3 LEU HA 1 1 16 5266 1 1 3 LEU HB2 H -2.879 2.184 0.221 1.00 . A A . 3 LEU HB2 1 1 16 5267 1 1 3 LEU HB3 H -1.206 2.433 -0.198 1.00 . A A . 3 LEU HB3 1 1 16 5268 1 1 3 LEU HD11 H -2.620 -1.493 0.834 1.00 . A A . 3 LEU HD11 1 1 16 5269 1 1 3 LEU HD12 H -3.740 -0.141 0.783 1.00 . A A . 3 LEU HD12 1 1 16 5270 1 1 3 LEU HD13 H -2.561 -0.264 2.080 1.00 . A A . 3 LEU HD13 1 1 16 5271 1 1 3 LEU HD21 H -2.940 0.397 -1.594 1.00 . A A . 3 LEU HD21 1 1 16 5272 1 1 3 LEU HD22 H -1.840 -0.969 -1.502 1.00 . A A . 3 LEU HD22 1 1 16 5273 1 1 3 LEU HD23 H -1.225 0.627 -1.896 1.00 . A A . 3 LEU HD23 1 1 16 5274 1 1 3 LEU HG H -0.716 0.053 0.454 1.00 . A A . 3 LEU HG 1 1 16 5275 1 1 3 LEU N N -1.817 3.785 1.988 1.00 . A A . 3 LEU N 1 1 16 5276 1 1 3 LEU O O 0.196 2.222 3.558 1.00 . A A . 3 LEU O 1 1 16 5277 1 1 4 CYS C C 2.848 2.395 2.711 1.00 . A A . 4 CYS C 1 1 16 5278 1 1 4 CYS CA C 2.199 1.506 1.635 1.00 . A A . 4 CYS CA 1 1 16 5279 1 1 4 CYS CB C 2.909 1.763 0.305 1.00 . A A . 4 CYS CB 1 1 16 5280 1 1 4 CYS H H 0.394 1.656 0.540 1.00 . A A . 4 CYS H 1 1 16 5281 1 1 4 CYS HA H 2.354 0.481 1.921 1.00 . A A . 4 CYS HA 1 1 16 5282 1 1 4 CYS HB2 H 2.942 2.822 0.116 1.00 . A A . 4 CYS HB2 1 1 16 5283 1 1 4 CYS HB3 H 3.937 1.452 0.421 1.00 . A A . 4 CYS HB3 1 1 16 5284 1 1 4 CYS N N 0.738 1.760 1.445 1.00 . A A . 4 CYS N 1 1 16 5285 1 1 4 CYS O O 3.435 1.910 3.660 1.00 . A A . 4 CYS O 1 1 16 5286 1 1 4 CYS SG S 2.313 1.005 -1.225 1.00 . A A . 4 CYS SG 1 1 16 5287 1 1 5 CYS C C 2.559 4.726 4.798 1.00 . A A . 5 CYS C 1 1 16 5288 1 1 5 CYS CA C 3.277 4.688 3.446 1.00 . A A . 5 CYS CA 1 1 16 5289 1 1 5 CYS CB C 3.198 6.079 2.802 1.00 . A A . 5 CYS CB 1 1 16 5290 1 1 5 CYS H H 2.196 3.980 1.720 1.00 . A A . 5 CYS H 1 1 16 5291 1 1 5 CYS HA H 4.315 4.441 3.614 1.00 . A A . 5 CYS HA 1 1 16 5292 1 1 5 CYS HB2 H 3.560 6.012 1.788 1.00 . A A . 5 CYS HB2 1 1 16 5293 1 1 5 CYS HB3 H 2.166 6.397 2.762 1.00 . A A . 5 CYS HB3 1 1 16 5294 1 1 5 CYS N N 2.699 3.680 2.507 1.00 . A A . 5 CYS N 1 1 16 5295 1 1 5 CYS O O 3.203 4.800 5.828 1.00 . A A . 5 CYS O 1 1 16 5296 1 1 5 CYS SG S 4.145 7.365 3.649 1.00 . A A . 5 CYS SG 1 1 16 5297 1 1 6 GLY C C 0.798 3.543 6.947 1.00 . A A . 6 GLY C 1 1 16 5298 1 1 6 GLY CA C 0.447 4.707 6.020 1.00 . A A . 6 GLY CA 1 1 16 5299 1 1 6 GLY H H 0.792 4.611 3.893 1.00 . A A . 6 GLY H 1 1 16 5300 1 1 6 GLY HA2 H 0.638 5.639 6.533 1.00 . A A . 6 GLY HA2 1 1 16 5301 1 1 6 GLY HA3 H -0.601 4.650 5.779 1.00 . A A . 6 GLY HA3 1 1 16 5302 1 1 6 GLY N N 1.250 4.674 4.758 1.00 . A A . 6 GLY N 1 1 16 5303 1 1 6 GLY O O 0.800 3.699 8.153 1.00 . A A . 6 GLY O 1 1 16 5304 1 1 7 PHE C C 2.207 0.134 6.324 1.00 . A A . 7 PHE C 1 1 16 5305 1 1 7 PHE CA C 1.442 1.204 7.145 1.00 . A A . 7 PHE CA 1 1 16 5306 1 1 7 PHE CB C 0.132 0.619 7.738 1.00 . A A . 7 PHE CB 1 1 16 5307 1 1 7 PHE CD1 C -0.959 -0.878 6.017 1.00 . A A . 7 PHE CD1 1 1 16 5308 1 1 7 PHE CD2 C -1.827 1.323 6.287 1.00 . A A . 7 PHE CD2 1 1 16 5309 1 1 7 PHE CE1 C -1.901 -1.134 5.042 1.00 . A A . 7 PHE CE1 1 1 16 5310 1 1 7 PHE CE2 C -2.769 1.072 5.313 1.00 . A A . 7 PHE CE2 1 1 16 5311 1 1 7 PHE CG C -0.914 0.347 6.645 1.00 . A A . 7 PHE CG 1 1 16 5312 1 1 7 PHE CZ C -2.807 -0.156 4.692 1.00 . A A . 7 PHE CZ 1 1 16 5313 1 1 7 PHE H H 1.064 2.362 5.373 1.00 . A A . 7 PHE H 1 1 16 5314 1 1 7 PHE HA H 2.065 1.535 7.961 1.00 . A A . 7 PHE HA 1 1 16 5315 1 1 7 PHE HB2 H 0.345 -0.308 8.251 1.00 . A A . 7 PHE HB2 1 1 16 5316 1 1 7 PHE HB3 H -0.288 1.311 8.454 1.00 . A A . 7 PHE HB3 1 1 16 5317 1 1 7 PHE HD1 H -0.247 -1.636 6.299 1.00 . A A . 7 PHE HD1 1 1 16 5318 1 1 7 PHE HD2 H -1.802 2.289 6.770 1.00 . A A . 7 PHE HD2 1 1 16 5319 1 1 7 PHE HE1 H -1.929 -2.097 4.554 1.00 . A A . 7 PHE HE1 1 1 16 5320 1 1 7 PHE HE2 H -3.479 1.838 5.039 1.00 . A A . 7 PHE HE2 1 1 16 5321 1 1 7 PHE HZ H -3.548 -0.352 3.932 1.00 . A A . 7 PHE HZ 1 1 16 5322 1 1 7 PHE N N 1.084 2.413 6.350 1.00 . A A . 7 PHE N 1 1 16 5323 1 1 7 PHE O O 1.837 -0.213 5.213 1.00 . A A . 7 PHE O 1 1 16 5324 1 1 8 HYP C C 3.856 -2.447 5.648 1.00 . A A . 8 HYP C 1 1 16 5325 1 1 8 HYP CA C 4.327 -1.100 6.209 1.00 . A A . 8 HYP CA 1 1 16 5326 1 1 8 HYP CB C 5.450 -1.242 7.230 1.00 . A A . 8 HYP CB 1 1 16 5327 1 1 8 HYP CD C 3.593 -0.290 8.367 1.00 . A A . 8 HYP CD 1 1 16 5328 1 1 8 HYP CG C 4.725 -1.269 8.528 1.00 . A A . 8 HYP CG 1 1 16 5329 1 1 8 HYP HA H 4.694 -0.500 5.393 1.00 . A A . 8 HYP HA 1 1 16 5330 1 1 8 HYP HB2 H 6.128 -0.404 7.156 1.00 . A A . 8 HYP HB2 1 1 16 5331 1 1 8 HYP HB3 H 6.018 -2.146 7.060 1.00 . A A . 8 HYP HB3 1 1 16 5332 1 1 8 HYP HD1 H 5.948 -0.012 9.366 1.00 . A A . 8 HYP HD1 1 1 16 5333 1 1 8 HYP HD22 H 3.922 0.702 8.642 1.00 . A A . 8 HYP HD22 1 1 16 5334 1 1 8 HYP HD23 H 2.751 -0.591 8.972 1.00 . A A . 8 HYP HD23 1 1 16 5335 1 1 8 HYP HG H 4.339 -2.261 8.713 1.00 . A A . 8 HYP HG 1 1 16 5336 1 1 8 HYP N N 3.269 -0.362 6.925 1.00 . A A . 8 HYP N 1 1 16 5337 1 1 8 HYP O O 4.617 -3.115 4.975 1.00 . A A . 8 HYP O 1 1 16 5338 1 1 8 HYP OD1 O 5.590 -0.876 9.583 1.00 . A A . 8 HYP OD1 1 1 16 5339 1 1 9 LYS C C 2.141 -4.021 3.932 1.00 . A A . 9 LYS C 1 1 16 5340 1 1 9 LYS CA C 2.050 -4.076 5.459 1.00 . A A . 9 LYS CA 1 1 16 5341 1 1 9 LYS CB C 0.581 -4.169 5.966 1.00 . A A . 9 LYS CB 1 1 16 5342 1 1 9 LYS CD C -0.370 -5.806 4.192 1.00 . A A . 9 LYS CD 1 1 16 5343 1 1 9 LYS CE C -1.161 -7.112 4.034 1.00 . A A . 9 LYS CE 1 1 16 5344 1 1 9 LYS CG C -0.139 -5.525 5.693 1.00 . A A . 9 LYS CG 1 1 16 5345 1 1 9 LYS H H 2.074 -2.195 6.496 1.00 . A A . 9 LYS H 1 1 16 5346 1 1 9 LYS HA H 2.645 -4.898 5.831 1.00 . A A . 9 LYS HA 1 1 16 5347 1 1 9 LYS HB2 H 0.557 -3.964 7.026 1.00 . A A . 9 LYS HB2 1 1 16 5348 1 1 9 LYS HB3 H 0.006 -3.410 5.462 1.00 . A A . 9 LYS HB3 1 1 16 5349 1 1 9 LYS HD2 H -0.903 -4.987 3.732 1.00 . A A . 9 LYS HD2 1 1 16 5350 1 1 9 LYS HD3 H 0.565 -5.950 3.683 1.00 . A A . 9 LYS HD3 1 1 16 5351 1 1 9 LYS HE2 H -0.613 -7.940 4.458 1.00 . A A . 9 LYS HE2 1 1 16 5352 1 1 9 LYS HE3 H -2.121 -7.037 4.522 1.00 . A A . 9 LYS HE3 1 1 16 5353 1 1 9 LYS HG2 H 0.456 -6.324 6.113 1.00 . A A . 9 LYS HG2 1 1 16 5354 1 1 9 LYS HG3 H -1.092 -5.517 6.204 1.00 . A A . 9 LYS HG3 1 1 16 5355 1 1 9 LYS HZ1 H -1.718 -8.359 2.462 1.00 . A A . 9 LYS HZ1 1 1 16 5356 1 1 9 LYS HZ2 H -0.493 -7.251 2.069 1.00 . A A . 9 LYS HZ2 1 1 16 5357 1 1 9 LYS HZ3 H -2.098 -6.721 2.218 1.00 . A A . 9 LYS HZ3 1 1 16 5358 1 1 9 LYS N N 2.625 -2.789 5.947 1.00 . A A . 9 LYS N 1 1 16 5359 1 1 9 LYS NZ N -1.384 -7.382 2.587 1.00 . A A . 9 LYS NZ 1 1 16 5360 1 1 9 LYS O O 2.559 -4.987 3.322 1.00 . A A . 9 LYS O 1 1 16 5361 1 1 10 SER C C 3.263 -2.473 1.397 1.00 . A A . 10 SER C 1 1 16 5362 1 1 10 SER CA C 1.844 -2.829 1.865 1.00 . A A . 10 SER CA 1 1 16 5363 1 1 10 SER CB C 0.819 -1.792 1.402 1.00 . A A . 10 SER CB 1 1 16 5364 1 1 10 SER H H 1.448 -2.111 3.853 1.00 . A A . 10 SER H 1 1 16 5365 1 1 10 SER HA H 1.578 -3.791 1.447 1.00 . A A . 10 SER HA 1 1 16 5366 1 1 10 SER HB2 H 0.943 -0.849 1.906 1.00 . A A . 10 SER HB2 1 1 16 5367 1 1 10 SER HB3 H 0.824 -1.661 0.331 1.00 . A A . 10 SER HB3 1 1 16 5368 1 1 10 SER HG H -0.501 -2.221 2.764 1.00 . A A . 10 SER HG 1 1 16 5369 1 1 10 SER N N 1.767 -2.901 3.352 1.00 . A A . 10 SER N 1 1 16 5370 1 1 10 SER O O 3.662 -2.904 0.338 1.00 . A A . 10 SER O 1 1 16 5371 1 1 10 SER OG O -0.421 -2.348 1.816 1.00 . A A . 10 SER OG 1 1 16 5372 1 1 11 CYS C C 6.329 -2.437 1.447 1.00 . A A . 11 CYS C 1 1 16 5373 1 1 11 CYS CA C 5.388 -1.282 1.860 1.00 . A A . 11 CYS CA 1 1 16 5374 1 1 11 CYS CB C 5.933 -0.570 3.095 1.00 . A A . 11 CYS CB 1 1 16 5375 1 1 11 CYS H H 3.582 -1.414 3.036 1.00 . A A . 11 CYS H 1 1 16 5376 1 1 11 CYS HA H 5.343 -0.572 1.051 1.00 . A A . 11 CYS HA 1 1 16 5377 1 1 11 CYS HB2 H 5.238 0.215 3.350 1.00 . A A . 11 CYS HB2 1 1 16 5378 1 1 11 CYS HB3 H 5.900 -1.296 3.893 1.00 . A A . 11 CYS HB3 1 1 16 5379 1 1 11 CYS N N 3.979 -1.713 2.191 1.00 . A A . 11 CYS N 1 1 16 5380 1 1 11 CYS O O 7.376 -2.204 0.874 1.00 . A A . 11 CYS O 1 1 16 5381 1 1 11 CYS SG S 7.590 0.158 3.183 1.00 . A A . 11 CYS SG 1 1 16 5382 1 1 12 ARG C C 6.566 -5.306 -0.056 1.00 . A A . 12 ARG C 1 1 16 5383 1 1 12 ARG CA C 6.714 -4.869 1.421 1.00 . A A . 12 ARG CA 1 1 16 5384 1 1 12 ARG CB C 6.232 -5.975 2.391 1.00 . A A . 12 ARG CB 1 1 16 5385 1 1 12 ARG CD C 6.464 -8.339 3.200 1.00 . A A . 12 ARG CD 1 1 16 5386 1 1 12 ARG CG C 6.991 -7.306 2.187 1.00 . A A . 12 ARG CG 1 1 16 5387 1 1 12 ARG CZ C 6.875 -10.453 2.017 1.00 . A A . 12 ARG CZ 1 1 16 5388 1 1 12 ARG H H 5.057 -3.747 2.209 1.00 . A A . 12 ARG H 1 1 16 5389 1 1 12 ARG HA H 7.757 -4.660 1.612 1.00 . A A . 12 ARG HA 1 1 16 5390 1 1 12 ARG HB2 H 6.374 -5.636 3.406 1.00 . A A . 12 ARG HB2 1 1 16 5391 1 1 12 ARG HB3 H 5.175 -6.141 2.235 1.00 . A A . 12 ARG HB3 1 1 16 5392 1 1 12 ARG HD2 H 6.651 -8.003 4.209 1.00 . A A . 12 ARG HD2 1 1 16 5393 1 1 12 ARG HD3 H 5.403 -8.499 3.074 1.00 . A A . 12 ARG HD3 1 1 16 5394 1 1 12 ARG HE H 7.923 -9.870 3.593 1.00 . A A . 12 ARG HE 1 1 16 5395 1 1 12 ARG HG2 H 6.827 -7.685 1.190 1.00 . A A . 12 ARG HG2 1 1 16 5396 1 1 12 ARG HG3 H 8.052 -7.155 2.333 1.00 . A A . 12 ARG HG3 1 1 16 5397 1 1 12 ARG HH11 H 5.391 -9.318 1.288 1.00 . A A . 12 ARG HH11 1 1 16 5398 1 1 12 ARG HH12 H 5.676 -10.807 0.453 1.00 . A A . 12 ARG HH12 1 1 16 5399 1 1 12 ARG HH21 H 8.297 -11.753 2.553 1.00 . A A . 12 ARG HH21 1 1 16 5400 1 1 12 ARG HH22 H 7.346 -12.209 1.178 1.00 . A A . 12 ARG HH22 1 1 16 5401 1 1 12 ARG N N 5.917 -3.642 1.750 1.00 . A A . 12 ARG N 1 1 16 5402 1 1 12 ARG NE N 7.191 -9.631 2.989 1.00 . A A . 12 ARG NE 1 1 16 5403 1 1 12 ARG NH1 N 5.905 -10.170 1.189 1.00 . A A . 12 ARG NH1 1 1 16 5404 1 1 12 ARG NH2 N 7.559 -11.558 1.907 1.00 . A A . 12 ARG NH2 1 1 16 5405 1 1 12 ARG O O 7.323 -6.133 -0.526 1.00 . A A . 12 ARG O 1 1 16 5406 1 1 13 SER C C 6.191 -4.230 -3.153 1.00 . A A . 13 SER C 1 1 16 5407 1 1 13 SER CA C 5.378 -5.098 -2.184 1.00 . A A . 13 SER CA 1 1 16 5408 1 1 13 SER CB C 3.881 -4.944 -2.507 1.00 . A A . 13 SER CB 1 1 16 5409 1 1 13 SER H H 5.040 -4.073 -0.321 1.00 . A A . 13 SER H 1 1 16 5410 1 1 13 SER HA H 5.654 -6.132 -2.335 1.00 . A A . 13 SER HA 1 1 16 5411 1 1 13 SER HB2 H 3.667 -5.197 -3.536 1.00 . A A . 13 SER HB2 1 1 16 5412 1 1 13 SER HB3 H 3.274 -5.544 -1.845 1.00 . A A . 13 SER HB3 1 1 16 5413 1 1 13 SER HG H 2.882 -3.512 -1.649 1.00 . A A . 13 SER HG 1 1 16 5414 1 1 13 SER N N 5.610 -4.741 -0.748 1.00 . A A . 13 SER N 1 1 16 5415 1 1 13 SER O O 6.434 -3.065 -2.899 1.00 . A A . 13 SER O 1 1 16 5416 1 1 13 SER OG O 3.594 -3.569 -2.290 1.00 . A A . 13 SER OG 1 1 16 5417 1 1 14 ARG C C 6.650 -2.894 -5.773 1.00 . A A . 14 ARG C 1 1 16 5418 1 1 14 ARG CA C 7.373 -4.169 -5.308 1.00 . A A . 14 ARG CA 1 1 16 5419 1 1 14 ARG CB C 7.553 -5.162 -6.480 1.00 . A A . 14 ARG CB 1 1 16 5420 1 1 14 ARG CD C 9.769 -4.125 -7.205 1.00 . A A . 14 ARG CD 1 1 16 5421 1 1 14 ARG CG C 8.354 -4.540 -7.653 1.00 . A A . 14 ARG CG 1 1 16 5422 1 1 14 ARG CZ C 11.716 -3.155 -8.331 1.00 . A A . 14 ARG CZ 1 1 16 5423 1 1 14 ARG H H 6.330 -5.794 -4.361 1.00 . A A . 14 ARG H 1 1 16 5424 1 1 14 ARG HA H 8.334 -3.900 -4.897 1.00 . A A . 14 ARG HA 1 1 16 5425 1 1 14 ARG HB2 H 8.069 -6.041 -6.123 1.00 . A A . 14 ARG HB2 1 1 16 5426 1 1 14 ARG HB3 H 6.581 -5.466 -6.840 1.00 . A A . 14 ARG HB3 1 1 16 5427 1 1 14 ARG HD2 H 9.729 -3.371 -6.431 1.00 . A A . 14 ARG HD2 1 1 16 5428 1 1 14 ARG HD3 H 10.323 -4.981 -6.848 1.00 . A A . 14 ARG HD3 1 1 16 5429 1 1 14 ARG HE H 9.983 -3.459 -9.239 1.00 . A A . 14 ARG HE 1 1 16 5430 1 1 14 ARG HG2 H 8.435 -5.270 -8.445 1.00 . A A . 14 ARG HG2 1 1 16 5431 1 1 14 ARG HG3 H 7.829 -3.680 -8.043 1.00 . A A . 14 ARG HG3 1 1 16 5432 1 1 14 ARG HH11 H 11.961 -3.638 -6.399 1.00 . A A . 14 ARG HH11 1 1 16 5433 1 1 14 ARG HH12 H 13.346 -2.956 -7.186 1.00 . A A . 14 ARG HH12 1 1 16 5434 1 1 14 ARG HH21 H 11.714 -2.593 -10.251 1.00 . A A . 14 ARG HH21 1 1 16 5435 1 1 14 ARG HH22 H 13.205 -2.354 -9.402 1.00 . A A . 14 ARG HH22 1 1 16 5436 1 1 14 ARG N N 6.574 -4.852 -4.242 1.00 . A A . 14 ARG N 1 1 16 5437 1 1 14 ARG NE N 10.469 -3.547 -8.392 1.00 . A A . 14 ARG NE 1 1 16 5438 1 1 14 ARG NH1 N 12.394 -3.258 -7.218 1.00 . A A . 14 ARG NH1 1 1 16 5439 1 1 14 ARG NH2 N 12.254 -2.662 -9.412 1.00 . A A . 14 ARG NH2 1 1 16 5440 1 1 14 ARG O O 7.279 -1.918 -6.136 1.00 . A A . 14 ARG O 1 1 16 5441 1 1 15 GLN C C 4.718 -0.623 -5.200 1.00 . A A . 15 GLN C 1 1 16 5442 1 1 15 GLN CA C 4.488 -1.806 -6.156 1.00 . A A . 15 GLN CA 1 1 16 5443 1 1 15 GLN CB C 3.016 -2.259 -6.117 1.00 . A A . 15 GLN CB 1 1 16 5444 1 1 15 GLN CD C 0.628 -1.607 -6.481 1.00 . A A . 15 GLN CD 1 1 16 5445 1 1 15 GLN CG C 2.076 -1.110 -6.545 1.00 . A A . 15 GLN CG 1 1 16 5446 1 1 15 GLN H H 4.914 -3.787 -5.432 1.00 . A A . 15 GLN H 1 1 16 5447 1 1 15 GLN HA H 4.764 -1.513 -7.158 1.00 . A A . 15 GLN HA 1 1 16 5448 1 1 15 GLN HB2 H 2.885 -3.094 -6.790 1.00 . A A . 15 GLN HB2 1 1 16 5449 1 1 15 GLN HB3 H 2.764 -2.583 -5.117 1.00 . A A . 15 GLN HB3 1 1 16 5450 1 1 15 GLN HE21 H 0.594 -1.617 -4.495 1.00 . A A . 15 GLN HE21 1 1 16 5451 1 1 15 GLN HE22 H -0.845 -2.113 -5.248 1.00 . A A . 15 GLN HE22 1 1 16 5452 1 1 15 GLN HG2 H 2.177 -0.260 -5.886 1.00 . A A . 15 GLN HG2 1 1 16 5453 1 1 15 GLN HG3 H 2.296 -0.799 -7.557 1.00 . A A . 15 GLN HG3 1 1 16 5454 1 1 15 GLN N N 5.342 -2.959 -5.739 1.00 . A A . 15 GLN N 1 1 16 5455 1 1 15 GLN NE2 N 0.080 -1.795 -5.311 1.00 . A A . 15 GLN NE2 1 1 16 5456 1 1 15 GLN O O 4.673 0.520 -5.612 1.00 . A A . 15 GLN O 1 1 16 5457 1 1 15 GLN OE1 O -0.015 -1.830 -7.488 1.00 . A A . 15 GLN OE1 1 1 16 5458 1 1 16 CYS C C 6.617 0.670 -2.861 1.00 . A A . 16 CYS C 1 1 16 5459 1 1 16 CYS CA C 5.197 0.104 -2.923 1.00 . A A . 16 CYS CA 1 1 16 5460 1 1 16 CYS CB C 4.856 -0.439 -1.554 1.00 . A A . 16 CYS CB 1 1 16 5461 1 1 16 CYS H H 4.974 -1.892 -3.699 1.00 . A A . 16 CYS H 1 1 16 5462 1 1 16 CYS HA H 4.516 0.917 -3.114 1.00 . A A . 16 CYS HA 1 1 16 5463 1 1 16 CYS HB2 H 5.437 -1.322 -1.355 1.00 . A A . 16 CYS HB2 1 1 16 5464 1 1 16 CYS HB3 H 5.160 0.303 -0.833 1.00 . A A . 16 CYS HB3 1 1 16 5465 1 1 16 CYS N N 4.956 -0.947 -3.953 1.00 . A A . 16 CYS N 1 1 16 5466 1 1 16 CYS O O 6.767 1.816 -2.488 1.00 . A A . 16 CYS O 1 1 16 5467 1 1 16 CYS SG S 3.130 -0.836 -1.200 1.00 . A A . 16 CYS SG 1 1 16 5468 1 1 17 LYS C C 9.234 1.806 -3.891 1.00 . A A . 17 LYS C 1 1 16 5469 1 1 17 LYS CA C 9.012 0.468 -3.140 1.00 . A A . 17 LYS CA 1 1 16 5470 1 1 17 LYS CB C 10.048 -0.562 -3.687 1.00 . A A . 17 LYS CB 1 1 16 5471 1 1 17 LYS CD C 9.161 -2.482 -2.224 1.00 . A A . 17 LYS CD 1 1 16 5472 1 1 17 LYS CE C 9.577 -3.539 -1.191 1.00 . A A . 17 LYS CE 1 1 16 5473 1 1 17 LYS CG C 10.384 -1.662 -2.645 1.00 . A A . 17 LYS CG 1 1 16 5474 1 1 17 LYS H H 7.461 -1.031 -3.481 1.00 . A A . 17 LYS H 1 1 16 5475 1 1 17 LYS HA H 9.228 0.639 -2.098 1.00 . A A . 17 LYS HA 1 1 16 5476 1 1 17 LYS HB2 H 9.652 -1.031 -4.577 1.00 . A A . 17 LYS HB2 1 1 16 5477 1 1 17 LYS HB3 H 10.964 -0.055 -3.958 1.00 . A A . 17 LYS HB3 1 1 16 5478 1 1 17 LYS HD2 H 8.408 -1.848 -1.780 1.00 . A A . 17 LYS HD2 1 1 16 5479 1 1 17 LYS HD3 H 8.753 -2.968 -3.093 1.00 . A A . 17 LYS HD3 1 1 16 5480 1 1 17 LYS HE2 H 8.722 -4.131 -0.912 1.00 . A A . 17 LYS HE2 1 1 16 5481 1 1 17 LYS HE3 H 10.335 -4.191 -1.599 1.00 . A A . 17 LYS HE3 1 1 16 5482 1 1 17 LYS HG2 H 11.121 -2.324 -3.073 1.00 . A A . 17 LYS HG2 1 1 16 5483 1 1 17 LYS HG3 H 10.821 -1.194 -1.775 1.00 . A A . 17 LYS HG3 1 1 16 5484 1 1 17 LYS HZ1 H 9.617 -1.984 0.193 1.00 . A A . 17 LYS HZ1 1 1 16 5485 1 1 17 LYS HZ2 H 11.133 -2.694 -0.095 1.00 . A A . 17 LYS HZ2 1 1 16 5486 1 1 17 LYS HZ3 H 9.978 -3.506 0.852 1.00 . A A . 17 LYS HZ3 1 1 16 5487 1 1 17 LYS N N 7.621 -0.103 -3.200 1.00 . A A . 17 LYS N 1 1 16 5488 1 1 17 LYS NZ N 10.117 -2.881 0.033 1.00 . A A . 17 LYS NZ 1 1 16 5489 1 1 17 LYS O O 9.908 2.662 -3.353 1.00 . A A . 17 LYS O 1 1 16 5490 1 1 18 HYP C C 8.176 4.486 -5.050 1.00 . A A . 18 HYP C 1 1 16 5491 1 1 18 HYP CA C 8.810 3.284 -5.792 1.00 . A A . 18 HYP CA 1 1 16 5492 1 1 18 HYP CB C 8.166 3.029 -7.158 1.00 . A A . 18 HYP CB 1 1 16 5493 1 1 18 HYP CD C 7.937 1.017 -5.895 1.00 . A A . 18 HYP CD 1 1 16 5494 1 1 18 HYP CG C 7.255 1.876 -6.922 1.00 . A A . 18 HYP CG 1 1 16 5495 1 1 18 HYP HA H 9.850 3.519 -5.966 1.00 . A A . 18 HYP HA 1 1 16 5496 1 1 18 HYP HB2 H 8.929 2.802 -7.889 1.00 . A A . 18 HYP HB2 1 1 16 5497 1 1 18 HYP HB3 H 7.630 3.902 -7.498 1.00 . A A . 18 HYP HB3 1 1 16 5498 1 1 18 HYP HD1 H 7.699 0.457 -8.182 1.00 . A A . 18 HYP HD1 1 1 16 5499 1 1 18 HYP HD22 H 8.601 0.305 -6.362 1.00 . A A . 18 HYP HD22 1 1 16 5500 1 1 18 HYP HD23 H 7.183 0.505 -5.328 1.00 . A A . 18 HYP HD23 1 1 16 5501 1 1 18 HYP HG H 6.314 2.238 -6.537 1.00 . A A . 18 HYP HG 1 1 16 5502 1 1 18 HYP N N 8.695 1.988 -5.079 1.00 . A A . 18 HYP N 1 1 16 5503 1 1 18 HYP O O 8.328 5.606 -5.500 1.00 . A A . 18 HYP O 1 1 16 5504 1 1 18 HYP OD1 O 7.035 1.149 -8.122 1.00 . A A . 18 HYP OD1 1 1 16 5505 1 1 19 HIS C C 7.885 6.162 -2.405 1.00 . A A . 19 HIS C 1 1 16 5506 1 1 19 HIS CA C 6.855 5.327 -3.173 1.00 . A A . 19 HIS CA 1 1 16 5507 1 1 19 HIS CB C 5.845 4.736 -2.165 1.00 . A A . 19 HIS CB 1 1 16 5508 1 1 19 HIS CD2 C 4.650 3.263 -4.043 1.00 . A A . 19 HIS CD2 1 1 16 5509 1 1 19 HIS CE1 C 2.712 3.407 -3.329 1.00 . A A . 19 HIS CE1 1 1 16 5510 1 1 19 HIS CG C 4.686 4.040 -2.897 1.00 . A A . 19 HIS CG 1 1 16 5511 1 1 19 HIS H H 7.424 3.298 -3.645 1.00 . A A . 19 HIS H 1 1 16 5512 1 1 19 HIS HA H 6.332 5.976 -3.862 1.00 . A A . 19 HIS HA 1 1 16 5513 1 1 19 HIS HB2 H 6.330 4.022 -1.519 1.00 . A A . 19 HIS HB2 1 1 16 5514 1 1 19 HIS HB3 H 5.432 5.527 -1.556 1.00 . A A . 19 HIS HB3 1 1 16 5515 1 1 19 HIS HD1 H 3.129 4.561 -1.720 1.00 . A A . 19 HIS HD1 1 1 16 5516 1 1 19 HIS HD2 H 5.507 3.004 -4.641 1.00 . A A . 19 HIS HD2 1 1 16 5517 1 1 19 HIS HE1 H 1.643 3.292 -3.227 1.00 . A A . 19 HIS HE1 1 1 16 5518 1 1 19 HIS N N 7.503 4.224 -3.955 1.00 . A A . 19 HIS N 1 1 16 5519 1 1 19 HIS ND1 N 3.453 4.085 -2.513 1.00 . A A . 19 HIS ND1 1 1 16 5520 1 1 19 HIS NE2 N 3.416 2.878 -4.298 1.00 . A A . 19 HIS NE2 1 1 16 5521 1 1 19 HIS O O 8.946 5.684 -2.055 1.00 . A A . 19 HIS O 1 1 16 5522 1 1 20 ARG C C 8.505 8.026 0.075 1.00 . A A . 20 ARG C 1 1 16 5523 1 1 20 ARG CA C 8.393 8.359 -1.429 1.00 . A A . 20 ARG CA 1 1 16 5524 1 1 20 ARG CB C 7.807 9.782 -1.611 1.00 . A A . 20 ARG CB 1 1 16 5525 1 1 20 ARG CD C 8.936 10.251 -3.916 1.00 . A A . 20 ARG CD 1 1 16 5526 1 1 20 ARG CG C 7.620 10.203 -3.105 1.00 . A A . 20 ARG CG 1 1 16 5527 1 1 20 ARG CZ C 10.774 8.693 -4.361 1.00 . A A . 20 ARG CZ 1 1 16 5528 1 1 20 ARG H H 6.638 7.696 -2.479 1.00 . A A . 20 ARG H 1 1 16 5529 1 1 20 ARG HA H 9.392 8.308 -1.833 1.00 . A A . 20 ARG HA 1 1 16 5530 1 1 20 ARG HB2 H 6.845 9.830 -1.118 1.00 . A A . 20 ARG HB2 1 1 16 5531 1 1 20 ARG HB3 H 8.460 10.498 -1.132 1.00 . A A . 20 ARG HB3 1 1 16 5532 1 1 20 ARG HD2 H 8.746 10.629 -4.910 1.00 . A A . 20 ARG HD2 1 1 16 5533 1 1 20 ARG HD3 H 9.643 10.900 -3.421 1.00 . A A . 20 ARG HD3 1 1 16 5534 1 1 20 ARG HE H 8.957 8.099 -3.850 1.00 . A A . 20 ARG HE 1 1 16 5535 1 1 20 ARG HG2 H 6.934 9.521 -3.587 1.00 . A A . 20 ARG HG2 1 1 16 5536 1 1 20 ARG HG3 H 7.173 11.187 -3.128 1.00 . A A . 20 ARG HG3 1 1 16 5537 1 1 20 ARG HH11 H 11.202 10.644 -4.551 1.00 . A A . 20 ARG HH11 1 1 16 5538 1 1 20 ARG HH12 H 12.512 9.557 -4.860 1.00 . A A . 20 ARG HH12 1 1 16 5539 1 1 20 ARG HH21 H 10.593 6.704 -4.238 1.00 . A A . 20 ARG HH21 1 1 16 5540 1 1 20 ARG HH22 H 12.163 7.289 -4.681 1.00 . A A . 20 ARG HH22 1 1 16 5541 1 1 20 ARG N N 7.516 7.394 -2.166 1.00 . A A . 20 ARG N 1 1 16 5542 1 1 20 ARG NE N 9.521 8.880 -4.030 1.00 . A A . 20 ARG NE 1 1 16 5543 1 1 20 ARG NH1 N 11.556 9.711 -4.609 1.00 . A A . 20 ARG NH1 1 1 16 5544 1 1 20 ARG NH2 N 11.210 7.467 -4.432 1.00 . A A . 20 ARG NH2 1 1 16 5545 1 1 20 ARG O O 9.002 8.832 0.840 1.00 . A A . 20 ARG O 1 1 16 5546 1 1 21 CYS C C 8.779 5.044 1.984 1.00 . A A . 21 CYS C 1 1 16 5547 1 1 21 CYS CA C 8.101 6.422 1.888 1.00 . A A . 21 CYS CA 1 1 16 5548 1 1 21 CYS CB C 6.680 6.317 2.433 1.00 . A A . 21 CYS CB 1 1 16 5549 1 1 21 CYS H H 7.660 6.250 -0.207 1.00 . A A . 21 CYS H 1 1 16 5550 1 1 21 CYS HA H 8.679 7.127 2.467 1.00 . A A . 21 CYS HA 1 1 16 5551 1 1 21 CYS HB2 H 6.194 5.481 1.952 1.00 . A A . 21 CYS HB2 1 1 16 5552 1 1 21 CYS HB3 H 6.747 6.084 3.487 1.00 . A A . 21 CYS HB3 1 1 16 5553 1 1 21 CYS N N 8.048 6.857 0.455 1.00 . A A . 21 CYS N 1 1 16 5554 1 1 21 CYS O O 9.204 4.643 3.050 1.00 . A A . 21 CYS O 1 1 16 5555 1 1 21 CYS SG S 5.574 7.738 2.271 1.00 . A A . 21 CYS SG 1 1 16 5556 1 1 22 . C C 10.382 2.857 -0.422 1.00 . A A . 22 CY3 C 1 1 16 5557 1 1 22 . CA C 9.480 3.008 0.806 1.00 . A A . 22 CY3 CA 1 1 16 5558 1 1 22 . CB C 8.307 1.993 0.825 1.00 . A A . 22 CY3 CB 1 1 16 5559 1 1 22 . H H 8.492 4.756 0.037 1.00 . A A . 22 CY3 H 1 1 16 5560 1 1 22 . HA H 10.093 2.858 1.684 1.00 . A A . 22 CY3 HA 1 1 16 5561 1 1 22 . HB2 H 8.676 0.995 0.640 1.00 . A A . 22 CY3 HB2 1 1 16 5562 1 1 22 . HB3 H 7.610 2.241 0.038 1.00 . A A . 22 CY3 HB3 1 1 16 5563 1 1 22 . HN11 H 10.414 4.810 -0.764 1.00 . A A . 22 CY3 HN11 1 1 16 5564 1 1 22 . HN12 H 11.313 3.872 -1.854 1.00 . A A . 22 CY3 HN12 1 1 16 5565 1 1 22 . N N 8.853 4.366 0.863 1.00 . A A . 22 CY3 N 1 1 16 5566 1 1 22 . N1 N 10.734 3.934 -1.067 1.00 . A A . 22 CY3 N1 1 1 16 5567 1 1 22 . O O 10.779 1.774 -0.802 1.00 . A A . 22 CY3 O 1 1 16 5568 1 1 22 . SG S 7.409 2.011 2.398 1.00 . A A . 22 CY3 SG 1 1 17 5569 1 1 1 PCA C C -3.640 5.996 3.334 1.00 . A A . 1 PCA C 1 1 17 5570 1 1 1 PCA CA C -4.601 6.717 2.373 1.00 . A A . 1 PCA CA 1 1 17 5571 1 1 1 PCA CB C -3.914 7.781 1.490 1.00 . A A . 1 PCA CB 1 1 17 5572 1 1 1 PCA CD C -5.459 8.886 2.912 1.00 . A A . 1 PCA CD 1 1 17 5573 1 1 1 PCA CG C -4.168 9.117 2.172 1.00 . A A . 1 PCA CG 1 1 17 5574 1 1 1 PCA HA H -5.082 5.985 1.741 1.00 . A A . 1 PCA HA 1 1 17 5575 1 1 1 PCA HB2 H -4.345 7.760 0.499 1.00 . A A . 1 PCA HB2 1 1 17 5576 1 1 1 PCA HB3 H -2.858 7.580 1.386 1.00 . A A . 1 PCA HB3 1 1 17 5577 1 1 1 PCA HG2 H -4.280 9.901 1.436 1.00 . A A . 1 PCA HG2 1 1 17 5578 1 1 1 PCA HG3 H -3.368 9.350 2.859 1.00 . A A . 1 PCA HG3 1 1 17 5579 1 1 1 PCA N N -5.643 7.451 3.121 1.00 . A A . 1 PCA N 1 1 17 5580 1 1 1 PCA O O -2.506 6.404 3.504 1.00 . A A . 1 PCA O 1 1 17 5581 1 1 1 PCA OE O -6.219 9.761 3.273 1.00 . A A . 1 PCA OE 1 1 17 5582 1 1 2 ARG C C -2.719 2.944 4.141 1.00 . A A . 2 ARG C 1 1 17 5583 1 1 2 ARG CA C -3.350 4.130 4.893 1.00 . A A . 2 ARG CA 1 1 17 5584 1 1 2 ARG CB C -4.337 3.693 6.023 1.00 . A A . 2 ARG CB 1 1 17 5585 1 1 2 ARG CD C -2.516 3.591 7.827 1.00 . A A . 2 ARG CD 1 1 17 5586 1 1 2 ARG CG C -3.681 2.845 7.157 1.00 . A A . 2 ARG CG 1 1 17 5587 1 1 2 ARG CZ C -2.211 5.770 8.898 1.00 . A A . 2 ARG CZ 1 1 17 5588 1 1 2 ARG H H -5.074 4.687 3.734 1.00 . A A . 2 ARG H 1 1 17 5589 1 1 2 ARG HA H -2.554 4.741 5.290 1.00 . A A . 2 ARG HA 1 1 17 5590 1 1 2 ARG HB2 H -4.782 4.576 6.458 1.00 . A A . 2 ARG HB2 1 1 17 5591 1 1 2 ARG HB3 H -5.132 3.111 5.579 1.00 . A A . 2 ARG HB3 1 1 17 5592 1 1 2 ARG HD2 H -2.095 2.988 8.618 1.00 . A A . 2 ARG HD2 1 1 17 5593 1 1 2 ARG HD3 H -1.745 3.812 7.107 1.00 . A A . 2 ARG HD3 1 1 17 5594 1 1 2 ARG HE H -3.994 5.034 8.434 1.00 . A A . 2 ARG HE 1 1 17 5595 1 1 2 ARG HG2 H -4.433 2.650 7.908 1.00 . A A . 2 ARG HG2 1 1 17 5596 1 1 2 ARG HG3 H -3.340 1.891 6.789 1.00 . A A . 2 ARG HG3 1 1 17 5597 1 1 2 ARG HH11 H -0.541 4.734 8.498 1.00 . A A . 2 ARG HH11 1 1 17 5598 1 1 2 ARG HH12 H -0.307 6.273 9.256 1.00 . A A . 2 ARG HH12 1 1 17 5599 1 1 2 ARG HH21 H -3.718 6.987 9.397 1.00 . A A . 2 ARG HH21 1 1 17 5600 1 1 2 ARG HH22 H -2.130 7.567 9.774 1.00 . A A . 2 ARG HH22 1 1 17 5601 1 1 2 ARG N N -4.149 4.946 3.927 1.00 . A A . 2 ARG N 1 1 17 5602 1 1 2 ARG NE N -3.028 4.868 8.412 1.00 . A A . 2 ARG NE 1 1 17 5603 1 1 2 ARG NH1 N -0.919 5.576 8.882 1.00 . A A . 2 ARG NH1 1 1 17 5604 1 1 2 ARG NH2 N -2.727 6.860 9.396 1.00 . A A . 2 ARG NH2 1 1 17 5605 1 1 2 ARG O O -2.671 1.833 4.629 1.00 . A A . 2 ARG O 1 1 17 5606 1 1 3 LEU C C -0.091 2.162 2.387 1.00 . A A . 3 LEU C 1 1 17 5607 1 1 3 LEU CA C -1.607 2.173 2.109 1.00 . A A . 3 LEU CA 1 1 17 5608 1 1 3 LEU CB C -1.892 2.464 0.597 1.00 . A A . 3 LEU CB 1 1 17 5609 1 1 3 LEU CD1 C -1.578 3.795 -1.503 1.00 . A A . 3 LEU CD1 1 1 17 5610 1 1 3 LEU CD2 C -1.460 5.032 0.688 1.00 . A A . 3 LEU CD2 1 1 17 5611 1 1 3 LEU CG C -1.161 3.702 -0.027 1.00 . A A . 3 LEU CG 1 1 17 5612 1 1 3 LEU H H -2.326 4.152 2.632 1.00 . A A . 3 LEU H 1 1 17 5613 1 1 3 LEU HA H -2.029 1.216 2.361 1.00 . A A . 3 LEU HA 1 1 17 5614 1 1 3 LEU HB2 H -1.627 1.584 0.029 1.00 . A A . 3 LEU HB2 1 1 17 5615 1 1 3 LEU HB3 H -2.958 2.606 0.486 1.00 . A A . 3 LEU HB3 1 1 17 5616 1 1 3 LEU HD11 H -2.649 3.915 -1.583 1.00 . A A . 3 LEU HD11 1 1 17 5617 1 1 3 LEU HD12 H -1.291 2.890 -2.018 1.00 . A A . 3 LEU HD12 1 1 17 5618 1 1 3 LEU HD13 H -1.093 4.634 -1.979 1.00 . A A . 3 LEU HD13 1 1 17 5619 1 1 3 LEU HD21 H -0.932 5.834 0.191 1.00 . A A . 3 LEU HD21 1 1 17 5620 1 1 3 LEU HD22 H -1.120 4.994 1.710 1.00 . A A . 3 LEU HD22 1 1 17 5621 1 1 3 LEU HD23 H -2.518 5.243 0.666 1.00 . A A . 3 LEU HD23 1 1 17 5622 1 1 3 LEU HG H -0.093 3.551 -0.007 1.00 . A A . 3 LEU HG 1 1 17 5623 1 1 3 LEU N N -2.248 3.232 2.952 1.00 . A A . 3 LEU N 1 1 17 5624 1 1 3 LEU O O 0.309 2.430 3.501 1.00 . A A . 3 LEU O 1 1 17 5625 1 1 4 CYS C C 2.781 2.839 2.416 1.00 . A A . 4 CYS C 1 1 17 5626 1 1 4 CYS CA C 2.187 1.792 1.463 1.00 . A A . 4 CYS CA 1 1 17 5627 1 1 4 CYS CB C 2.790 2.040 0.078 1.00 . A A . 4 CYS CB 1 1 17 5628 1 1 4 CYS H H 0.278 1.620 0.526 1.00 . A A . 4 CYS H 1 1 17 5629 1 1 4 CYS HA H 2.477 0.815 1.811 1.00 . A A . 4 CYS HA 1 1 17 5630 1 1 4 CYS HB2 H 2.686 3.070 -0.211 1.00 . A A . 4 CYS HB2 1 1 17 5631 1 1 4 CYS HB3 H 3.852 1.876 0.184 1.00 . A A . 4 CYS HB3 1 1 17 5632 1 1 4 CYS N N 0.692 1.846 1.381 1.00 . A A . 4 CYS N 1 1 17 5633 1 1 4 CYS O O 3.519 2.503 3.322 1.00 . A A . 4 CYS O 1 1 17 5634 1 1 4 CYS SG S 2.266 1.069 -1.351 1.00 . A A . 4 CYS SG 1 1 17 5635 1 1 5 CYS C C 1.997 5.375 4.232 1.00 . A A . 5 CYS C 1 1 17 5636 1 1 5 CYS CA C 2.942 5.196 3.027 1.00 . A A . 5 CYS CA 1 1 17 5637 1 1 5 CYS CB C 2.992 6.493 2.188 1.00 . A A . 5 CYS CB 1 1 17 5638 1 1 5 CYS H H 1.827 4.264 1.426 1.00 . A A . 5 CYS H 1 1 17 5639 1 1 5 CYS HA H 3.932 4.954 3.388 1.00 . A A . 5 CYS HA 1 1 17 5640 1 1 5 CYS HB2 H 3.472 6.276 1.245 1.00 . A A . 5 CYS HB2 1 1 17 5641 1 1 5 CYS HB3 H 1.985 6.822 1.978 1.00 . A A . 5 CYS HB3 1 1 17 5642 1 1 5 CYS N N 2.430 4.079 2.173 1.00 . A A . 5 CYS N 1 1 17 5643 1 1 5 CYS O O 1.630 6.475 4.599 1.00 . A A . 5 CYS O 1 1 17 5644 1 1 5 CYS SG S 3.882 7.862 2.970 1.00 . A A . 5 CYS SG 1 1 17 5645 1 1 6 GLY C C 0.978 3.019 6.865 1.00 . A A . 6 GLY C 1 1 17 5646 1 1 6 GLY CA C 0.721 4.249 5.990 1.00 . A A . 6 GLY CA 1 1 17 5647 1 1 6 GLY H H 1.966 3.405 4.467 1.00 . A A . 6 GLY H 1 1 17 5648 1 1 6 GLY HA2 H 0.876 5.142 6.579 1.00 . A A . 6 GLY HA2 1 1 17 5649 1 1 6 GLY HA3 H -0.297 4.225 5.633 1.00 . A A . 6 GLY HA3 1 1 17 5650 1 1 6 GLY N N 1.634 4.259 4.811 1.00 . A A . 6 GLY N 1 1 17 5651 1 1 6 GLY O O 0.816 3.095 8.068 1.00 . A A . 6 GLY O 1 1 17 5652 1 1 7 PHE C C 2.569 -0.355 6.353 1.00 . A A . 7 PHE C 1 1 17 5653 1 1 7 PHE CA C 1.639 0.680 7.042 1.00 . A A . 7 PHE CA 1 1 17 5654 1 1 7 PHE CB C 0.264 0.011 7.405 1.00 . A A . 7 PHE CB 1 1 17 5655 1 1 7 PHE CD1 C -0.323 -0.183 4.887 1.00 . A A . 7 PHE CD1 1 1 17 5656 1 1 7 PHE CD2 C -1.871 -0.970 6.504 1.00 . A A . 7 PHE CD2 1 1 17 5657 1 1 7 PHE CE1 C -1.183 -0.561 3.888 1.00 . A A . 7 PHE CE1 1 1 17 5658 1 1 7 PHE CE2 C -2.736 -1.349 5.496 1.00 . A A . 7 PHE CE2 1 1 17 5659 1 1 7 PHE CG C -0.651 -0.381 6.217 1.00 . A A . 7 PHE CG 1 1 17 5660 1 1 7 PHE CZ C -2.389 -1.144 4.180 1.00 . A A . 7 PHE CZ 1 1 17 5661 1 1 7 PHE H H 1.478 1.921 5.278 1.00 . A A . 7 PHE H 1 1 17 5662 1 1 7 PHE HA H 2.111 0.990 7.963 1.00 . A A . 7 PHE HA 1 1 17 5663 1 1 7 PHE HB2 H 0.455 -0.886 7.976 1.00 . A A . 7 PHE HB2 1 1 17 5664 1 1 7 PHE HB3 H -0.292 0.686 8.038 1.00 . A A . 7 PHE HB3 1 1 17 5665 1 1 7 PHE HD1 H 0.605 0.277 4.606 1.00 . A A . 7 PHE HD1 1 1 17 5666 1 1 7 PHE HD2 H -2.154 -1.136 7.534 1.00 . A A . 7 PHE HD2 1 1 17 5667 1 1 7 PHE HE1 H -0.905 -0.398 2.861 1.00 . A A . 7 PHE HE1 1 1 17 5668 1 1 7 PHE HE2 H -3.683 -1.806 5.741 1.00 . A A . 7 PHE HE2 1 1 17 5669 1 1 7 PHE HZ H -3.054 -1.431 3.378 1.00 . A A . 7 PHE HZ 1 1 17 5670 1 1 7 PHE N N 1.366 1.924 6.252 1.00 . A A . 7 PHE N 1 1 17 5671 1 1 7 PHE O O 2.569 -0.512 5.144 1.00 . A A . 7 PHE O 1 1 17 5672 1 1 8 HYP C C 3.701 -3.176 5.873 1.00 . A A . 8 HYP C 1 1 17 5673 1 1 8 HYP CA C 4.341 -2.029 6.670 1.00 . A A . 8 HYP CA 1 1 17 5674 1 1 8 HYP CB C 5.066 -2.511 7.926 1.00 . A A . 8 HYP CB 1 1 17 5675 1 1 8 HYP CD C 3.381 -0.993 8.639 1.00 . A A . 8 HYP CD 1 1 17 5676 1 1 8 HYP CG C 4.090 -2.260 9.020 1.00 . A A . 8 HYP CG 1 1 17 5677 1 1 8 HYP HA H 5.072 -1.543 6.043 1.00 . A A . 8 HYP HA 1 1 17 5678 1 1 8 HYP HB2 H 5.981 -1.950 8.061 1.00 . A A . 8 HYP HB2 1 1 17 5679 1 1 8 HYP HB3 H 5.327 -3.556 7.848 1.00 . A A . 8 HYP HB3 1 1 17 5680 1 1 8 HYP HD1 H 4.143 -1.745 10.894 1.00 . A A . 8 HYP HD1 1 1 17 5681 1 1 8 HYP HD22 H 3.933 -0.128 8.978 1.00 . A A . 8 HYP HD22 1 1 17 5682 1 1 8 HYP HD23 H 2.385 -0.993 9.057 1.00 . A A . 8 HYP HD23 1 1 17 5683 1 1 8 HYP HG H 3.386 -3.078 9.080 1.00 . A A . 8 HYP HG 1 1 17 5684 1 1 8 HYP N N 3.348 -1.049 7.160 1.00 . A A . 8 HYP N 1 1 17 5685 1 1 8 HYP O O 4.405 -3.959 5.265 1.00 . A A . 8 HYP O 1 1 17 5686 1 1 8 HYP OD1 O 4.766 -2.107 10.260 1.00 . A A . 8 HYP OD1 1 1 17 5687 1 1 9 LYS C C 1.813 -4.120 3.675 1.00 . A A . 9 LYS C 1 1 17 5688 1 1 9 LYS CA C 1.638 -4.279 5.185 1.00 . A A . 9 LYS CA 1 1 17 5689 1 1 9 LYS CB C 0.144 -4.186 5.558 1.00 . A A . 9 LYS CB 1 1 17 5690 1 1 9 LYS CD C -1.503 -4.386 7.463 1.00 . A A . 9 LYS CD 1 1 17 5691 1 1 9 LYS CE C -1.653 -4.561 8.984 1.00 . A A . 9 LYS CE 1 1 17 5692 1 1 9 LYS CG C -0.008 -4.397 7.081 1.00 . A A . 9 LYS CG 1 1 17 5693 1 1 9 LYS H H 1.895 -2.547 6.418 1.00 . A A . 9 LYS H 1 1 17 5694 1 1 9 LYS HA H 2.028 -5.244 5.479 1.00 . A A . 9 LYS HA 1 1 17 5695 1 1 9 LYS HB2 H -0.241 -3.213 5.286 1.00 . A A . 9 LYS HB2 1 1 17 5696 1 1 9 LYS HB3 H -0.416 -4.941 5.026 1.00 . A A . 9 LYS HB3 1 1 17 5697 1 1 9 LYS HD2 H -1.960 -3.457 7.163 1.00 . A A . 9 LYS HD2 1 1 17 5698 1 1 9 LYS HD3 H -2.013 -5.196 6.960 1.00 . A A . 9 LYS HD3 1 1 17 5699 1 1 9 LYS HE2 H -1.151 -3.759 9.506 1.00 . A A . 9 LYS HE2 1 1 17 5700 1 1 9 LYS HE3 H -2.697 -4.555 9.256 1.00 . A A . 9 LYS HE3 1 1 17 5701 1 1 9 LYS HG2 H 0.434 -5.345 7.358 1.00 . A A . 9 LYS HG2 1 1 17 5702 1 1 9 LYS HG3 H 0.504 -3.609 7.613 1.00 . A A . 9 LYS HG3 1 1 17 5703 1 1 9 LYS HZ1 H -1.409 -6.097 10.370 1.00 . A A . 9 LYS HZ1 1 1 17 5704 1 1 9 LYS HZ2 H -0.022 -5.771 9.446 1.00 . A A . 9 LYS HZ2 1 1 17 5705 1 1 9 LYS HZ3 H -1.328 -6.605 8.751 1.00 . A A . 9 LYS HZ3 1 1 17 5706 1 1 9 LYS N N 2.391 -3.220 5.910 1.00 . A A . 9 LYS N 1 1 17 5707 1 1 9 LYS NZ N -1.058 -5.857 9.421 1.00 . A A . 9 LYS NZ 1 1 17 5708 1 1 9 LYS O O 2.046 -5.104 2.998 1.00 . A A . 9 LYS O 1 1 17 5709 1 1 10 SER C C 3.304 -2.308 1.394 1.00 . A A . 10 SER C 1 1 17 5710 1 1 10 SER CA C 1.866 -2.712 1.707 1.00 . A A . 10 SER CA 1 1 17 5711 1 1 10 SER CB C 0.891 -1.629 1.238 1.00 . A A . 10 SER CB 1 1 17 5712 1 1 10 SER H H 1.517 -2.124 3.752 1.00 . A A . 10 SER H 1 1 17 5713 1 1 10 SER HA H 1.645 -3.634 1.187 1.00 . A A . 10 SER HA 1 1 17 5714 1 1 10 SER HB2 H 1.000 -0.722 1.810 1.00 . A A . 10 SER HB2 1 1 17 5715 1 1 10 SER HB3 H 0.982 -1.426 0.181 1.00 . A A . 10 SER HB3 1 1 17 5716 1 1 10 SER HG H -0.431 -2.406 2.438 1.00 . A A . 10 SER HG 1 1 17 5717 1 1 10 SER N N 1.701 -2.908 3.180 1.00 . A A . 10 SER N 1 1 17 5718 1 1 10 SER O O 3.881 -2.798 0.446 1.00 . A A . 10 SER O 1 1 17 5719 1 1 10 SER OG O -0.383 -2.203 1.501 1.00 . A A . 10 SER OG 1 1 17 5720 1 1 11 CYS C C 6.298 -1.969 1.743 1.00 . A A . 11 CYS C 1 1 17 5721 1 1 11 CYS CA C 5.231 -0.903 2.073 1.00 . A A . 11 CYS CA 1 1 17 5722 1 1 11 CYS CB C 5.567 -0.207 3.385 1.00 . A A . 11 CYS CB 1 1 17 5723 1 1 11 CYS H H 3.278 -1.101 2.953 1.00 . A A . 11 CYS H 1 1 17 5724 1 1 11 CYS HA H 5.233 -0.166 1.285 1.00 . A A . 11 CYS HA 1 1 17 5725 1 1 11 CYS HB2 H 4.786 0.505 3.598 1.00 . A A . 11 CYS HB2 1 1 17 5726 1 1 11 CYS HB3 H 5.521 -0.962 4.152 1.00 . A A . 11 CYS HB3 1 1 17 5727 1 1 11 CYS N N 3.829 -1.431 2.212 1.00 . A A . 11 CYS N 1 1 17 5728 1 1 11 CYS O O 7.330 -1.651 1.183 1.00 . A A . 11 CYS O 1 1 17 5729 1 1 11 CYS SG S 7.149 0.645 3.606 1.00 . A A . 11 CYS SG 1 1 17 5730 1 1 12 ARG C C 6.639 -4.989 0.479 1.00 . A A . 12 ARG C 1 1 17 5731 1 1 12 ARG CA C 6.943 -4.341 1.854 1.00 . A A . 12 ARG CA 1 1 17 5732 1 1 12 ARG CB C 6.740 -5.316 3.050 1.00 . A A . 12 ARG CB 1 1 17 5733 1 1 12 ARG CD C 7.457 -7.394 4.267 1.00 . A A . 12 ARG CD 1 1 17 5734 1 1 12 ARG CG C 7.705 -6.527 3.017 1.00 . A A . 12 ARG CG 1 1 17 5735 1 1 12 ARG CZ C 9.649 -8.467 4.558 1.00 . A A . 12 ARG CZ 1 1 17 5736 1 1 12 ARG H H 5.153 -3.369 2.542 1.00 . A A . 12 ARG H 1 1 17 5737 1 1 12 ARG HA H 7.962 -3.978 1.848 1.00 . A A . 12 ARG HA 1 1 17 5738 1 1 12 ARG HB2 H 6.895 -4.769 3.969 1.00 . A A . 12 ARG HB2 1 1 17 5739 1 1 12 ARG HB3 H 5.720 -5.672 3.041 1.00 . A A . 12 ARG HB3 1 1 17 5740 1 1 12 ARG HD2 H 7.628 -6.830 5.172 1.00 . A A . 12 ARG HD2 1 1 17 5741 1 1 12 ARG HD3 H 6.441 -7.761 4.271 1.00 . A A . 12 ARG HD3 1 1 17 5742 1 1 12 ARG HE H 8.035 -9.443 3.953 1.00 . A A . 12 ARG HE 1 1 17 5743 1 1 12 ARG HG2 H 7.530 -7.146 2.152 1.00 . A A . 12 ARG HG2 1 1 17 5744 1 1 12 ARG HG3 H 8.728 -6.182 2.997 1.00 . A A . 12 ARG HG3 1 1 17 5745 1 1 12 ARG HH11 H 9.569 -6.506 4.972 1.00 . A A . 12 ARG HH11 1 1 17 5746 1 1 12 ARG HH12 H 11.115 -7.255 5.181 1.00 . A A . 12 ARG HH12 1 1 17 5747 1 1 12 ARG HH21 H 9.983 -10.408 4.211 1.00 . A A . 12 ARG HH21 1 1 17 5748 1 1 12 ARG HH22 H 11.355 -9.495 4.744 1.00 . A A . 12 ARG HH22 1 1 17 5749 1 1 12 ARG N N 6.009 -3.195 2.102 1.00 . A A . 12 ARG N 1 1 17 5750 1 1 12 ARG NE N 8.384 -8.570 4.229 1.00 . A A . 12 ARG NE 1 1 17 5751 1 1 12 ARG NH1 N 10.150 -7.319 4.933 1.00 . A A . 12 ARG NH1 1 1 17 5752 1 1 12 ARG NH2 N 10.386 -9.541 4.501 1.00 . A A . 12 ARG NH2 1 1 17 5753 1 1 12 ARG O O 6.980 -6.127 0.224 1.00 . A A . 12 ARG O 1 1 17 5754 1 1 13 SER C C 6.398 -3.953 -2.833 1.00 . A A . 13 SER C 1 1 17 5755 1 1 13 SER CA C 5.637 -4.722 -1.749 1.00 . A A . 13 SER CA 1 1 17 5756 1 1 13 SER CB C 4.118 -4.543 -1.956 1.00 . A A . 13 SER CB 1 1 17 5757 1 1 13 SER H H 5.761 -3.318 -0.115 1.00 . A A . 13 SER H 1 1 17 5758 1 1 13 SER HA H 5.884 -5.770 -1.835 1.00 . A A . 13 SER HA 1 1 17 5759 1 1 13 SER HB2 H 3.549 -5.106 -1.229 1.00 . A A . 13 SER HB2 1 1 17 5760 1 1 13 SER HB3 H 3.834 -3.501 -1.921 1.00 . A A . 13 SER HB3 1 1 17 5761 1 1 13 SER HG H 4.471 -5.757 -3.445 1.00 . A A . 13 SER HG 1 1 17 5762 1 1 13 SER N N 6.002 -4.230 -0.379 1.00 . A A . 13 SER N 1 1 17 5763 1 1 13 SER O O 6.805 -2.824 -2.632 1.00 . A A . 13 SER O 1 1 17 5764 1 1 13 SER OG O 3.851 -5.047 -3.259 1.00 . A A . 13 SER OG 1 1 17 5765 1 1 14 ARG C C 6.436 -2.806 -5.617 1.00 . A A . 14 ARG C 1 1 17 5766 1 1 14 ARG CA C 7.275 -3.992 -5.114 1.00 . A A . 14 ARG CA 1 1 17 5767 1 1 14 ARG CB C 7.440 -5.055 -6.224 1.00 . A A . 14 ARG CB 1 1 17 5768 1 1 14 ARG CD C 9.628 -4.036 -7.066 1.00 . A A . 14 ARG CD 1 1 17 5769 1 1 14 ARG CG C 8.199 -4.487 -7.455 1.00 . A A . 14 ARG CG 1 1 17 5770 1 1 14 ARG CZ C 10.106 -2.271 -8.708 1.00 . A A . 14 ARG CZ 1 1 17 5771 1 1 14 ARG H H 6.199 -5.518 -4.039 1.00 . A A . 14 ARG H 1 1 17 5772 1 1 14 ARG HA H 8.233 -3.635 -4.771 1.00 . A A . 14 ARG HA 1 1 17 5773 1 1 14 ARG HB2 H 7.981 -5.902 -5.828 1.00 . A A . 14 ARG HB2 1 1 17 5774 1 1 14 ARG HB3 H 6.463 -5.396 -6.540 1.00 . A A . 14 ARG HB3 1 1 17 5775 1 1 14 ARG HD2 H 9.615 -3.273 -6.305 1.00 . A A . 14 ARG HD2 1 1 17 5776 1 1 14 ARG HD3 H 10.198 -4.881 -6.705 1.00 . A A . 14 ARG HD3 1 1 17 5777 1 1 14 ARG HE H 10.927 -4.071 -8.782 1.00 . A A . 14 ARG HE 1 1 17 5778 1 1 14 ARG HG2 H 8.263 -5.255 -8.210 1.00 . A A . 14 ARG HG2 1 1 17 5779 1 1 14 ARG HG3 H 7.654 -3.652 -7.873 1.00 . A A . 14 ARG HG3 1 1 17 5780 1 1 14 ARG HH11 H 8.808 -1.789 -7.258 1.00 . A A . 14 ARG HH11 1 1 17 5781 1 1 14 ARG HH12 H 9.148 -0.539 -8.407 1.00 . A A . 14 ARG HH12 1 1 17 5782 1 1 14 ARG HH21 H 11.362 -2.506 -10.246 1.00 . A A . 14 ARG HH21 1 1 17 5783 1 1 14 ARG HH22 H 10.610 -0.950 -10.124 1.00 . A A . 14 ARG HH22 1 1 17 5784 1 1 14 ARG N N 6.557 -4.610 -3.957 1.00 . A A . 14 ARG N 1 1 17 5785 1 1 14 ARG NE N 10.310 -3.495 -8.285 1.00 . A A . 14 ARG NE 1 1 17 5786 1 1 14 ARG NH1 N 9.290 -1.471 -8.074 1.00 . A A . 14 ARG NH1 1 1 17 5787 1 1 14 ARG NH2 N 10.743 -1.879 -9.776 1.00 . A A . 14 ARG NH2 1 1 17 5788 1 1 14 ARG O O 6.960 -1.860 -6.169 1.00 . A A . 14 ARG O 1 1 17 5789 1 1 15 GLN C C 4.540 -0.566 -5.023 1.00 . A A . 15 GLN C 1 1 17 5790 1 1 15 GLN CA C 4.204 -1.829 -5.831 1.00 . A A . 15 GLN CA 1 1 17 5791 1 1 15 GLN CB C 2.767 -2.291 -5.539 1.00 . A A . 15 GLN CB 1 1 17 5792 1 1 15 GLN CD C 0.330 -1.688 -5.668 1.00 . A A . 15 GLN CD 1 1 17 5793 1 1 15 GLN CG C 1.754 -1.214 -5.985 1.00 . A A . 15 GLN CG 1 1 17 5794 1 1 15 GLN H H 4.795 -3.703 -4.956 1.00 . A A . 15 GLN H 1 1 17 5795 1 1 15 GLN HA H 4.344 -1.631 -6.884 1.00 . A A . 15 GLN HA 1 1 17 5796 1 1 15 GLN HB2 H 2.581 -3.213 -6.070 1.00 . A A . 15 GLN HB2 1 1 17 5797 1 1 15 GLN HB3 H 2.656 -2.480 -4.480 1.00 . A A . 15 GLN HB3 1 1 17 5798 1 1 15 GLN HE21 H 0.552 -3.422 -6.610 1.00 . A A . 15 GLN HE21 1 1 17 5799 1 1 15 GLN HE22 H -0.969 -3.171 -5.901 1.00 . A A . 15 GLN HE22 1 1 17 5800 1 1 15 GLN HG2 H 1.931 -0.285 -5.462 1.00 . A A . 15 GLN HG2 1 1 17 5801 1 1 15 GLN HG3 H 1.830 -1.039 -7.048 1.00 . A A . 15 GLN HG3 1 1 17 5802 1 1 15 GLN N N 5.148 -2.906 -5.404 1.00 . A A . 15 GLN N 1 1 17 5803 1 1 15 GLN NE2 N -0.062 -2.857 -6.095 1.00 . A A . 15 GLN NE2 1 1 17 5804 1 1 15 GLN O O 4.470 0.538 -5.528 1.00 . A A . 15 GLN O 1 1 17 5805 1 1 15 GLN OE1 O -0.439 -0.998 -5.030 1.00 . A A . 15 GLN OE1 1 1 17 5806 1 1 16 CYS C C 6.736 0.708 -2.942 1.00 . A A . 16 CYS C 1 1 17 5807 1 1 16 CYS CA C 5.259 0.298 -2.848 1.00 . A A . 16 CYS CA 1 1 17 5808 1 1 16 CYS CB C 4.967 -0.152 -1.441 1.00 . A A . 16 CYS CB 1 1 17 5809 1 1 16 CYS H H 4.916 -1.721 -3.458 1.00 . A A . 16 CYS H 1 1 17 5810 1 1 16 CYS HA H 4.641 1.152 -3.062 1.00 . A A . 16 CYS HA 1 1 17 5811 1 1 16 CYS HB2 H 5.604 -0.975 -1.180 1.00 . A A . 16 CYS HB2 1 1 17 5812 1 1 16 CYS HB3 H 5.227 0.661 -0.781 1.00 . A A . 16 CYS HB3 1 1 17 5813 1 1 16 CYS N N 4.894 -0.799 -3.784 1.00 . A A . 16 CYS N 1 1 17 5814 1 1 16 CYS O O 7.102 1.765 -2.465 1.00 . A A . 16 CYS O 1 1 17 5815 1 1 16 CYS SG S 3.275 -0.644 -1.044 1.00 . A A . 16 CYS SG 1 1 17 5816 1 1 17 LYS C C 9.244 1.564 -4.306 1.00 . A A . 17 LYS C 1 1 17 5817 1 1 17 LYS CA C 9.000 0.160 -3.695 1.00 . A A . 17 LYS CA 1 1 17 5818 1 1 17 LYS CB C 9.589 -1.009 -4.556 1.00 . A A . 17 LYS CB 1 1 17 5819 1 1 17 LYS CD C 11.570 0.212 -5.714 1.00 . A A . 17 LYS CD 1 1 17 5820 1 1 17 LYS CE C 13.076 0.091 -5.983 1.00 . A A . 17 LYS CE 1 1 17 5821 1 1 17 LYS CG C 11.124 -0.967 -4.816 1.00 . A A . 17 LYS CG 1 1 17 5822 1 1 17 LYS H H 7.177 -0.970 -3.906 1.00 . A A . 17 LYS H 1 1 17 5823 1 1 17 LYS HA H 9.454 0.119 -2.716 1.00 . A A . 17 LYS HA 1 1 17 5824 1 1 17 LYS HB2 H 9.379 -1.931 -4.035 1.00 . A A . 17 LYS HB2 1 1 17 5825 1 1 17 LYS HB3 H 9.092 -1.059 -5.505 1.00 . A A . 17 LYS HB3 1 1 17 5826 1 1 17 LYS HD2 H 11.021 0.209 -6.645 1.00 . A A . 17 LYS HD2 1 1 17 5827 1 1 17 LYS HD3 H 11.420 1.156 -5.221 1.00 . A A . 17 LYS HD3 1 1 17 5828 1 1 17 LYS HE2 H 13.631 0.137 -5.056 1.00 . A A . 17 LYS HE2 1 1 17 5829 1 1 17 LYS HE3 H 13.298 -0.842 -6.481 1.00 . A A . 17 LYS HE3 1 1 17 5830 1 1 17 LYS HG2 H 11.634 -0.897 -3.865 1.00 . A A . 17 LYS HG2 1 1 17 5831 1 1 17 LYS HG3 H 11.418 -1.896 -5.282 1.00 . A A . 17 LYS HG3 1 1 17 5832 1 1 17 LYS HZ1 H 13.029 1.152 -7.770 1.00 . A A . 17 LYS HZ1 1 1 17 5833 1 1 17 LYS HZ2 H 14.547 1.146 -7.009 1.00 . A A . 17 LYS HZ2 1 1 17 5834 1 1 17 LYS HZ3 H 13.293 2.117 -6.398 1.00 . A A . 17 LYS HZ3 1 1 17 5835 1 1 17 LYS N N 7.540 -0.133 -3.546 1.00 . A A . 17 LYS N 1 1 17 5836 1 1 17 LYS NZ N 13.520 1.212 -6.856 1.00 . A A . 17 LYS NZ 1 1 17 5837 1 1 17 LYS O O 10.013 2.318 -3.738 1.00 . A A . 17 LYS O 1 1 17 5838 1 1 18 HYP C C 8.129 4.399 -5.291 1.00 . A A . 18 HYP C 1 1 17 5839 1 1 18 HYP CA C 8.796 3.225 -6.046 1.00 . A A . 18 HYP CA 1 1 17 5840 1 1 18 HYP CB C 8.254 3.025 -7.461 1.00 . A A . 18 HYP CB 1 1 17 5841 1 1 18 HYP CD C 7.659 1.093 -6.201 1.00 . A A . 18 HYP CD 1 1 17 5842 1 1 18 HYP CG C 7.171 2.024 -7.274 1.00 . A A . 18 HYP CG 1 1 17 5843 1 1 18 HYP HA H 9.849 3.451 -6.137 1.00 . A A . 18 HYP HA 1 1 17 5844 1 1 18 HYP HB2 H 9.039 2.660 -8.109 1.00 . A A . 18 HYP HB2 1 1 17 5845 1 1 18 HYP HB3 H 7.884 3.950 -7.878 1.00 . A A . 18 HYP HB3 1 1 17 5846 1 1 18 HYP HD1 H 6.078 0.906 -8.428 1.00 . A A . 18 HYP HD1 1 1 17 5847 1 1 18 HYP HD22 H 8.155 0.255 -6.661 1.00 . A A . 18 HYP HD22 1 1 17 5848 1 1 18 HYP HD23 H 6.829 0.766 -5.600 1.00 . A A . 18 HYP HD23 1 1 17 5849 1 1 18 HYP HG H 6.262 2.519 -6.963 1.00 . A A . 18 HYP HG 1 1 17 5850 1 1 18 HYP N N 8.612 1.903 -5.412 1.00 . A A . 18 HYP N 1 1 17 5851 1 1 18 HYP O O 7.920 5.437 -5.889 1.00 . A A . 18 HYP O 1 1 17 5852 1 1 18 HYP OD1 O 6.947 1.309 -8.481 1.00 . A A . 18 HYP OD1 1 1 17 5853 1 1 19 HIS C C 8.237 6.092 -2.466 1.00 . A A . 19 HIS C 1 1 17 5854 1 1 19 HIS CA C 7.174 5.311 -3.237 1.00 . A A . 19 HIS CA 1 1 17 5855 1 1 19 HIS CB C 6.158 4.727 -2.233 1.00 . A A . 19 HIS CB 1 1 17 5856 1 1 19 HIS CD2 C 4.906 3.384 -4.170 1.00 . A A . 19 HIS CD2 1 1 17 5857 1 1 19 HIS CE1 C 2.994 3.457 -3.376 1.00 . A A . 19 HIS CE1 1 1 17 5858 1 1 19 HIS CG C 4.980 4.074 -2.971 1.00 . A A . 19 HIS CG 1 1 17 5859 1 1 19 HIS H H 8.004 3.353 -3.592 1.00 . A A . 19 HIS H 1 1 17 5860 1 1 19 HIS HA H 6.663 5.989 -3.907 1.00 . A A . 19 HIS HA 1 1 17 5861 1 1 19 HIS HB2 H 6.631 3.988 -1.604 1.00 . A A . 19 HIS HB2 1 1 17 5862 1 1 19 HIS HB3 H 5.772 5.515 -1.604 1.00 . A A . 19 HIS HB3 1 1 17 5863 1 1 19 HIS HD1 H 3.464 4.490 -1.701 1.00 . A A . 19 HIS HD1 1 1 17 5864 1 1 19 HIS HD2 H 5.740 3.176 -4.818 1.00 . A A . 19 HIS HD2 1 1 17 5865 1 1 19 HIS HE1 H 1.931 3.324 -3.241 1.00 . A A . 19 HIS HE1 1 1 17 5866 1 1 19 HIS N N 7.818 4.212 -4.029 1.00 . A A . 19 HIS N 1 1 17 5867 1 1 19 HIS ND1 N 3.762 4.078 -2.538 1.00 . A A . 19 HIS ND1 1 1 17 5868 1 1 19 HIS NE2 N 3.665 3.008 -4.406 1.00 . A A . 19 HIS NE2 1 1 17 5869 1 1 19 HIS O O 9.209 5.522 -2.010 1.00 . A A . 19 HIS O 1 1 17 5870 1 1 20 ARG C C 8.920 7.990 -0.075 1.00 . A A . 20 ARG C 1 1 17 5871 1 1 20 ARG CA C 8.997 8.245 -1.594 1.00 . A A . 20 ARG CA 1 1 17 5872 1 1 20 ARG CB C 8.673 9.728 -1.898 1.00 . A A . 20 ARG CB 1 1 17 5873 1 1 20 ARG CD C 10.111 9.892 -4.071 1.00 . A A . 20 ARG CD 1 1 17 5874 1 1 20 ARG CG C 8.712 10.077 -3.419 1.00 . A A . 20 ARG CG 1 1 17 5875 1 1 20 ARG CZ C 10.044 7.579 -4.896 1.00 . A A . 20 ARG CZ 1 1 17 5876 1 1 20 ARG H H 7.218 7.777 -2.723 1.00 . A A . 20 ARG H 1 1 17 5877 1 1 20 ARG HA H 10.001 7.999 -1.899 1.00 . A A . 20 ARG HA 1 1 17 5878 1 1 20 ARG HB2 H 7.687 9.955 -1.517 1.00 . A A . 20 ARG HB2 1 1 17 5879 1 1 20 ARG HB3 H 9.381 10.358 -1.382 1.00 . A A . 20 ARG HB3 1 1 17 5880 1 1 20 ARG HD2 H 10.098 10.238 -5.094 1.00 . A A . 20 ARG HD2 1 1 17 5881 1 1 20 ARG HD3 H 10.847 10.463 -3.526 1.00 . A A . 20 ARG HD3 1 1 17 5882 1 1 20 ARG HE H 11.162 8.152 -3.367 1.00 . A A . 20 ARG HE 1 1 17 5883 1 1 20 ARG HG2 H 7.991 9.467 -3.943 1.00 . A A . 20 ARG HG2 1 1 17 5884 1 1 20 ARG HG3 H 8.417 11.109 -3.537 1.00 . A A . 20 ARG HG3 1 1 17 5885 1 1 20 ARG HH11 H 8.884 8.893 -5.872 1.00 . A A . 20 ARG HH11 1 1 17 5886 1 1 20 ARG HH12 H 8.833 7.266 -6.459 1.00 . A A . 20 ARG HH12 1 1 17 5887 1 1 20 ARG HH21 H 11.108 6.094 -4.081 1.00 . A A . 20 ARG HH21 1 1 17 5888 1 1 20 ARG HH22 H 10.115 5.652 -5.430 1.00 . A A . 20 ARG HH22 1 1 17 5889 1 1 20 ARG N N 8.024 7.377 -2.334 1.00 . A A . 20 ARG N 1 1 17 5890 1 1 20 ARG NE N 10.520 8.453 -4.044 1.00 . A A . 20 ARG NE 1 1 17 5891 1 1 20 ARG NH1 N 9.187 7.942 -5.813 1.00 . A A . 20 ARG NH1 1 1 17 5892 1 1 20 ARG NH2 N 10.454 6.344 -4.795 1.00 . A A . 20 ARG NH2 1 1 17 5893 1 1 20 ARG O O 9.568 8.671 0.696 1.00 . A A . 20 ARG O 1 1 17 5894 1 1 21 CYS C C 8.479 5.218 1.946 1.00 . A A . 21 CYS C 1 1 17 5895 1 1 21 CYS CA C 7.947 6.644 1.737 1.00 . A A . 21 CYS CA 1 1 17 5896 1 1 21 CYS CB C 6.467 6.653 2.094 1.00 . A A . 21 CYS CB 1 1 17 5897 1 1 21 CYS H H 7.635 6.508 -0.378 1.00 . A A . 21 CYS H 1 1 17 5898 1 1 21 CYS HA H 8.514 7.315 2.363 1.00 . A A . 21 CYS HA 1 1 17 5899 1 1 21 CYS HB2 H 6.001 5.809 1.606 1.00 . A A . 21 CYS HB2 1 1 17 5900 1 1 21 CYS HB3 H 6.387 6.488 3.158 1.00 . A A . 21 CYS HB3 1 1 17 5901 1 1 21 CYS N N 8.128 7.015 0.299 1.00 . A A . 21 CYS N 1 1 17 5902 1 1 21 CYS O O 8.825 4.838 3.048 1.00 . A A . 21 CYS O 1 1 17 5903 1 1 21 CYS SG S 5.443 8.094 1.709 1.00 . A A . 21 CYS SG 1 1 17 5904 1 1 22 . C C 9.758 2.797 -0.411 1.00 . A A . 22 CY3 C 1 1 17 5905 1 1 22 . CA C 9.002 3.067 0.884 1.00 . A A . 22 CY3 CA 1 1 17 5906 1 1 22 . CB C 7.755 2.175 1.044 1.00 . A A . 22 CY3 CB 1 1 17 5907 1 1 22 . H H 8.239 4.857 0.003 1.00 . A A . 22 CY3 H 1 1 17 5908 1 1 22 . HA H 9.678 2.925 1.715 1.00 . A A . 22 CY3 HA 1 1 17 5909 1 1 22 . HB2 H 8.038 1.139 0.933 1.00 . A A . 22 CY3 HB2 1 1 17 5910 1 1 22 . HB3 H 7.056 2.410 0.256 1.00 . A A . 22 CY3 HB3 1 1 17 5911 1 1 22 . HN11 H 10.736 4.513 -0.259 1.00 . A A . 22 CY3 HN11 1 1 17 5912 1 1 22 . HN12 H 11.113 3.588 -1.624 1.00 . A A . 22 CY3 HN12 1 1 17 5913 1 1 22 . N N 8.522 4.479 0.863 1.00 . A A . 22 CY3 N 1 1 17 5914 1 1 22 . N1 N 10.607 3.705 -0.799 1.00 . A A . 22 CY3 N1 1 1 17 5915 1 1 22 . O O 9.588 1.792 -1.068 1.00 . A A . 22 CY3 O 1 1 17 5916 1 1 22 . SG S 6.895 2.391 2.623 1.00 . A A . 22 CY3 SG 1 1 18 5917 1 1 1 PCA C C -2.308 5.152 -1.404 1.00 . A A . 1 PCA C 1 1 18 5918 1 1 1 PCA CA C -3.384 4.936 -2.478 1.00 . A A . 1 PCA CA 1 1 18 5919 1 1 1 PCA CB C -2.901 4.048 -3.638 1.00 . A A . 1 PCA CB 1 1 18 5920 1 1 1 PCA CD C -3.393 6.207 -4.501 1.00 . A A . 1 PCA CD 1 1 18 5921 1 1 1 PCA CG C -2.530 4.999 -4.767 1.00 . A A . 1 PCA CG 1 1 18 5922 1 1 1 PCA HA H -4.256 4.487 -2.025 1.00 . A A . 1 PCA HA 1 1 18 5923 1 1 1 PCA HB2 H -3.694 3.376 -3.933 1.00 . A A . 1 PCA HB2 1 1 18 5924 1 1 1 PCA HB3 H -2.059 3.442 -3.333 1.00 . A A . 1 PCA HB3 1 1 18 5925 1 1 1 PCA HG2 H -2.767 4.559 -5.724 1.00 . A A . 1 PCA HG2 1 1 18 5926 1 1 1 PCA HG3 H -1.483 5.260 -4.715 1.00 . A A . 1 PCA HG3 1 1 18 5927 1 1 1 PCA N N -3.783 6.218 -3.094 1.00 . A A . 1 PCA N 1 1 18 5928 1 1 1 PCA O O -1.164 5.403 -1.734 1.00 . A A . 1 PCA O 1 1 18 5929 1 1 1 PCA OE O -3.708 7.034 -5.334 1.00 . A A . 1 PCA OE 1 1 18 5930 1 1 2 ARG C C -1.838 3.940 1.824 1.00 . A A . 2 ARG C 1 1 18 5931 1 1 2 ARG CA C -1.791 5.230 0.985 1.00 . A A . 2 ARG CA 1 1 18 5932 1 1 2 ARG CB C -2.273 6.471 1.774 1.00 . A A . 2 ARG CB 1 1 18 5933 1 1 2 ARG CD C -1.786 8.020 3.729 1.00 . A A . 2 ARG CD 1 1 18 5934 1 1 2 ARG CG C -1.293 6.797 2.928 1.00 . A A . 2 ARG CG 1 1 18 5935 1 1 2 ARG CZ C -2.964 9.605 2.248 1.00 . A A . 2 ARG CZ 1 1 18 5936 1 1 2 ARG H H -3.665 4.843 0.011 1.00 . A A . 2 ARG H 1 1 18 5937 1 1 2 ARG HA H -0.782 5.377 0.627 1.00 . A A . 2 ARG HA 1 1 18 5938 1 1 2 ARG HB2 H -2.324 7.308 1.094 1.00 . A A . 2 ARG HB2 1 1 18 5939 1 1 2 ARG HB3 H -3.262 6.290 2.170 1.00 . A A . 2 ARG HB3 1 1 18 5940 1 1 2 ARG HD2 H -2.752 7.831 4.173 1.00 . A A . 2 ARG HD2 1 1 18 5941 1 1 2 ARG HD3 H -1.085 8.237 4.522 1.00 . A A . 2 ARG HD3 1 1 18 5942 1 1 2 ARG HE H -1.036 9.733 2.666 1.00 . A A . 2 ARG HE 1 1 18 5943 1 1 2 ARG HG2 H -1.206 5.957 3.597 1.00 . A A . 2 ARG HG2 1 1 18 5944 1 1 2 ARG HG3 H -0.316 7.008 2.518 1.00 . A A . 2 ARG HG3 1 1 18 5945 1 1 2 ARG HH11 H -4.113 8.145 3.011 1.00 . A A . 2 ARG HH11 1 1 18 5946 1 1 2 ARG HH12 H -4.919 9.273 1.977 1.00 . A A . 2 ARG HH12 1 1 18 5947 1 1 2 ARG HH21 H -2.046 11.145 1.360 1.00 . A A . 2 ARG HH21 1 1 18 5948 1 1 2 ARG HH22 H -3.738 10.988 1.025 1.00 . A A . 2 ARG HH22 1 1 18 5949 1 1 2 ARG N N -2.724 5.046 -0.167 1.00 . A A . 2 ARG N 1 1 18 5950 1 1 2 ARG NE N -1.854 9.217 2.828 1.00 . A A . 2 ARG NE 1 1 18 5951 1 1 2 ARG NH1 N -4.085 8.956 2.427 1.00 . A A . 2 ARG NH1 1 1 18 5952 1 1 2 ARG NH2 N -2.912 10.662 1.485 1.00 . A A . 2 ARG NH2 1 1 18 5953 1 1 2 ARG O O -2.248 3.931 2.970 1.00 . A A . 2 ARG O 1 1 18 5954 1 1 3 LEU C C 0.030 1.392 2.437 1.00 . A A . 3 LEU C 1 1 18 5955 1 1 3 LEU CA C -1.385 1.538 1.873 1.00 . A A . 3 LEU CA 1 1 18 5956 1 1 3 LEU CB C -1.634 0.376 0.861 1.00 . A A . 3 LEU CB 1 1 18 5957 1 1 3 LEU CD1 C -4.179 0.609 0.972 1.00 . A A . 3 LEU CD1 1 1 18 5958 1 1 3 LEU CD2 C -2.922 1.567 -1.036 1.00 . A A . 3 LEU CD2 1 1 18 5959 1 1 3 LEU CG C -2.958 0.463 0.047 1.00 . A A . 3 LEU CG 1 1 18 5960 1 1 3 LEU H H -1.095 2.952 0.273 1.00 . A A . 3 LEU H 1 1 18 5961 1 1 3 LEU HA H -2.094 1.524 2.684 1.00 . A A . 3 LEU HA 1 1 18 5962 1 1 3 LEU HB2 H -0.813 0.326 0.162 1.00 . A A . 3 LEU HB2 1 1 18 5963 1 1 3 LEU HB3 H -1.649 -0.551 1.413 1.00 . A A . 3 LEU HB3 1 1 18 5964 1 1 3 LEU HD11 H -4.244 -0.245 1.630 1.00 . A A . 3 LEU HD11 1 1 18 5965 1 1 3 LEU HD12 H -5.081 0.662 0.380 1.00 . A A . 3 LEU HD12 1 1 18 5966 1 1 3 LEU HD13 H -4.100 1.506 1.567 1.00 . A A . 3 LEU HD13 1 1 18 5967 1 1 3 LEU HD21 H -2.116 1.372 -1.729 1.00 . A A . 3 LEU HD21 1 1 18 5968 1 1 3 LEU HD22 H -2.779 2.543 -0.607 1.00 . A A . 3 LEU HD22 1 1 18 5969 1 1 3 LEU HD23 H -3.852 1.573 -1.585 1.00 . A A . 3 LEU HD23 1 1 18 5970 1 1 3 LEU HG H -3.068 -0.478 -0.472 1.00 . A A . 3 LEU HG 1 1 18 5971 1 1 3 LEU N N -1.408 2.874 1.199 1.00 . A A . 3 LEU N 1 1 18 5972 1 1 3 LEU O O 0.251 1.156 3.606 1.00 . A A . 3 LEU O 1 1 18 5973 1 1 4 CYS C C 2.898 2.412 2.774 1.00 . A A . 4 CYS C 1 1 18 5974 1 1 4 CYS CA C 2.392 1.474 1.671 1.00 . A A . 4 CYS CA 1 1 18 5975 1 1 4 CYS CB C 3.031 1.865 0.346 1.00 . A A . 4 CYS CB 1 1 18 5976 1 1 4 CYS H H 0.588 1.713 0.601 1.00 . A A . 4 CYS H 1 1 18 5977 1 1 4 CYS HA H 2.669 0.464 1.924 1.00 . A A . 4 CYS HA 1 1 18 5978 1 1 4 CYS HB2 H 3.028 2.930 0.212 1.00 . A A . 4 CYS HB2 1 1 18 5979 1 1 4 CYS HB3 H 4.069 1.580 0.407 1.00 . A A . 4 CYS HB3 1 1 18 5980 1 1 4 CYS N N 0.920 1.545 1.499 1.00 . A A . 4 CYS N 1 1 18 5981 1 1 4 CYS O O 3.449 1.979 3.768 1.00 . A A . 4 CYS O 1 1 18 5982 1 1 4 CYS SG S 2.380 1.168 -1.189 1.00 . A A . 4 CYS SG 1 1 18 5983 1 1 5 CYS C C 2.181 4.755 4.716 1.00 . A A . 5 CYS C 1 1 18 5984 1 1 5 CYS CA C 3.110 4.738 3.497 1.00 . A A . 5 CYS CA 1 1 18 5985 1 1 5 CYS CB C 3.073 6.106 2.788 1.00 . A A . 5 CYS CB 1 1 18 5986 1 1 5 CYS H H 2.208 3.935 1.713 1.00 . A A . 5 CYS H 1 1 18 5987 1 1 5 CYS HA H 4.117 4.522 3.822 1.00 . A A . 5 CYS HA 1 1 18 5988 1 1 5 CYS HB2 H 3.488 5.995 1.797 1.00 . A A . 5 CYS HB2 1 1 18 5989 1 1 5 CYS HB3 H 2.045 6.420 2.679 1.00 . A A . 5 CYS HB3 1 1 18 5990 1 1 5 CYS N N 2.674 3.681 2.536 1.00 . A A . 5 CYS N 1 1 18 5991 1 1 5 CYS O O 2.616 5.036 5.817 1.00 . A A . 5 CYS O 1 1 18 5992 1 1 5 CYS SG S 3.972 7.438 3.621 1.00 . A A . 5 CYS SG 1 1 18 5993 1 1 6 GLY C C 0.272 3.360 6.612 1.00 . A A . 6 GLY C 1 1 18 5994 1 1 6 GLY CA C -0.080 4.431 5.576 1.00 . A A . 6 GLY CA 1 1 18 5995 1 1 6 GLY H H 0.651 4.236 3.560 1.00 . A A . 6 GLY H 1 1 18 5996 1 1 6 GLY HA2 H -0.108 5.400 6.053 1.00 . A A . 6 GLY HA2 1 1 18 5997 1 1 6 GLY HA3 H -1.052 4.209 5.162 1.00 . A A . 6 GLY HA3 1 1 18 5998 1 1 6 GLY N N 0.929 4.452 4.474 1.00 . A A . 6 GLY N 1 1 18 5999 1 1 6 GLY O O 0.086 3.562 7.797 1.00 . A A . 6 GLY O 1 1 18 6000 1 1 7 PHE C C 2.143 0.122 6.346 1.00 . A A . 7 PHE C 1 1 18 6001 1 1 7 PHE CA C 1.162 1.121 7.014 1.00 . A A . 7 PHE CA 1 1 18 6002 1 1 7 PHE CB C -0.138 0.401 7.468 1.00 . A A . 7 PHE CB 1 1 18 6003 1 1 7 PHE CD1 C -0.657 -1.231 5.605 1.00 . A A . 7 PHE CD1 1 1 18 6004 1 1 7 PHE CD2 C -2.073 0.665 5.847 1.00 . A A . 7 PHE CD2 1 1 18 6005 1 1 7 PHE CE1 C -1.410 -1.662 4.536 1.00 . A A . 7 PHE CE1 1 1 18 6006 1 1 7 PHE CE2 C -2.829 0.236 4.777 1.00 . A A . 7 PHE CE2 1 1 18 6007 1 1 7 PHE CG C -0.980 -0.068 6.270 1.00 . A A . 7 PHE CG 1 1 18 6008 1 1 7 PHE CZ C -2.498 -0.928 4.120 1.00 . A A . 7 PHE CZ 1 1 18 6009 1 1 7 PHE H H 0.893 2.170 5.155 1.00 . A A . 7 PHE H 1 1 18 6010 1 1 7 PHE HA H 1.640 1.548 7.881 1.00 . A A . 7 PHE HA 1 1 18 6011 1 1 7 PHE HB2 H 0.110 -0.460 8.071 1.00 . A A . 7 PHE HB2 1 1 18 6012 1 1 7 PHE HB3 H -0.735 1.070 8.070 1.00 . A A . 7 PHE HB3 1 1 18 6013 1 1 7 PHE HD1 H 0.196 -1.803 5.928 1.00 . A A . 7 PHE HD1 1 1 18 6014 1 1 7 PHE HD2 H -2.340 1.580 6.357 1.00 . A A . 7 PHE HD2 1 1 18 6015 1 1 7 PHE HE1 H -1.148 -2.577 4.027 1.00 . A A . 7 PHE HE1 1 1 18 6016 1 1 7 PHE HE2 H -3.683 0.815 4.453 1.00 . A A . 7 PHE HE2 1 1 18 6017 1 1 7 PHE HZ H -3.089 -1.267 3.283 1.00 . A A . 7 PHE HZ 1 1 18 6018 1 1 7 PHE N N 0.771 2.253 6.122 1.00 . A A . 7 PHE N 1 1 18 6019 1 1 7 PHE O O 2.039 -0.189 5.170 1.00 . A A . 7 PHE O 1 1 18 6020 1 1 8 HYP C C 3.955 -2.416 5.979 1.00 . A A . 8 HYP C 1 1 18 6021 1 1 8 HYP CA C 4.272 -1.066 6.636 1.00 . A A . 8 HYP CA 1 1 18 6022 1 1 8 HYP CB C 5.177 -1.197 7.858 1.00 . A A . 8 HYP CB 1 1 18 6023 1 1 8 HYP CD C 3.105 -0.300 8.618 1.00 . A A . 8 HYP CD 1 1 18 6024 1 1 8 HYP CG C 4.217 -1.243 8.995 1.00 . A A . 8 HYP CG 1 1 18 6025 1 1 8 HYP HA H 4.787 -0.452 5.914 1.00 . A A . 8 HYP HA 1 1 18 6026 1 1 8 HYP HB2 H 5.842 -0.347 7.919 1.00 . A A . 8 HYP HB2 1 1 18 6027 1 1 8 HYP HB3 H 5.782 -2.090 7.801 1.00 . A A . 8 HYP HB3 1 1 18 6028 1 1 8 HYP HD1 H 4.181 -0.699 10.862 1.00 . A A . 8 HYP HD1 1 1 18 6029 1 1 8 HYP HD22 H 3.330 0.701 8.959 1.00 . A A . 8 HYP HD22 1 1 18 6030 1 1 8 HYP HD23 H 2.172 -0.642 9.041 1.00 . A A . 8 HYP HD23 1 1 18 6031 1 1 8 HYP HG H 3.836 -2.246 9.116 1.00 . A A . 8 HYP HG 1 1 18 6032 1 1 8 HYP N N 3.077 -0.361 7.139 1.00 . A A . 8 HYP N 1 1 18 6033 1 1 8 HYP O O 4.844 -3.038 5.430 1.00 . A A . 8 HYP O 1 1 18 6034 1 1 8 HYP OD1 O 4.857 -0.820 10.191 1.00 . A A . 8 HYP OD1 1 1 18 6035 1 1 9 LYS C C 2.400 -4.034 3.917 1.00 . A A . 9 LYS C 1 1 18 6036 1 1 9 LYS CA C 2.317 -4.119 5.443 1.00 . A A . 9 LYS CA 1 1 18 6037 1 1 9 LYS CB C 0.864 -4.515 5.846 1.00 . A A . 9 LYS CB 1 1 18 6038 1 1 9 LYS CD C 0.958 -3.519 8.250 1.00 . A A . 9 LYS CD 1 1 18 6039 1 1 9 LYS CE C 0.704 -3.853 9.729 1.00 . A A . 9 LYS CE 1 1 18 6040 1 1 9 LYS CG C 0.688 -4.771 7.375 1.00 . A A . 9 LYS CG 1 1 18 6041 1 1 9 LYS H H 2.040 -2.266 6.510 1.00 . A A . 9 LYS H 1 1 18 6042 1 1 9 LYS HA H 3.003 -4.882 5.785 1.00 . A A . 9 LYS HA 1 1 18 6043 1 1 9 LYS HB2 H 0.164 -3.766 5.518 1.00 . A A . 9 LYS HB2 1 1 18 6044 1 1 9 LYS HB3 H 0.613 -5.432 5.332 1.00 . A A . 9 LYS HB3 1 1 18 6045 1 1 9 LYS HD2 H 1.988 -3.215 8.169 1.00 . A A . 9 LYS HD2 1 1 18 6046 1 1 9 LYS HD3 H 0.322 -2.703 7.945 1.00 . A A . 9 LYS HD3 1 1 18 6047 1 1 9 LYS HE2 H 0.883 -2.980 10.340 1.00 . A A . 9 LYS HE2 1 1 18 6048 1 1 9 LYS HE3 H -0.316 -4.177 9.874 1.00 . A A . 9 LYS HE3 1 1 18 6049 1 1 9 LYS HG2 H -0.322 -5.111 7.552 1.00 . A A . 9 LYS HG2 1 1 18 6050 1 1 9 LYS HG3 H 1.361 -5.564 7.670 1.00 . A A . 9 LYS HG3 1 1 18 6051 1 1 9 LYS HZ1 H 1.620 -4.992 11.213 1.00 . A A . 9 LYS HZ1 1 1 18 6052 1 1 9 LYS HZ2 H 2.584 -4.740 9.837 1.00 . A A . 9 LYS HZ2 1 1 18 6053 1 1 9 LYS HZ3 H 1.297 -5.847 9.782 1.00 . A A . 9 LYS HZ3 1 1 18 6054 1 1 9 LYS N N 2.709 -2.818 6.055 1.00 . A A . 9 LYS N 1 1 18 6055 1 1 9 LYS NZ N 1.620 -4.940 10.176 1.00 . A A . 9 LYS NZ 1 1 18 6056 1 1 9 LYS O O 2.758 -5.021 3.301 1.00 . A A . 9 LYS O 1 1 18 6057 1 1 10 SER C C 3.555 -2.314 1.432 1.00 . A A . 10 SER C 1 1 18 6058 1 1 10 SER CA C 2.168 -2.822 1.842 1.00 . A A . 10 SER CA 1 1 18 6059 1 1 10 SER CB C 1.072 -1.877 1.338 1.00 . A A . 10 SER CB 1 1 18 6060 1 1 10 SER H H 1.792 -2.091 3.825 1.00 . A A . 10 SER H 1 1 18 6061 1 1 10 SER HA H 2.014 -3.803 1.414 1.00 . A A . 10 SER HA 1 1 18 6062 1 1 10 SER HB2 H 1.131 -0.915 1.815 1.00 . A A . 10 SER HB2 1 1 18 6063 1 1 10 SER HB3 H 1.082 -1.774 0.263 1.00 . A A . 10 SER HB3 1 1 18 6064 1 1 10 SER HG H -0.624 -1.895 2.279 1.00 . A A . 10 SER HG 1 1 18 6065 1 1 10 SER N N 2.081 -2.896 3.334 1.00 . A A . 10 SER N 1 1 18 6066 1 1 10 SER O O 4.039 -2.650 0.375 1.00 . A A . 10 SER O 1 1 18 6067 1 1 10 SER OG O -0.131 -2.515 1.738 1.00 . A A . 10 SER OG 1 1 18 6068 1 1 11 CYS C C 6.571 -1.818 1.417 1.00 . A A . 11 CYS C 1 1 18 6069 1 1 11 CYS CA C 5.502 -0.920 2.085 1.00 . A A . 11 CYS CA 1 1 18 6070 1 1 11 CYS CB C 5.971 -0.459 3.464 1.00 . A A . 11 CYS CB 1 1 18 6071 1 1 11 CYS H H 3.669 -1.320 3.127 1.00 . A A . 11 CYS H 1 1 18 6072 1 1 11 CYS HA H 5.376 -0.044 1.469 1.00 . A A . 11 CYS HA 1 1 18 6073 1 1 11 CYS HB2 H 5.212 0.198 3.857 1.00 . A A . 11 CYS HB2 1 1 18 6074 1 1 11 CYS HB3 H 6.002 -1.328 4.103 1.00 . A A . 11 CYS HB3 1 1 18 6075 1 1 11 CYS N N 4.144 -1.527 2.294 1.00 . A A . 11 CYS N 1 1 18 6076 1 1 11 CYS O O 7.381 -1.333 0.650 1.00 . A A . 11 CYS O 1 1 18 6077 1 1 11 CYS SG S 7.555 0.387 3.675 1.00 . A A . 11 CYS SG 1 1 18 6078 1 1 12 ARG C C 7.190 -4.516 -0.291 1.00 . A A . 12 ARG C 1 1 18 6079 1 1 12 ARG CA C 7.531 -4.065 1.145 1.00 . A A . 12 ARG CA 1 1 18 6080 1 1 12 ARG CB C 7.584 -5.278 2.109 1.00 . A A . 12 ARG CB 1 1 18 6081 1 1 12 ARG CD C 10.013 -5.865 1.538 1.00 . A A . 12 ARG CD 1 1 18 6082 1 1 12 ARG CG C 8.564 -6.394 1.652 1.00 . A A . 12 ARG CG 1 1 18 6083 1 1 12 ARG CZ C 10.977 -7.466 -0.069 1.00 . A A . 12 ARG CZ 1 1 18 6084 1 1 12 ARG H H 5.855 -3.414 2.344 1.00 . A A . 12 ARG H 1 1 18 6085 1 1 12 ARG HA H 8.499 -3.587 1.128 1.00 . A A . 12 ARG HA 1 1 18 6086 1 1 12 ARG HB2 H 7.879 -4.931 3.090 1.00 . A A . 12 ARG HB2 1 1 18 6087 1 1 12 ARG HB3 H 6.594 -5.702 2.192 1.00 . A A . 12 ARG HB3 1 1 18 6088 1 1 12 ARG HD2 H 10.090 -5.094 0.786 1.00 . A A . 12 ARG HD2 1 1 18 6089 1 1 12 ARG HD3 H 10.346 -5.467 2.485 1.00 . A A . 12 ARG HD3 1 1 18 6090 1 1 12 ARG HE H 11.461 -7.426 1.851 1.00 . A A . 12 ARG HE 1 1 18 6091 1 1 12 ARG HG2 H 8.543 -7.193 2.379 1.00 . A A . 12 ARG HG2 1 1 18 6092 1 1 12 ARG HG3 H 8.243 -6.799 0.704 1.00 . A A . 12 ARG HG3 1 1 18 6093 1 1 12 ARG HH11 H 9.649 -6.171 -0.815 1.00 . A A . 12 ARG HH11 1 1 18 6094 1 1 12 ARG HH12 H 10.316 -7.293 -1.951 1.00 . A A . 12 ARG HH12 1 1 18 6095 1 1 12 ARG HH21 H 12.325 -8.856 0.436 1.00 . A A . 12 ARG HH21 1 1 18 6096 1 1 12 ARG HH22 H 11.856 -8.836 -1.232 1.00 . A A . 12 ARG HH22 1 1 18 6097 1 1 12 ARG N N 6.542 -3.091 1.724 1.00 . A A . 12 ARG N 1 1 18 6098 1 1 12 ARG NE N 10.908 -7.007 1.158 1.00 . A A . 12 ARG NE 1 1 18 6099 1 1 12 ARG NH1 N 10.257 -6.935 -1.019 1.00 . A A . 12 ARG NH1 1 1 18 6100 1 1 12 ARG NH2 N 11.782 -8.463 -0.307 1.00 . A A . 12 ARG NH2 1 1 18 6101 1 1 12 ARG O O 8.056 -4.960 -1.019 1.00 . A A . 12 ARG O 1 1 18 6102 1 1 13 SER C C 6.217 -4.077 -3.140 1.00 . A A . 13 SER C 1 1 18 6103 1 1 13 SER CA C 5.459 -4.782 -2.012 1.00 . A A . 13 SER CA 1 1 18 6104 1 1 13 SER CB C 3.970 -4.446 -2.109 1.00 . A A . 13 SER CB 1 1 18 6105 1 1 13 SER H H 5.293 -4.015 -0.036 1.00 . A A . 13 SER H 1 1 18 6106 1 1 13 SER HA H 5.597 -5.849 -2.122 1.00 . A A . 13 SER HA 1 1 18 6107 1 1 13 SER HB2 H 3.780 -3.392 -1.979 1.00 . A A . 13 SER HB2 1 1 18 6108 1 1 13 SER HB3 H 3.561 -4.782 -3.045 1.00 . A A . 13 SER HB3 1 1 18 6109 1 1 13 SER HG H 2.987 -5.975 -1.422 1.00 . A A . 13 SER HG 1 1 18 6110 1 1 13 SER N N 5.942 -4.385 -0.658 1.00 . A A . 13 SER N 1 1 18 6111 1 1 13 SER O O 6.801 -3.029 -2.940 1.00 . A A . 13 SER O 1 1 18 6112 1 1 13 SER OG O 3.371 -5.179 -1.050 1.00 . A A . 13 SER OG 1 1 18 6113 1 1 14 ARG C C 6.127 -2.843 -5.907 1.00 . A A . 14 ARG C 1 1 18 6114 1 1 14 ARG CA C 6.860 -4.130 -5.498 1.00 . A A . 14 ARG CA 1 1 18 6115 1 1 14 ARG CB C 6.809 -5.186 -6.619 1.00 . A A . 14 ARG CB 1 1 18 6116 1 1 14 ARG CD C 7.539 -5.759 -8.974 1.00 . A A . 14 ARG CD 1 1 18 6117 1 1 14 ARG CG C 7.554 -4.672 -7.875 1.00 . A A . 14 ARG CG 1 1 18 6118 1 1 14 ARG CZ C 9.518 -7.068 -8.320 1.00 . A A . 14 ARG CZ 1 1 18 6119 1 1 14 ARG H H 5.681 -5.536 -4.371 1.00 . A A . 14 ARG H 1 1 18 6120 1 1 14 ARG HA H 7.883 -3.896 -5.243 1.00 . A A . 14 ARG HA 1 1 18 6121 1 1 14 ARG HB2 H 7.272 -6.096 -6.264 1.00 . A A . 14 ARG HB2 1 1 18 6122 1 1 14 ARG HB3 H 5.779 -5.402 -6.868 1.00 . A A . 14 ARG HB3 1 1 18 6123 1 1 14 ARG HD2 H 6.522 -6.010 -9.242 1.00 . A A . 14 ARG HD2 1 1 18 6124 1 1 14 ARG HD3 H 8.057 -5.413 -9.857 1.00 . A A . 14 ARG HD3 1 1 18 6125 1 1 14 ARG HE H 7.669 -7.769 -8.216 1.00 . A A . 14 ARG HE 1 1 18 6126 1 1 14 ARG HG2 H 7.065 -3.789 -8.257 1.00 . A A . 14 ARG HG2 1 1 18 6127 1 1 14 ARG HG3 H 8.572 -4.417 -7.619 1.00 . A A . 14 ARG HG3 1 1 18 6128 1 1 14 ARG HH11 H 9.881 -5.211 -8.982 1.00 . A A . 14 ARG HH11 1 1 18 6129 1 1 14 ARG HH12 H 11.274 -6.129 -8.521 1.00 . A A . 14 ARG HH12 1 1 18 6130 1 1 14 ARG HH21 H 9.417 -8.943 -7.628 1.00 . A A . 14 ARG HH21 1 1 18 6131 1 1 14 ARG HH22 H 11.010 -8.269 -7.744 1.00 . A A . 14 ARG HH22 1 1 18 6132 1 1 14 ARG N N 6.173 -4.692 -4.295 1.00 . A A . 14 ARG N 1 1 18 6133 1 1 14 ARG NE N 8.215 -6.993 -8.458 1.00 . A A . 14 ARG NE 1 1 18 6134 1 1 14 ARG NH1 N 10.282 -6.056 -8.632 1.00 . A A . 14 ARG NH1 1 1 18 6135 1 1 14 ARG NH2 N 10.021 -8.181 -7.861 1.00 . A A . 14 ARG NH2 1 1 18 6136 1 1 14 ARG O O 6.736 -1.913 -6.399 1.00 . A A . 14 ARG O 1 1 18 6137 1 1 15 GLN C C 4.396 -0.493 -5.110 1.00 . A A . 15 GLN C 1 1 18 6138 1 1 15 GLN CA C 3.986 -1.657 -6.025 1.00 . A A . 15 GLN CA 1 1 18 6139 1 1 15 GLN CB C 2.513 -2.036 -5.799 1.00 . A A . 15 GLN CB 1 1 18 6140 1 1 15 GLN CD C 0.137 -1.267 -5.900 1.00 . A A . 15 GLN CD 1 1 18 6141 1 1 15 GLN CG C 1.590 -0.851 -6.149 1.00 . A A . 15 GLN CG 1 1 18 6142 1 1 15 GLN H H 4.415 -3.631 -5.285 1.00 . A A . 15 GLN H 1 1 18 6143 1 1 15 GLN HA H 4.158 -1.383 -7.056 1.00 . A A . 15 GLN HA 1 1 18 6144 1 1 15 GLN HB2 H 2.263 -2.885 -6.419 1.00 . A A . 15 GLN HB2 1 1 18 6145 1 1 15 GLN HB3 H 2.369 -2.317 -4.765 1.00 . A A . 15 GLN HB3 1 1 18 6146 1 1 15 GLN HE21 H 0.337 -1.214 -3.926 1.00 . A A . 15 GLN HE21 1 1 18 6147 1 1 15 GLN HE22 H -1.202 -1.656 -4.487 1.00 . A A . 15 GLN HE22 1 1 18 6148 1 1 15 GLN HG2 H 1.812 0.005 -5.529 1.00 . A A . 15 GLN HG2 1 1 18 6149 1 1 15 GLN HG3 H 1.704 -0.575 -7.187 1.00 . A A . 15 GLN HG3 1 1 18 6150 1 1 15 GLN N N 4.836 -2.841 -5.684 1.00 . A A . 15 GLN N 1 1 18 6151 1 1 15 GLN NE2 N -0.278 -1.389 -4.669 1.00 . A A . 15 GLN NE2 1 1 18 6152 1 1 15 GLN O O 4.423 0.648 -5.529 1.00 . A A . 15 GLN O 1 1 18 6153 1 1 15 GLN OE1 O -0.631 -1.484 -6.816 1.00 . A A . 15 GLN OE1 1 1 18 6154 1 1 16 CYS C C 6.612 0.487 -2.880 1.00 . A A . 16 CYS C 1 1 18 6155 1 1 16 CYS CA C 5.119 0.144 -2.851 1.00 . A A . 16 CYS CA 1 1 18 6156 1 1 16 CYS CB C 4.788 -0.408 -1.494 1.00 . A A . 16 CYS CB 1 1 18 6157 1 1 16 CYS H H 4.631 -1.790 -3.631 1.00 . A A . 16 CYS H 1 1 18 6158 1 1 16 CYS HA H 4.552 1.047 -2.990 1.00 . A A . 16 CYS HA 1 1 18 6159 1 1 16 CYS HB2 H 5.324 -1.325 -1.340 1.00 . A A . 16 CYS HB2 1 1 18 6160 1 1 16 CYS HB3 H 5.153 0.287 -0.754 1.00 . A A . 16 CYS HB3 1 1 18 6161 1 1 16 CYS N N 4.694 -0.846 -3.884 1.00 . A A . 16 CYS N 1 1 18 6162 1 1 16 CYS O O 7.020 1.506 -2.360 1.00 . A A . 16 CYS O 1 1 18 6163 1 1 16 CYS SG S 3.050 -0.727 -1.134 1.00 . A A . 16 CYS SG 1 1 18 6164 1 1 17 LYS C C 9.290 1.202 -4.164 1.00 . A A . 17 LYS C 1 1 18 6165 1 1 17 LYS CA C 8.855 -0.182 -3.591 1.00 . A A . 17 LYS CA 1 1 18 6166 1 1 17 LYS CB C 9.408 -1.341 -4.462 1.00 . A A . 17 LYS CB 1 1 18 6167 1 1 17 LYS CD C 11.612 -1.526 -3.088 1.00 . A A . 17 LYS CD 1 1 18 6168 1 1 17 LYS CE C 11.244 -2.869 -2.388 1.00 . A A . 17 LYS CE 1 1 18 6169 1 1 17 LYS CG C 10.956 -1.351 -4.498 1.00 . A A . 17 LYS CG 1 1 18 6170 1 1 17 LYS H H 6.965 -1.183 -3.873 1.00 . A A . 17 LYS H 1 1 18 6171 1 1 17 LYS HA H 9.256 -0.263 -2.592 1.00 . A A . 17 LYS HA 1 1 18 6172 1 1 17 LYS HB2 H 9.029 -2.288 -4.116 1.00 . A A . 17 LYS HB2 1 1 18 6173 1 1 17 LYS HB3 H 9.063 -1.217 -5.476 1.00 . A A . 17 LYS HB3 1 1 18 6174 1 1 17 LYS HD2 H 12.684 -1.492 -3.211 1.00 . A A . 17 LYS HD2 1 1 18 6175 1 1 17 LYS HD3 H 11.332 -0.703 -2.448 1.00 . A A . 17 LYS HD3 1 1 18 6176 1 1 17 LYS HE2 H 11.493 -3.698 -3.036 1.00 . A A . 17 LYS HE2 1 1 18 6177 1 1 17 LYS HE3 H 11.809 -2.967 -1.474 1.00 . A A . 17 LYS HE3 1 1 18 6178 1 1 17 LYS HG2 H 11.279 -2.164 -5.132 1.00 . A A . 17 LYS HG2 1 1 18 6179 1 1 17 LYS HG3 H 11.310 -0.430 -4.939 1.00 . A A . 17 LYS HG3 1 1 18 6180 1 1 17 LYS HZ1 H 9.312 -3.576 -2.738 1.00 . A A . 17 LYS HZ1 1 1 18 6181 1 1 17 LYS HZ2 H 9.364 -2.014 -2.073 1.00 . A A . 17 LYS HZ2 1 1 18 6182 1 1 17 LYS HZ3 H 9.686 -3.362 -1.097 1.00 . A A . 17 LYS HZ3 1 1 18 6183 1 1 17 LYS N N 7.377 -0.381 -3.486 1.00 . A A . 17 LYS N 1 1 18 6184 1 1 17 LYS NZ N 9.792 -2.959 -2.051 1.00 . A A . 17 LYS NZ 1 1 18 6185 1 1 17 LYS O O 10.218 1.783 -3.636 1.00 . A A . 17 LYS O 1 1 18 6186 1 1 18 HYP C C 8.388 4.230 -4.967 1.00 . A A . 18 HYP C 1 1 18 6187 1 1 18 HYP CA C 8.964 3.035 -5.761 1.00 . A A . 18 HYP CA 1 1 18 6188 1 1 18 HYP CB C 8.437 2.955 -7.186 1.00 . A A . 18 HYP CB 1 1 18 6189 1 1 18 HYP CD C 7.559 1.084 -5.979 1.00 . A A . 18 HYP CD 1 1 18 6190 1 1 18 HYP CG C 7.223 2.105 -7.038 1.00 . A A . 18 HYP CG 1 1 18 6191 1 1 18 HYP HA H 10.035 3.171 -5.824 1.00 . A A . 18 HYP HA 1 1 18 6192 1 1 18 HYP HB2 H 9.179 2.508 -7.834 1.00 . A A . 18 HYP HB2 1 1 18 6193 1 1 18 HYP HB3 H 8.205 3.936 -7.572 1.00 . A A . 18 HYP HB3 1 1 18 6194 1 1 18 HYP HD1 H 6.201 0.837 -8.096 1.00 . A A . 18 HYP HD1 1 1 18 6195 1 1 18 HYP HD22 H 7.893 0.171 -6.446 1.00 . A A . 18 HYP HD22 1 1 18 6196 1 1 18 HYP HD23 H 6.697 0.907 -5.364 1.00 . A A . 18 HYP HD23 1 1 18 6197 1 1 18 HYP HG H 6.389 2.714 -6.720 1.00 . A A . 18 HYP HG 1 1 18 6198 1 1 18 HYP N N 8.648 1.704 -5.200 1.00 . A A . 18 HYP N 1 1 18 6199 1 1 18 HYP O O 8.546 5.354 -5.404 1.00 . A A . 18 HYP O 1 1 18 6200 1 1 18 HYP OD1 O 6.909 1.462 -8.265 1.00 . A A . 18 HYP OD1 1 1 18 6201 1 1 19 HIS C C 8.258 5.858 -2.287 1.00 . A A . 19 HIS C 1 1 18 6202 1 1 19 HIS CA C 7.174 5.097 -3.044 1.00 . A A . 19 HIS CA 1 1 18 6203 1 1 19 HIS CB C 6.146 4.550 -2.030 1.00 . A A . 19 HIS CB 1 1 18 6204 1 1 19 HIS CD2 C 4.797 3.336 -3.983 1.00 . A A . 19 HIS CD2 1 1 18 6205 1 1 19 HIS CE1 C 2.905 3.474 -3.151 1.00 . A A . 19 HIS CE1 1 1 18 6206 1 1 19 HIS CG C 4.924 3.981 -2.763 1.00 . A A . 19 HIS CG 1 1 18 6207 1 1 19 HIS H H 7.655 3.047 -3.534 1.00 . A A . 19 HIS H 1 1 18 6208 1 1 19 HIS HA H 6.679 5.784 -3.716 1.00 . A A . 19 HIS HA 1 1 18 6209 1 1 19 HIS HB2 H 6.589 3.771 -1.428 1.00 . A A . 19 HIS HB2 1 1 18 6210 1 1 19 HIS HB3 H 5.814 5.345 -1.377 1.00 . A A . 19 HIS HB3 1 1 18 6211 1 1 19 HIS HD1 H 3.453 4.427 -1.451 1.00 . A A . 19 HIS HD1 1 1 18 6212 1 1 19 HIS HD2 H 5.611 3.113 -4.653 1.00 . A A . 19 HIS HD2 1 1 18 6213 1 1 19 HIS HE1 H 1.838 3.390 -3.001 1.00 . A A . 19 HIS HE1 1 1 18 6214 1 1 19 HIS N N 7.752 3.970 -3.848 1.00 . A A . 19 HIS N 1 1 18 6215 1 1 19 HIS ND1 N 3.715 4.029 -2.307 1.00 . A A . 19 HIS ND1 1 1 18 6216 1 1 19 HIS NE2 N 3.535 3.029 -4.208 1.00 . A A . 19 HIS NE2 1 1 18 6217 1 1 19 HIS O O 9.253 5.288 -1.890 1.00 . A A . 19 HIS O 1 1 18 6218 1 1 20 ARG C C 9.060 7.631 0.111 1.00 . A A . 20 ARG C 1 1 18 6219 1 1 20 ARG CA C 9.011 7.994 -1.383 1.00 . A A . 20 ARG CA 1 1 18 6220 1 1 20 ARG CB C 8.610 9.486 -1.549 1.00 . A A . 20 ARG CB 1 1 18 6221 1 1 20 ARG CD C 7.831 9.251 -4.025 1.00 . A A . 20 ARG CD 1 1 18 6222 1 1 20 ARG CG C 8.740 9.998 -3.019 1.00 . A A . 20 ARG CG 1 1 18 6223 1 1 20 ARG CZ C 7.348 10.965 -5.720 1.00 . A A . 20 ARG CZ 1 1 18 6224 1 1 20 ARG H H 7.201 7.527 -2.455 1.00 . A A . 20 ARG H 1 1 18 6225 1 1 20 ARG HA H 9.992 7.835 -1.807 1.00 . A A . 20 ARG HA 1 1 18 6226 1 1 20 ARG HB2 H 7.588 9.615 -1.221 1.00 . A A . 20 ARG HB2 1 1 18 6227 1 1 20 ARG HB3 H 9.242 10.093 -0.918 1.00 . A A . 20 ARG HB3 1 1 18 6228 1 1 20 ARG HD2 H 8.137 8.221 -4.121 1.00 . A A . 20 ARG HD2 1 1 18 6229 1 1 20 ARG HD3 H 6.793 9.288 -3.728 1.00 . A A . 20 ARG HD3 1 1 18 6230 1 1 20 ARG HE H 8.616 9.474 -6.015 1.00 . A A . 20 ARG HE 1 1 18 6231 1 1 20 ARG HG2 H 8.495 11.050 -3.038 1.00 . A A . 20 ARG HG2 1 1 18 6232 1 1 20 ARG HG3 H 9.769 9.892 -3.334 1.00 . A A . 20 ARG HG3 1 1 18 6233 1 1 20 ARG HH11 H 6.370 11.161 -3.980 1.00 . A A . 20 ARG HH11 1 1 18 6234 1 1 20 ARG HH12 H 6.026 12.366 -5.174 1.00 . A A . 20 ARG HH12 1 1 18 6235 1 1 20 ARG HH21 H 8.195 10.988 -7.531 1.00 . A A . 20 ARG HH21 1 1 18 6236 1 1 20 ARG HH22 H 7.075 12.270 -7.213 1.00 . A A . 20 ARG HH22 1 1 18 6237 1 1 20 ARG N N 8.028 7.133 -2.109 1.00 . A A . 20 ARG N 1 1 18 6238 1 1 20 ARG NE N 8.000 9.882 -5.372 1.00 . A A . 20 ARG NE 1 1 18 6239 1 1 20 ARG NH1 N 6.516 11.541 -4.892 1.00 . A A . 20 ARG NH1 1 1 18 6240 1 1 20 ARG NH2 N 7.555 11.446 -6.914 1.00 . A A . 20 ARG NH2 1 1 18 6241 1 1 20 ARG O O 9.988 8.004 0.803 1.00 . A A . 20 ARG O 1 1 18 6242 1 1 21 CYS C C 8.571 5.076 2.140 1.00 . A A . 21 CYS C 1 1 18 6243 1 1 21 CYS CA C 7.977 6.484 1.989 1.00 . A A . 21 CYS CA 1 1 18 6244 1 1 21 CYS CB C 6.519 6.418 2.446 1.00 . A A . 21 CYS CB 1 1 18 6245 1 1 21 CYS H H 7.346 6.646 -0.064 1.00 . A A . 21 CYS H 1 1 18 6246 1 1 21 CYS HA H 8.551 7.163 2.597 1.00 . A A . 21 CYS HA 1 1 18 6247 1 1 21 CYS HB2 H 6.050 5.593 1.928 1.00 . A A . 21 CYS HB2 1 1 18 6248 1 1 21 CYS HB3 H 6.523 6.166 3.498 1.00 . A A . 21 CYS HB3 1 1 18 6249 1 1 21 CYS N N 8.058 6.911 0.555 1.00 . A A . 21 CYS N 1 1 18 6250 1 1 21 CYS O O 8.935 4.670 3.229 1.00 . A A . 21 CYS O 1 1 18 6251 1 1 21 CYS SG S 5.411 7.835 2.258 1.00 . A A . 21 CYS SG 1 1 18 6252 1 1 22 . C C 9.894 2.800 -0.325 1.00 . A A . 22 CY3 C 1 1 18 6253 1 1 22 . CA C 9.191 2.995 1.005 1.00 . A A . 22 CY3 CA 1 1 18 6254 1 1 22 . CB C 7.994 2.050 1.197 1.00 . A A . 22 CY3 CB 1 1 18 6255 1 1 22 . H H 8.353 4.774 0.185 1.00 . A A . 22 CY3 H 1 1 18 6256 1 1 22 . HA H 9.911 2.867 1.801 1.00 . A A . 22 CY3 HA 1 1 18 6257 1 1 22 . HB2 H 8.310 1.033 1.034 1.00 . A A . 22 CY3 HB2 1 1 18 6258 1 1 22 . HB3 H 7.245 2.283 0.454 1.00 . A A . 22 CY3 HB3 1 1 18 6259 1 1 22 . HN11 H 11.002 4.410 -0.007 1.00 . A A . 22 CY3 HN11 1 1 18 6260 1 1 22 . HN12 H 11.284 3.621 -1.475 1.00 . A A . 22 CY3 HN12 1 1 18 6261 1 1 22 . N N 8.649 4.382 1.033 1.00 . A A . 22 CY3 N 1 1 18 6262 1 1 22 . N1 N 10.804 3.680 -0.631 1.00 . A A . 22 CY3 N1 1 1 18 6263 1 1 22 . O O 9.631 1.885 -1.079 1.00 . A A . 22 CY3 O 1 1 18 6264 1 1 22 . SG S 7.213 2.184 2.823 1.00 . A A . 22 CY3 SG 1 1 19 6265 1 1 1 PCA C C -4.322 5.923 2.329 1.00 . A A . 1 PCA C 1 1 19 6266 1 1 1 PCA CA C -5.422 5.942 1.258 1.00 . A A . 1 PCA CA 1 1 19 6267 1 1 1 PCA CB C -4.872 6.234 -0.151 1.00 . A A . 1 PCA CB 1 1 19 6268 1 1 1 PCA CD C -6.417 7.946 0.421 1.00 . A A . 1 PCA CD 1 1 19 6269 1 1 1 PCA CG C -5.217 7.686 -0.451 1.00 . A A . 1 PCA CG 1 1 19 6270 1 1 1 PCA HA H -5.931 4.988 1.250 1.00 . A A . 1 PCA HA 1 1 19 6271 1 1 1 PCA HB2 H -5.330 5.565 -0.866 1.00 . A A . 1 PCA HB2 1 1 19 6272 1 1 1 PCA HB3 H -3.805 6.066 -0.186 1.00 . A A . 1 PCA HB3 1 1 19 6273 1 1 1 PCA HG2 H -5.465 7.809 -1.495 1.00 . A A . 1 PCA HG2 1 1 19 6274 1 1 1 PCA HG3 H -4.398 8.333 -0.173 1.00 . A A . 1 PCA HG3 1 1 19 6275 1 1 1 PCA N N -6.417 6.999 1.532 1.00 . A A . 1 PCA N 1 1 19 6276 1 1 1 PCA O O -3.604 6.894 2.474 1.00 . A A . 1 PCA O 1 1 19 6277 1 1 1 PCA OE O -7.247 8.810 0.221 1.00 . A A . 1 PCA OE 1 1 19 6278 1 1 2 ARG C C -2.576 3.259 4.000 1.00 . A A . 2 ARG C 1 1 19 6279 1 1 2 ARG CA C -3.215 4.657 4.113 1.00 . A A . 2 ARG CA 1 1 19 6280 1 1 2 ARG CB C -3.916 4.841 5.489 1.00 . A A . 2 ARG CB 1 1 19 6281 1 1 2 ARG CD C -5.225 6.431 6.950 1.00 . A A . 2 ARG CD 1 1 19 6282 1 1 2 ARG CG C -4.552 6.250 5.576 1.00 . A A . 2 ARG CG 1 1 19 6283 1 1 2 ARG CZ C -5.165 8.880 7.195 1.00 . A A . 2 ARG CZ 1 1 19 6284 1 1 2 ARG H H -4.862 4.087 2.848 1.00 . A A . 2 ARG H 1 1 19 6285 1 1 2 ARG HA H -2.435 5.395 3.992 1.00 . A A . 2 ARG HA 1 1 19 6286 1 1 2 ARG HB2 H -4.684 4.090 5.608 1.00 . A A . 2 ARG HB2 1 1 19 6287 1 1 2 ARG HB3 H -3.194 4.724 6.283 1.00 . A A . 2 ARG HB3 1 1 19 6288 1 1 2 ARG HD2 H -5.996 5.688 7.090 1.00 . A A . 2 ARG HD2 1 1 19 6289 1 1 2 ARG HD3 H -4.505 6.343 7.751 1.00 . A A . 2 ARG HD3 1 1 19 6290 1 1 2 ARG HE H -6.832 7.860 6.896 1.00 . A A . 2 ARG HE 1 1 19 6291 1 1 2 ARG HG2 H -3.790 7.003 5.437 1.00 . A A . 2 ARG HG2 1 1 19 6292 1 1 2 ARG HG3 H -5.298 6.370 4.805 1.00 . A A . 2 ARG HG3 1 1 19 6293 1 1 2 ARG HH11 H -3.392 7.950 7.314 1.00 . A A . 2 ARG HH11 1 1 19 6294 1 1 2 ARG HH12 H -3.351 9.672 7.492 1.00 . A A . 2 ARG HH12 1 1 19 6295 1 1 2 ARG HH21 H -6.800 10.031 7.115 1.00 . A A . 2 ARG HH21 1 1 19 6296 1 1 2 ARG HH22 H -5.307 10.869 7.374 1.00 . A A . 2 ARG HH22 1 1 19 6297 1 1 2 ARG N N -4.239 4.820 3.032 1.00 . A A . 2 ARG N 1 1 19 6298 1 1 2 ARG NE N -5.862 7.786 7.005 1.00 . A A . 2 ARG NE 1 1 19 6299 1 1 2 ARG NH1 N -3.868 8.830 7.346 1.00 . A A . 2 ARG NH1 1 1 19 6300 1 1 2 ARG NH2 N -5.807 10.016 7.230 1.00 . A A . 2 ARG NH2 1 1 19 6301 1 1 2 ARG O O -2.437 2.545 4.973 1.00 . A A . 2 ARG O 1 1 19 6302 1 1 3 LEU C C -0.028 1.739 2.489 1.00 . A A . 3 LEU C 1 1 19 6303 1 1 3 LEU CA C -1.562 1.611 2.485 1.00 . A A . 3 LEU CA 1 1 19 6304 1 1 3 LEU CB C -2.136 1.085 1.087 1.00 . A A . 3 LEU CB 1 1 19 6305 1 1 3 LEU CD1 C -3.539 3.040 0.043 1.00 . A A . 3 LEU CD1 1 1 19 6306 1 1 3 LEU CD2 C -1.071 2.979 -0.392 1.00 . A A . 3 LEU CD2 1 1 19 6307 1 1 3 LEU CG C -2.313 2.100 -0.126 1.00 . A A . 3 LEU CG 1 1 19 6308 1 1 3 LEU H H -2.338 3.567 2.068 1.00 . A A . 3 LEU H 1 1 19 6309 1 1 3 LEU HA H -1.839 0.901 3.251 1.00 . A A . 3 LEU HA 1 1 19 6310 1 1 3 LEU HB2 H -1.514 0.268 0.750 1.00 . A A . 3 LEU HB2 1 1 19 6311 1 1 3 LEU HB3 H -3.109 0.662 1.292 1.00 . A A . 3 LEU HB3 1 1 19 6312 1 1 3 LEU HD11 H -3.489 3.663 0.914 1.00 . A A . 3 LEU HD11 1 1 19 6313 1 1 3 LEU HD12 H -4.441 2.447 0.103 1.00 . A A . 3 LEU HD12 1 1 19 6314 1 1 3 LEU HD13 H -3.615 3.684 -0.821 1.00 . A A . 3 LEU HD13 1 1 19 6315 1 1 3 LEU HD21 H -0.224 2.370 -0.660 1.00 . A A . 3 LEU HD21 1 1 19 6316 1 1 3 LEU HD22 H -0.827 3.568 0.480 1.00 . A A . 3 LEU HD22 1 1 19 6317 1 1 3 LEU HD23 H -1.268 3.649 -1.216 1.00 . A A . 3 LEU HD23 1 1 19 6318 1 1 3 LEU HG H -2.483 1.510 -1.015 1.00 . A A . 3 LEU HG 1 1 19 6319 1 1 3 LEU N N -2.201 2.925 2.790 1.00 . A A . 3 LEU N 1 1 19 6320 1 1 3 LEU O O 0.514 2.059 3.525 1.00 . A A . 3 LEU O 1 1 19 6321 1 1 4 CYS C C 2.729 2.687 2.116 1.00 . A A . 4 CYS C 1 1 19 6322 1 1 4 CYS CA C 2.121 1.580 1.241 1.00 . A A . 4 CYS CA 1 1 19 6323 1 1 4 CYS CB C 2.511 1.903 -0.212 1.00 . A A . 4 CYS CB 1 1 19 6324 1 1 4 CYS H H 0.120 1.200 0.605 1.00 . A A . 4 CYS H 1 1 19 6325 1 1 4 CYS HA H 2.579 0.647 1.515 1.00 . A A . 4 CYS HA 1 1 19 6326 1 1 4 CYS HB2 H 2.337 2.936 -0.432 1.00 . A A . 4 CYS HB2 1 1 19 6327 1 1 4 CYS HB3 H 3.584 1.798 -0.247 1.00 . A A . 4 CYS HB3 1 1 19 6328 1 1 4 CYS N N 0.628 1.488 1.381 1.00 . A A . 4 CYS N 1 1 19 6329 1 1 4 CYS O O 3.699 2.462 2.815 1.00 . A A . 4 CYS O 1 1 19 6330 1 1 4 CYS SG S 1.881 0.990 -1.640 1.00 . A A . 4 CYS SG 1 1 19 6331 1 1 5 CYS C C 2.108 4.996 4.292 1.00 . A A . 5 CYS C 1 1 19 6332 1 1 5 CYS CA C 2.632 5.001 2.847 1.00 . A A . 5 CYS CA 1 1 19 6333 1 1 5 CYS CB C 2.205 6.306 2.160 1.00 . A A . 5 CYS CB 1 1 19 6334 1 1 5 CYS H H 1.343 3.948 1.471 1.00 . A A . 5 CYS H 1 1 19 6335 1 1 5 CYS HA H 3.709 4.955 2.876 1.00 . A A . 5 CYS HA 1 1 19 6336 1 1 5 CYS HB2 H 2.418 6.233 1.103 1.00 . A A . 5 CYS HB2 1 1 19 6337 1 1 5 CYS HB3 H 1.139 6.440 2.274 1.00 . A A . 5 CYS HB3 1 1 19 6338 1 1 5 CYS N N 2.128 3.847 2.048 1.00 . A A . 5 CYS N 1 1 19 6339 1 1 5 CYS O O 2.820 5.375 5.202 1.00 . A A . 5 CYS O 1 1 19 6340 1 1 5 CYS SG S 3.029 7.784 2.799 1.00 . A A . 5 CYS SG 1 1 19 6341 1 1 6 GLY C C 0.916 3.502 6.770 1.00 . A A . 6 GLY C 1 1 19 6342 1 1 6 GLY CA C 0.259 4.515 5.822 1.00 . A A . 6 GLY CA 1 1 19 6343 1 1 6 GLY H H 0.364 4.267 3.685 1.00 . A A . 6 GLY H 1 1 19 6344 1 1 6 GLY HA2 H 0.322 5.499 6.265 1.00 . A A . 6 GLY HA2 1 1 19 6345 1 1 6 GLY HA3 H -0.782 4.256 5.715 1.00 . A A . 6 GLY HA3 1 1 19 6346 1 1 6 GLY N N 0.882 4.565 4.462 1.00 . A A . 6 GLY N 1 1 19 6347 1 1 6 GLY O O 1.006 3.756 7.956 1.00 . A A . 6 GLY O 1 1 19 6348 1 1 7 PHE C C 2.881 0.360 6.242 1.00 . A A . 7 PHE C 1 1 19 6349 1 1 7 PHE CA C 2.011 1.339 7.067 1.00 . A A . 7 PHE CA 1 1 19 6350 1 1 7 PHE CB C 0.892 0.575 7.840 1.00 . A A . 7 PHE CB 1 1 19 6351 1 1 7 PHE CD1 C 0.108 -1.155 6.133 1.00 . A A . 7 PHE CD1 1 1 19 6352 1 1 7 PHE CD2 C -1.455 0.467 6.894 1.00 . A A . 7 PHE CD2 1 1 19 6353 1 1 7 PHE CE1 C -0.862 -1.718 5.334 1.00 . A A . 7 PHE CE1 1 1 19 6354 1 1 7 PHE CE2 C -2.428 -0.095 6.093 1.00 . A A . 7 PHE CE2 1 1 19 6355 1 1 7 PHE CG C -0.176 -0.058 6.924 1.00 . A A . 7 PHE CG 1 1 19 6356 1 1 7 PHE CZ C -2.133 -1.189 5.312 1.00 . A A . 7 PHE CZ 1 1 19 6357 1 1 7 PHE H H 1.257 2.251 5.270 1.00 . A A . 7 PHE H 1 1 19 6358 1 1 7 PHE HA H 2.648 1.841 7.782 1.00 . A A . 7 PHE HA 1 1 19 6359 1 1 7 PHE HB2 H 1.327 -0.207 8.440 1.00 . A A . 7 PHE HB2 1 1 19 6360 1 1 7 PHE HB3 H 0.400 1.262 8.514 1.00 . A A . 7 PHE HB3 1 1 19 6361 1 1 7 PHE HD1 H 1.098 -1.581 6.133 1.00 . A A . 7 PHE HD1 1 1 19 6362 1 1 7 PHE HD2 H -1.699 1.326 7.502 1.00 . A A . 7 PHE HD2 1 1 19 6363 1 1 7 PHE HE1 H -0.626 -2.579 4.727 1.00 . A A . 7 PHE HE1 1 1 19 6364 1 1 7 PHE HE2 H -3.423 0.323 6.079 1.00 . A A . 7 PHE HE2 1 1 19 6365 1 1 7 PHE HZ H -2.893 -1.630 4.685 1.00 . A A . 7 PHE HZ 1 1 19 6366 1 1 7 PHE N N 1.356 2.392 6.231 1.00 . A A . 7 PHE N 1 1 19 6367 1 1 7 PHE O O 2.592 0.089 5.090 1.00 . A A . 7 PHE O 1 1 19 6368 1 1 8 HYP C C 4.541 -2.233 5.581 1.00 . A A . 8 HYP C 1 1 19 6369 1 1 8 HYP CA C 4.996 -0.895 6.177 1.00 . A A . 8 HYP CA 1 1 19 6370 1 1 8 HYP CB C 6.091 -1.060 7.225 1.00 . A A . 8 HYP CB 1 1 19 6371 1 1 8 HYP CD C 4.219 -0.061 8.317 1.00 . A A . 8 HYP CD 1 1 19 6372 1 1 8 HYP CG C 5.353 -1.030 8.515 1.00 . A A . 8 HYP CG 1 1 19 6373 1 1 8 HYP HA H 5.405 -0.298 5.374 1.00 . A A . 8 HYP HA 1 1 19 6374 1 1 8 HYP HB2 H 6.804 -0.252 7.144 1.00 . A A . 8 HYP HB2 1 1 19 6375 1 1 8 HYP HB3 H 6.625 -1.989 7.083 1.00 . A A . 8 HYP HB3 1 1 19 6376 1 1 8 HYP HD1 H 6.646 0.211 9.271 1.00 . A A . 8 HYP HD1 1 1 19 6377 1 1 8 HYP HD22 H 4.524 0.939 8.590 1.00 . A A . 8 HYP HD22 1 1 19 6378 1 1 8 HYP HD23 H 3.371 -0.369 8.907 1.00 . A A . 8 HYP HD23 1 1 19 6379 1 1 8 HYP HG H 4.968 -2.015 8.740 1.00 . A A . 8 HYP HG 1 1 19 6380 1 1 8 HYP N N 3.927 -0.144 6.867 1.00 . A A . 8 HYP N 1 1 19 6381 1 1 8 HYP O O 5.222 -2.754 4.718 1.00 . A A . 8 HYP O 1 1 19 6382 1 1 8 HYP OD1 O 6.212 -0.595 9.560 1.00 . A A . 8 HYP OD1 1 1 19 6383 1 1 9 LYS C C 2.676 -3.897 3.995 1.00 . A A . 9 LYS C 1 1 19 6384 1 1 9 LYS CA C 2.946 -4.048 5.492 1.00 . A A . 9 LYS CA 1 1 19 6385 1 1 9 LYS CB C 1.649 -4.510 6.224 1.00 . A A . 9 LYS CB 1 1 19 6386 1 1 9 LYS CD C 2.613 -4.054 8.637 1.00 . A A . 9 LYS CD 1 1 19 6387 1 1 9 LYS CE C 1.700 -2.852 8.905 1.00 . A A . 9 LYS CE 1 1 19 6388 1 1 9 LYS CG C 1.956 -5.060 7.656 1.00 . A A . 9 LYS CG 1 1 19 6389 1 1 9 LYS H H 2.916 -2.284 6.742 1.00 . A A . 9 LYS H 1 1 19 6390 1 1 9 LYS HA H 3.722 -4.788 5.629 1.00 . A A . 9 LYS HA 1 1 19 6391 1 1 9 LYS HB2 H 0.948 -3.696 6.291 1.00 . A A . 9 LYS HB2 1 1 19 6392 1 1 9 LYS HB3 H 1.184 -5.300 5.652 1.00 . A A . 9 LYS HB3 1 1 19 6393 1 1 9 LYS HD2 H 2.801 -4.561 9.573 1.00 . A A . 9 LYS HD2 1 1 19 6394 1 1 9 LYS HD3 H 3.562 -3.720 8.247 1.00 . A A . 9 LYS HD3 1 1 19 6395 1 1 9 LYS HE2 H 2.172 -2.187 9.613 1.00 . A A . 9 LYS HE2 1 1 19 6396 1 1 9 LYS HE3 H 1.510 -2.313 7.996 1.00 . A A . 9 LYS HE3 1 1 19 6397 1 1 9 LYS HG2 H 1.033 -5.419 8.089 1.00 . A A . 9 LYS HG2 1 1 19 6398 1 1 9 LYS HG3 H 2.615 -5.910 7.557 1.00 . A A . 9 LYS HG3 1 1 19 6399 1 1 9 LYS HZ1 H 0.572 -3.845 10.346 1.00 . A A . 9 LYS HZ1 1 1 19 6400 1 1 9 LYS HZ2 H -0.097 -3.895 8.785 1.00 . A A . 9 LYS HZ2 1 1 19 6401 1 1 9 LYS HZ3 H -0.185 -2.467 9.702 1.00 . A A . 9 LYS HZ3 1 1 19 6402 1 1 9 LYS N N 3.426 -2.747 6.046 1.00 . A A . 9 LYS N 1 1 19 6403 1 1 9 LYS NZ N 0.399 -3.299 9.478 1.00 . A A . 9 LYS NZ 1 1 19 6404 1 1 9 LYS O O 2.891 -4.840 3.257 1.00 . A A . 9 LYS O 1 1 19 6405 1 1 10 SER C C 3.318 -2.341 1.427 1.00 . A A . 10 SER C 1 1 19 6406 1 1 10 SER CA C 1.963 -2.557 2.123 1.00 . A A . 10 SER CA 1 1 19 6407 1 1 10 SER CB C 1.040 -1.354 1.957 1.00 . A A . 10 SER CB 1 1 19 6408 1 1 10 SER H H 2.047 -1.975 4.173 1.00 . A A . 10 SER H 1 1 19 6409 1 1 10 SER HA H 1.495 -3.447 1.725 1.00 . A A . 10 SER HA 1 1 19 6410 1 1 10 SER HB2 H 1.411 -0.533 2.546 1.00 . A A . 10 SER HB2 1 1 19 6411 1 1 10 SER HB3 H 0.898 -1.072 0.925 1.00 . A A . 10 SER HB3 1 1 19 6412 1 1 10 SER HG H -0.553 -2.468 1.985 1.00 . A A . 10 SER HG 1 1 19 6413 1 1 10 SER N N 2.223 -2.736 3.575 1.00 . A A . 10 SER N 1 1 19 6414 1 1 10 SER O O 3.475 -2.746 0.293 1.00 . A A . 10 SER O 1 1 19 6415 1 1 10 SER OG O -0.193 -1.763 2.527 1.00 . A A . 10 SER OG 1 1 19 6416 1 1 11 CYS C C 6.351 -2.765 1.095 1.00 . A A . 11 CYS C 1 1 19 6417 1 1 11 CYS CA C 5.616 -1.477 1.508 1.00 . A A . 11 CYS CA 1 1 19 6418 1 1 11 CYS CB C 6.546 -0.724 2.488 1.00 . A A . 11 CYS CB 1 1 19 6419 1 1 11 CYS H H 4.074 -1.422 3.028 1.00 . A A . 11 CYS H 1 1 19 6420 1 1 11 CYS HA H 5.490 -0.863 0.633 1.00 . A A . 11 CYS HA 1 1 19 6421 1 1 11 CYS HB2 H 6.616 -1.302 3.396 1.00 . A A . 11 CYS HB2 1 1 19 6422 1 1 11 CYS HB3 H 7.535 -0.706 2.055 1.00 . A A . 11 CYS HB3 1 1 19 6423 1 1 11 CYS N N 4.260 -1.723 2.115 1.00 . A A . 11 CYS N 1 1 19 6424 1 1 11 CYS O O 7.393 -2.696 0.471 1.00 . A A . 11 CYS O 1 1 19 6425 1 1 11 CYS SG S 6.187 0.980 2.974 1.00 . A A . 11 CYS SG 1 1 19 6426 1 1 12 ARG C C 6.148 -5.522 -0.396 1.00 . A A . 12 ARG C 1 1 19 6427 1 1 12 ARG CA C 6.437 -5.201 1.086 1.00 . A A . 12 ARG CA 1 1 19 6428 1 1 12 ARG CB C 5.854 -6.278 2.038 1.00 . A A . 12 ARG CB 1 1 19 6429 1 1 12 ARG CD C 7.993 -7.692 1.944 1.00 . A A . 12 ARG CD 1 1 19 6430 1 1 12 ARG CG C 6.452 -7.693 1.787 1.00 . A A . 12 ARG CG 1 1 19 6431 1 1 12 ARG CZ C 8.299 -8.003 4.364 1.00 . A A . 12 ARG CZ 1 1 19 6432 1 1 12 ARG H H 4.951 -3.895 1.942 1.00 . A A . 12 ARG H 1 1 19 6433 1 1 12 ARG HA H 7.504 -5.111 1.226 1.00 . A A . 12 ARG HA 1 1 19 6434 1 1 12 ARG HB2 H 6.046 -5.988 3.060 1.00 . A A . 12 ARG HB2 1 1 19 6435 1 1 12 ARG HB3 H 4.784 -6.326 1.902 1.00 . A A . 12 ARG HB3 1 1 19 6436 1 1 12 ARG HD2 H 8.384 -8.688 1.800 1.00 . A A . 12 ARG HD2 1 1 19 6437 1 1 12 ARG HD3 H 8.453 -7.039 1.219 1.00 . A A . 12 ARG HD3 1 1 19 6438 1 1 12 ARG HE H 8.629 -6.284 3.439 1.00 . A A . 12 ARG HE 1 1 19 6439 1 1 12 ARG HG2 H 6.026 -8.382 2.501 1.00 . A A . 12 ARG HG2 1 1 19 6440 1 1 12 ARG HG3 H 6.188 -8.040 0.799 1.00 . A A . 12 ARG HG3 1 1 19 6441 1 1 12 ARG HH11 H 7.679 -9.619 3.349 1.00 . A A . 12 ARG HH11 1 1 19 6442 1 1 12 ARG HH12 H 7.898 -9.840 5.052 1.00 . A A . 12 ARG HH12 1 1 19 6443 1 1 12 ARG HH21 H 8.908 -6.543 5.589 1.00 . A A . 12 ARG HH21 1 1 19 6444 1 1 12 ARG HH22 H 8.602 -8.074 6.342 1.00 . A A . 12 ARG HH22 1 1 19 6445 1 1 12 ARG N N 5.794 -3.898 1.444 1.00 . A A . 12 ARG N 1 1 19 6446 1 1 12 ARG NE N 8.349 -7.215 3.318 1.00 . A A . 12 ARG NE 1 1 19 6447 1 1 12 ARG NH1 N 7.930 -9.251 4.245 1.00 . A A . 12 ARG NH1 1 1 19 6448 1 1 12 ARG NH2 N 8.629 -7.501 5.522 1.00 . A A . 12 ARG NH2 1 1 19 6449 1 1 12 ARG O O 6.714 -6.439 -0.959 1.00 . A A . 12 ARG O 1 1 19 6450 1 1 13 SER C C 5.913 -4.218 -3.300 1.00 . A A . 13 SER C 1 1 19 6451 1 1 13 SER CA C 4.882 -4.914 -2.404 1.00 . A A . 13 SER CA 1 1 19 6452 1 1 13 SER CB C 3.491 -4.293 -2.619 1.00 . A A . 13 SER CB 1 1 19 6453 1 1 13 SER H H 4.858 -4.021 -0.456 1.00 . A A . 13 SER H 1 1 19 6454 1 1 13 SER HA H 4.855 -5.969 -2.639 1.00 . A A . 13 SER HA 1 1 19 6455 1 1 13 SER HB2 H 2.739 -4.789 -2.023 1.00 . A A . 13 SER HB2 1 1 19 6456 1 1 13 SER HB3 H 3.494 -3.234 -2.407 1.00 . A A . 13 SER HB3 1 1 19 6457 1 1 13 SER HG H 3.521 -5.364 -4.248 1.00 . A A . 13 SER HG 1 1 19 6458 1 1 13 SER N N 5.270 -4.740 -0.974 1.00 . A A . 13 SER N 1 1 19 6459 1 1 13 SER O O 6.437 -3.176 -2.955 1.00 . A A . 13 SER O 1 1 19 6460 1 1 13 SER OG O 3.208 -4.491 -3.998 1.00 . A A . 13 SER OG 1 1 19 6461 1 1 14 ARG C C 6.593 -2.938 -5.946 1.00 . A A . 14 ARG C 1 1 19 6462 1 1 14 ARG CA C 7.144 -4.276 -5.415 1.00 . A A . 14 ARG CA 1 1 19 6463 1 1 14 ARG CB C 7.306 -5.312 -6.545 1.00 . A A . 14 ARG CB 1 1 19 6464 1 1 14 ARG CD C 8.491 -5.911 -8.692 1.00 . A A . 14 ARG CD 1 1 19 6465 1 1 14 ARG CG C 8.361 -4.850 -7.580 1.00 . A A . 14 ARG CG 1 1 19 6466 1 1 14 ARG CZ C 8.914 -8.326 -8.751 1.00 . A A . 14 ARG CZ 1 1 19 6467 1 1 14 ARG H H 5.699 -5.669 -4.635 1.00 . A A . 14 ARG H 1 1 19 6468 1 1 14 ARG HA H 8.088 -4.103 -4.917 1.00 . A A . 14 ARG HA 1 1 19 6469 1 1 14 ARG HB2 H 7.610 -6.253 -6.111 1.00 . A A . 14 ARG HB2 1 1 19 6470 1 1 14 ARG HB3 H 6.355 -5.457 -7.039 1.00 . A A . 14 ARG HB3 1 1 19 6471 1 1 14 ARG HD2 H 7.542 -6.047 -9.192 1.00 . A A . 14 ARG HD2 1 1 19 6472 1 1 14 ARG HD3 H 9.235 -5.609 -9.413 1.00 . A A . 14 ARG HD3 1 1 19 6473 1 1 14 ARG HE H 9.193 -7.220 -7.132 1.00 . A A . 14 ARG HE 1 1 19 6474 1 1 14 ARG HG2 H 8.061 -3.913 -8.026 1.00 . A A . 14 ARG HG2 1 1 19 6475 1 1 14 ARG HG3 H 9.317 -4.712 -7.097 1.00 . A A . 14 ARG HG3 1 1 19 6476 1 1 14 ARG HH11 H 8.260 -7.502 -10.460 1.00 . A A . 14 ARG HH11 1 1 19 6477 1 1 14 ARG HH12 H 8.552 -9.208 -10.513 1.00 . A A . 14 ARG HH12 1 1 19 6478 1 1 14 ARG HH21 H 9.568 -9.374 -7.179 1.00 . A A . 14 ARG HH21 1 1 19 6479 1 1 14 ARG HH22 H 9.304 -10.286 -8.628 1.00 . A A . 14 ARG HH22 1 1 19 6480 1 1 14 ARG N N 6.164 -4.831 -4.430 1.00 . A A . 14 ARG N 1 1 19 6481 1 1 14 ARG NE N 8.912 -7.207 -8.071 1.00 . A A . 14 ARG NE 1 1 19 6482 1 1 14 ARG NH1 N 8.546 -8.346 -10.006 1.00 . A A . 14 ARG NH1 1 1 19 6483 1 1 14 ARG NH2 N 9.292 -9.414 -8.139 1.00 . A A . 14 ARG NH2 1 1 19 6484 1 1 14 ARG O O 7.337 -2.067 -6.352 1.00 . A A . 14 ARG O 1 1 19 6485 1 1 15 GLN C C 4.769 -0.495 -5.356 1.00 . A A . 15 GLN C 1 1 19 6486 1 1 15 GLN CA C 4.569 -1.616 -6.388 1.00 . A A . 15 GLN CA 1 1 19 6487 1 1 15 GLN CB C 3.073 -2.002 -6.551 1.00 . A A . 15 GLN CB 1 1 19 6488 1 1 15 GLN CD C 2.103 0.352 -6.123 1.00 . A A . 15 GLN CD 1 1 19 6489 1 1 15 GLN CG C 2.183 -0.843 -7.089 1.00 . A A . 15 GLN CG 1 1 19 6490 1 1 15 GLN H H 4.762 -3.591 -5.574 1.00 . A A . 15 GLN H 1 1 19 6491 1 1 15 GLN HA H 4.983 -1.305 -7.336 1.00 . A A . 15 GLN HA 1 1 19 6492 1 1 15 GLN HB2 H 3.006 -2.833 -7.238 1.00 . A A . 15 GLN HB2 1 1 19 6493 1 1 15 GLN HB3 H 2.688 -2.331 -5.597 1.00 . A A . 15 GLN HB3 1 1 19 6494 1 1 15 GLN HE21 H 1.823 -0.773 -4.509 1.00 . A A . 15 GLN HE21 1 1 19 6495 1 1 15 GLN HE22 H 1.863 0.901 -4.230 1.00 . A A . 15 GLN HE22 1 1 19 6496 1 1 15 GLN HG2 H 2.580 -0.495 -8.032 1.00 . A A . 15 GLN HG2 1 1 19 6497 1 1 15 GLN HG3 H 1.182 -1.212 -7.257 1.00 . A A . 15 GLN HG3 1 1 19 6498 1 1 15 GLN N N 5.287 -2.839 -5.917 1.00 . A A . 15 GLN N 1 1 19 6499 1 1 15 GLN NE2 N 1.913 0.141 -4.848 1.00 . A A . 15 GLN NE2 1 1 19 6500 1 1 15 GLN O O 4.907 0.658 -5.717 1.00 . A A . 15 GLN O 1 1 19 6501 1 1 15 GLN OE1 O 2.214 1.494 -6.524 1.00 . A A . 15 GLN OE1 1 1 19 6502 1 1 16 CYS C C 6.427 0.522 -2.770 1.00 . A A . 16 CYS C 1 1 19 6503 1 1 16 CYS CA C 4.966 0.117 -3.001 1.00 . A A . 16 CYS CA 1 1 19 6504 1 1 16 CYS CB C 4.446 -0.440 -1.688 1.00 . A A . 16 CYS CB 1 1 19 6505 1 1 16 CYS H H 4.671 -1.823 -3.885 1.00 . A A . 16 CYS H 1 1 19 6506 1 1 16 CYS HA H 4.395 0.999 -3.237 1.00 . A A . 16 CYS HA 1 1 19 6507 1 1 16 CYS HB2 H 4.992 -1.327 -1.447 1.00 . A A . 16 CYS HB2 1 1 19 6508 1 1 16 CYS HB3 H 4.701 0.278 -0.926 1.00 . A A . 16 CYS HB3 1 1 19 6509 1 1 16 CYS N N 4.781 -0.876 -4.102 1.00 . A A . 16 CYS N 1 1 19 6510 1 1 16 CYS O O 6.685 1.591 -2.252 1.00 . A A . 16 CYS O 1 1 19 6511 1 1 16 CYS SG S 2.701 -0.836 -1.447 1.00 . A A . 16 CYS SG 1 1 19 6512 1 1 17 LYS C C 9.174 1.337 -3.526 1.00 . A A . 17 LYS C 1 1 19 6513 1 1 17 LYS CA C 8.794 -0.064 -2.985 1.00 . A A . 17 LYS CA 1 1 19 6514 1 1 17 LYS CB C 9.543 -1.238 -3.708 1.00 . A A . 17 LYS CB 1 1 19 6515 1 1 17 LYS CD C 11.742 -0.012 -4.385 1.00 . A A . 17 LYS CD 1 1 19 6516 1 1 17 LYS CE C 13.275 -0.125 -4.317 1.00 . A A . 17 LYS CE 1 1 19 6517 1 1 17 LYS CG C 11.099 -1.201 -3.622 1.00 . A A . 17 LYS CG 1 1 19 6518 1 1 17 LYS H H 7.049 -1.184 -3.566 1.00 . A A . 17 LYS H 1 1 19 6519 1 1 17 LYS HA H 9.022 -0.098 -1.928 1.00 . A A . 17 LYS HA 1 1 19 6520 1 1 17 LYS HB2 H 9.217 -2.162 -3.251 1.00 . A A . 17 LYS HB2 1 1 19 6521 1 1 17 LYS HB3 H 9.256 -1.284 -4.745 1.00 . A A . 17 LYS HB3 1 1 19 6522 1 1 17 LYS HD2 H 11.416 -0.005 -5.415 1.00 . A A . 17 LYS HD2 1 1 19 6523 1 1 17 LYS HD3 H 11.486 0.929 -3.931 1.00 . A A . 17 LYS HD3 1 1 19 6524 1 1 17 LYS HE2 H 13.604 -1.054 -4.758 1.00 . A A . 17 LYS HE2 1 1 19 6525 1 1 17 LYS HE3 H 13.729 0.696 -4.851 1.00 . A A . 17 LYS HE3 1 1 19 6526 1 1 17 LYS HG2 H 11.381 -1.146 -2.580 1.00 . A A . 17 LYS HG2 1 1 19 6527 1 1 17 LYS HG3 H 11.486 -2.127 -4.023 1.00 . A A . 17 LYS HG3 1 1 19 6528 1 1 17 LYS HZ1 H 13.196 0.643 -2.384 1.00 . A A . 17 LYS HZ1 1 1 19 6529 1 1 17 LYS HZ2 H 14.748 0.154 -2.871 1.00 . A A . 17 LYS HZ2 1 1 19 6530 1 1 17 LYS HZ3 H 13.579 -1.009 -2.457 1.00 . A A . 17 LYS HZ3 1 1 19 6531 1 1 17 LYS N N 7.333 -0.341 -3.155 1.00 . A A . 17 LYS N 1 1 19 6532 1 1 17 LYS NZ N 13.735 -0.081 -2.899 1.00 . A A . 17 LYS NZ 1 1 19 6533 1 1 17 LYS O O 9.748 2.110 -2.780 1.00 . A A . 17 LYS O 1 1 19 6534 1 1 18 HYP C C 8.635 4.185 -4.699 1.00 . A A . 18 HYP C 1 1 19 6535 1 1 18 HYP CA C 9.247 2.941 -5.383 1.00 . A A . 18 HYP CA 1 1 19 6536 1 1 18 HYP CB C 8.829 2.805 -6.848 1.00 . A A . 18 HYP CB 1 1 19 6537 1 1 18 HYP CD C 8.108 0.835 -5.745 1.00 . A A . 18 HYP CD 1 1 19 6538 1 1 18 HYP CG C 7.715 1.822 -6.803 1.00 . A A . 18 HYP CG 1 1 19 6539 1 1 18 HYP HA H 10.322 3.051 -5.362 1.00 . A A . 18 HYP HA 1 1 19 6540 1 1 18 HYP HB2 H 9.660 2.451 -7.440 1.00 . A A . 18 HYP HB2 1 1 19 6541 1 1 18 HYP HB3 H 8.515 3.755 -7.254 1.00 . A A . 18 HYP HB3 1 1 19 6542 1 1 18 HYP HD1 H 7.100 0.342 -7.906 1.00 . A A . 18 HYP HD1 1 1 19 6543 1 1 18 HYP HD22 H 8.729 0.063 -6.171 1.00 . A A . 18 HYP HD22 1 1 19 6544 1 1 18 HYP HD23 H 7.225 0.406 -5.311 1.00 . A A . 18 HYP HD23 1 1 19 6545 1 1 18 HYP HG H 6.796 2.321 -6.531 1.00 . A A . 18 HYP HG 1 1 19 6546 1 1 18 HYP N N 8.860 1.650 -4.768 1.00 . A A . 18 HYP N 1 1 19 6547 1 1 18 HYP O O 8.987 5.290 -5.064 1.00 . A A . 18 HYP O 1 1 19 6548 1 1 18 HYP OD1 O 7.561 1.171 -8.055 1.00 . A A . 18 HYP OD1 1 1 19 6549 1 1 19 HIS C C 8.135 5.852 -2.163 1.00 . A A . 19 HIS C 1 1 19 6550 1 1 19 HIS CA C 7.121 5.126 -3.036 1.00 . A A . 19 HIS CA 1 1 19 6551 1 1 19 HIS CB C 5.961 4.630 -2.142 1.00 . A A . 19 HIS CB 1 1 19 6552 1 1 19 HIS CD2 C 4.830 3.363 -4.201 1.00 . A A . 19 HIS CD2 1 1 19 6553 1 1 19 HIS CE1 C 2.874 3.404 -3.521 1.00 . A A . 19 HIS CE1 1 1 19 6554 1 1 19 HIS CG C 4.830 4.008 -2.974 1.00 . A A . 19 HIS CG 1 1 19 6555 1 1 19 HIS H H 7.514 3.063 -3.490 1.00 . A A . 19 HIS H 1 1 19 6556 1 1 19 HIS HA H 6.756 5.823 -3.771 1.00 . A A . 19 HIS HA 1 1 19 6557 1 1 19 HIS HB2 H 6.323 3.893 -1.441 1.00 . A A . 19 HIS HB2 1 1 19 6558 1 1 19 HIS HB3 H 5.555 5.460 -1.582 1.00 . A A . 19 HIS HB3 1 1 19 6559 1 1 19 HIS HD1 H 3.239 4.375 -1.784 1.00 . A A . 19 HIS HD1 1 1 19 6560 1 1 19 HIS HD2 H 5.703 3.183 -4.806 1.00 . A A . 19 HIS HD2 1 1 19 6561 1 1 19 HIS HE1 H 1.806 3.266 -3.456 1.00 . A A . 19 HIS HE1 1 1 19 6562 1 1 19 HIS N N 7.759 3.974 -3.746 1.00 . A A . 19 HIS N 1 1 19 6563 1 1 19 HIS ND1 N 3.588 3.994 -2.617 1.00 . A A . 19 HIS ND1 1 1 19 6564 1 1 19 HIS NE2 N 3.606 2.995 -4.526 1.00 . A A . 19 HIS NE2 1 1 19 6565 1 1 19 HIS O O 8.992 5.231 -1.569 1.00 . A A . 19 HIS O 1 1 19 6566 1 1 20 ARG C C 8.656 7.760 0.190 1.00 . A A . 20 ARG C 1 1 19 6567 1 1 20 ARG CA C 8.908 8.010 -1.306 1.00 . A A . 20 ARG CA 1 1 19 6568 1 1 20 ARG CB C 8.651 9.506 -1.635 1.00 . A A . 20 ARG CB 1 1 19 6569 1 1 20 ARG CD C 8.220 9.129 -4.168 1.00 . A A . 20 ARG CD 1 1 19 6570 1 1 20 ARG CG C 9.022 9.904 -3.099 1.00 . A A . 20 ARG CG 1 1 19 6571 1 1 20 ARG CZ C 7.965 10.677 -6.062 1.00 . A A . 20 ARG CZ 1 1 19 6572 1 1 20 ARG H H 7.272 7.572 -2.632 1.00 . A A . 20 ARG H 1 1 19 6573 1 1 20 ARG HA H 9.932 7.750 -1.535 1.00 . A A . 20 ARG HA 1 1 19 6574 1 1 20 ARG HB2 H 7.607 9.728 -1.468 1.00 . A A . 20 ARG HB2 1 1 19 6575 1 1 20 ARG HB3 H 9.232 10.119 -0.959 1.00 . A A . 20 ARG HB3 1 1 19 6576 1 1 20 ARG HD2 H 8.493 8.087 -4.160 1.00 . A A . 20 ARG HD2 1 1 19 6577 1 1 20 ARG HD3 H 7.154 9.220 -4.012 1.00 . A A . 20 ARG HD3 1 1 19 6578 1 1 20 ARG HE H 9.326 9.240 -6.008 1.00 . A A . 20 ARG HE 1 1 19 6579 1 1 20 ARG HG2 H 8.841 10.962 -3.224 1.00 . A A . 20 ARG HG2 1 1 19 6580 1 1 20 ARG HG3 H 10.076 9.727 -3.255 1.00 . A A . 20 ARG HG3 1 1 19 6581 1 1 20 ARG HH11 H 6.691 10.958 -4.537 1.00 . A A . 20 ARG HH11 1 1 19 6582 1 1 20 ARG HH12 H 6.512 12.041 -5.876 1.00 . A A . 20 ARG HH12 1 1 19 6583 1 1 20 ARG HH21 H 9.113 10.604 -7.699 1.00 . A A . 20 ARG HH21 1 1 19 6584 1 1 20 ARG HH22 H 7.900 11.842 -7.688 1.00 . A A . 20 ARG HH22 1 1 19 6585 1 1 20 ARG N N 7.993 7.152 -2.120 1.00 . A A . 20 ARG N 1 1 19 6586 1 1 20 ARG NE N 8.592 9.663 -5.516 1.00 . A A . 20 ARG NE 1 1 19 6587 1 1 20 ARG NH1 N 6.979 11.270 -5.443 1.00 . A A . 20 ARG NH1 1 1 19 6588 1 1 20 ARG NH2 N 8.356 11.072 -7.242 1.00 . A A . 20 ARG NH2 1 1 19 6589 1 1 20 ARG O O 9.466 8.114 1.026 1.00 . A A . 20 ARG O 1 1 19 6590 1 1 21 CYS C C 7.844 5.541 2.315 1.00 . A A . 21 CYS C 1 1 19 6591 1 1 21 CYS CA C 7.139 6.833 1.878 1.00 . A A . 21 CYS CA 1 1 19 6592 1 1 21 CYS CB C 5.638 6.622 1.953 1.00 . A A . 21 CYS CB 1 1 19 6593 1 1 21 CYS H H 6.931 6.890 -0.263 1.00 . A A . 21 CYS H 1 1 19 6594 1 1 21 CYS HA H 7.437 7.643 2.528 1.00 . A A . 21 CYS HA 1 1 19 6595 1 1 21 CYS HB2 H 5.397 5.750 1.361 1.00 . A A . 21 CYS HB2 1 1 19 6596 1 1 21 CYS HB3 H 5.398 6.389 2.979 1.00 . A A . 21 CYS HB3 1 1 19 6597 1 1 21 CYS N N 7.530 7.149 0.469 1.00 . A A . 21 CYS N 1 1 19 6598 1 1 21 CYS O O 8.127 5.349 3.481 1.00 . A A . 21 CYS O 1 1 19 6599 1 1 21 CYS SG S 4.507 7.935 1.432 1.00 . A A . 21 CYS SG 1 1 19 6600 1 1 22 . C C 10.183 3.520 0.975 1.00 . A A . 22 CY3 C 1 1 19 6601 1 1 22 . CA C 8.776 3.394 1.577 1.00 . A A . 22 CY3 CA 1 1 19 6602 1 1 22 . CB C 8.007 2.275 0.860 1.00 . A A . 22 CY3 CB 1 1 19 6603 1 1 22 . H H 7.849 4.935 0.421 1.00 . A A . 22 CY3 H 1 1 19 6604 1 1 22 . HA H 8.854 3.195 2.636 1.00 . A A . 22 CY3 HA 1 1 19 6605 1 1 22 . HB2 H 8.524 1.347 1.052 1.00 . A A . 22 CY3 HB2 1 1 19 6606 1 1 22 . HB3 H 8.076 2.460 -0.201 1.00 . A A . 22 CY3 HB3 1 1 19 6607 1 1 22 . HN11 H 9.862 5.389 0.403 1.00 . A A . 22 CY3 HN11 1 1 19 6608 1 1 22 . HN12 H 11.381 4.782 0.004 1.00 . A A . 22 CY3 HN12 1 1 19 6609 1 1 22 . N N 8.097 4.703 1.340 1.00 . A A . 22 CY3 N 1 1 19 6610 1 1 22 . N1 N 10.508 4.653 0.416 1.00 . A A . 22 CY3 N1 1 1 19 6611 1 1 22 . O O 10.980 2.603 0.996 1.00 . A A . 22 CY3 O 1 1 19 6612 1 1 22 . SG S 6.255 1.988 1.223 1.00 . A A . 22 CY3 SG 1 1 20 6613 1 1 1 PCA C C -3.594 5.809 0.829 1.00 . A A . 1 PCA C 1 1 20 6614 1 1 1 PCA CA C -4.950 5.970 0.132 1.00 . A A . 1 PCA CA 1 1 20 6615 1 1 1 PCA CB C -5.657 4.625 -0.074 1.00 . A A . 1 PCA CB 1 1 20 6616 1 1 1 PCA CD C -5.191 5.562 -2.206 1.00 . A A . 1 PCA CD 1 1 20 6617 1 1 1 PCA CG C -5.384 4.233 -1.519 1.00 . A A . 1 PCA CG 1 1 20 6618 1 1 1 PCA HA H -5.578 6.616 0.725 1.00 . A A . 1 PCA HA 1 1 20 6619 1 1 1 PCA HB2 H -6.716 4.739 0.112 1.00 . A A . 1 PCA HB2 1 1 20 6620 1 1 1 PCA HB3 H -5.283 3.885 0.618 1.00 . A A . 1 PCA HB3 1 1 20 6621 1 1 1 PCA HG2 H -6.229 3.702 -1.933 1.00 . A A . 1 PCA HG2 1 1 20 6622 1 1 1 PCA HG3 H -4.486 3.636 -1.585 1.00 . A A . 1 PCA HG3 1 1 20 6623 1 1 1 PCA N N -4.810 6.566 -1.214 1.00 . A A . 1 PCA N 1 1 20 6624 1 1 1 PCA O O -2.573 5.735 0.172 1.00 . A A . 1 PCA O 1 1 20 6625 1 1 1 PCA OE O -5.334 5.758 -3.395 1.00 . A A . 1 PCA OE 1 1 20 6626 1 1 2 ARG C C -2.094 4.108 3.121 1.00 . A A . 2 ARG C 1 1 20 6627 1 1 2 ARG CA C -2.419 5.608 2.968 1.00 . A A . 2 ARG CA 1 1 20 6628 1 1 2 ARG CB C -2.699 6.313 4.335 1.00 . A A . 2 ARG CB 1 1 20 6629 1 1 2 ARG CD C -4.125 6.468 6.400 1.00 . A A . 2 ARG CD 1 1 20 6630 1 1 2 ARG CG C -3.923 5.709 5.073 1.00 . A A . 2 ARG CG 1 1 20 6631 1 1 2 ARG CZ C -6.522 6.096 6.802 1.00 . A A . 2 ARG CZ 1 1 20 6632 1 1 2 ARG H H -4.523 5.832 2.577 1.00 . A A . 2 ARG H 1 1 20 6633 1 1 2 ARG HA H -1.590 6.097 2.476 1.00 . A A . 2 ARG HA 1 1 20 6634 1 1 2 ARG HB2 H -1.827 6.248 4.968 1.00 . A A . 2 ARG HB2 1 1 20 6635 1 1 2 ARG HB3 H -2.887 7.359 4.146 1.00 . A A . 2 ARG HB3 1 1 20 6636 1 1 2 ARG HD2 H -3.241 6.387 7.018 1.00 . A A . 2 ARG HD2 1 1 20 6637 1 1 2 ARG HD3 H -4.331 7.513 6.218 1.00 . A A . 2 ARG HD3 1 1 20 6638 1 1 2 ARG HE H -5.095 5.265 7.894 1.00 . A A . 2 ARG HE 1 1 20 6639 1 1 2 ARG HG2 H -4.808 5.817 4.464 1.00 . A A . 2 ARG HG2 1 1 20 6640 1 1 2 ARG HG3 H -3.778 4.662 5.288 1.00 . A A . 2 ARG HG3 1 1 20 6641 1 1 2 ARG HH11 H -6.072 7.312 5.272 1.00 . A A . 2 ARG HH11 1 1 20 6642 1 1 2 ARG HH12 H -7.761 7.053 5.557 1.00 . A A . 2 ARG HH12 1 1 20 6643 1 1 2 ARG HH21 H -7.220 4.924 8.266 1.00 . A A . 2 ARG HH21 1 1 20 6644 1 1 2 ARG HH22 H -8.422 5.682 7.275 1.00 . A A . 2 ARG HH22 1 1 20 6645 1 1 2 ARG N N -3.651 5.763 2.135 1.00 . A A . 2 ARG N 1 1 20 6646 1 1 2 ARG NE N -5.277 5.859 7.136 1.00 . A A . 2 ARG NE 1 1 20 6647 1 1 2 ARG NH1 N -6.806 6.883 5.798 1.00 . A A . 2 ARG NH1 1 1 20 6648 1 1 2 ARG NH2 N -7.461 5.522 7.502 1.00 . A A . 2 ARG NH2 1 1 20 6649 1 1 2 ARG O O -2.048 3.559 4.203 1.00 . A A . 2 ARG O 1 1 20 6650 1 1 3 LEU C C -0.066 1.816 2.333 1.00 . A A . 3 LEU C 1 1 20 6651 1 1 3 LEU CA C -1.543 2.031 1.936 1.00 . A A . 3 LEU CA 1 1 20 6652 1 1 3 LEU CB C -1.880 1.578 0.475 1.00 . A A . 3 LEU CB 1 1 20 6653 1 1 3 LEU CD1 C -2.618 -0.783 1.111 1.00 . A A . 3 LEU CD1 1 1 20 6654 1 1 3 LEU CD2 C -1.945 -0.264 -1.256 1.00 . A A . 3 LEU CD2 1 1 20 6655 1 1 3 LEU CG C -1.669 0.053 0.228 1.00 . A A . 3 LEU CG 1 1 20 6656 1 1 3 LEU H H -1.918 3.994 1.152 1.00 . A A . 3 LEU H 1 1 20 6657 1 1 3 LEU HA H -2.162 1.516 2.644 1.00 . A A . 3 LEU HA 1 1 20 6658 1 1 3 LEU HB2 H -2.912 1.823 0.272 1.00 . A A . 3 LEU HB2 1 1 20 6659 1 1 3 LEU HB3 H -1.270 2.140 -0.218 1.00 . A A . 3 LEU HB3 1 1 20 6660 1 1 3 LEU HD11 H -2.424 -0.590 2.154 1.00 . A A . 3 LEU HD11 1 1 20 6661 1 1 3 LEU HD12 H -2.470 -1.836 0.923 1.00 . A A . 3 LEU HD12 1 1 20 6662 1 1 3 LEU HD13 H -3.649 -0.538 0.896 1.00 . A A . 3 LEU HD13 1 1 20 6663 1 1 3 LEU HD21 H -2.960 -0.002 -1.515 1.00 . A A . 3 LEU HD21 1 1 20 6664 1 1 3 LEU HD22 H -1.800 -1.319 -1.441 1.00 . A A . 3 LEU HD22 1 1 20 6665 1 1 3 LEU HD23 H -1.268 0.294 -1.886 1.00 . A A . 3 LEU HD23 1 1 20 6666 1 1 3 LEU HG H -0.651 -0.220 0.449 1.00 . A A . 3 LEU HG 1 1 20 6667 1 1 3 LEU N N -1.871 3.489 1.989 1.00 . A A . 3 LEU N 1 1 20 6668 1 1 3 LEU O O 0.274 1.910 3.495 1.00 . A A . 3 LEU O 1 1 20 6669 1 1 4 CYS C C 2.943 2.331 2.368 1.00 . A A . 4 CYS C 1 1 20 6670 1 1 4 CYS CA C 2.214 1.286 1.512 1.00 . A A . 4 CYS CA 1 1 20 6671 1 1 4 CYS CB C 2.875 1.303 0.147 1.00 . A A . 4 CYS CB 1 1 20 6672 1 1 4 CYS H H 0.383 1.454 0.457 1.00 . A A . 4 CYS H 1 1 20 6673 1 1 4 CYS HA H 2.369 0.323 1.970 1.00 . A A . 4 CYS HA 1 1 20 6674 1 1 4 CYS HB2 H 2.862 2.319 -0.211 1.00 . A A . 4 CYS HB2 1 1 20 6675 1 1 4 CYS HB3 H 3.913 1.052 0.303 1.00 . A A . 4 CYS HB3 1 1 20 6676 1 1 4 CYS N N 0.750 1.528 1.355 1.00 . A A . 4 CYS N 1 1 20 6677 1 1 4 CYS O O 3.627 2.007 3.319 1.00 . A A . 4 CYS O 1 1 20 6678 1 1 4 CYS SG S 2.300 0.290 -1.235 1.00 . A A . 4 CYS SG 1 1 20 6679 1 1 5 CYS C C 2.678 5.088 3.965 1.00 . A A . 5 CYS C 1 1 20 6680 1 1 5 CYS CA C 3.394 4.718 2.662 1.00 . A A . 5 CYS CA 1 1 20 6681 1 1 5 CYS CB C 3.405 5.882 1.636 1.00 . A A . 5 CYS CB 1 1 20 6682 1 1 5 CYS H H 2.158 3.718 1.201 1.00 . A A . 5 CYS H 1 1 20 6683 1 1 5 CYS HA H 4.403 4.435 2.908 1.00 . A A . 5 CYS HA 1 1 20 6684 1 1 5 CYS HB2 H 3.658 5.461 0.674 1.00 . A A . 5 CYS HB2 1 1 20 6685 1 1 5 CYS HB3 H 2.395 6.258 1.557 1.00 . A A . 5 CYS HB3 1 1 20 6686 1 1 5 CYS N N 2.749 3.562 1.968 1.00 . A A . 5 CYS N 1 1 20 6687 1 1 5 CYS O O 3.228 5.792 4.789 1.00 . A A . 5 CYS O 1 1 20 6688 1 1 5 CYS SG S 4.484 7.324 1.855 1.00 . A A . 5 CYS SG 1 1 20 6689 1 1 6 GLY C C 1.020 3.865 6.431 1.00 . A A . 6 GLY C 1 1 20 6690 1 1 6 GLY CA C 0.685 4.894 5.347 1.00 . A A . 6 GLY CA 1 1 20 6691 1 1 6 GLY H H 1.083 4.040 3.410 1.00 . A A . 6 GLY H 1 1 20 6692 1 1 6 GLY HA2 H 0.910 5.889 5.704 1.00 . A A . 6 GLY HA2 1 1 20 6693 1 1 6 GLY HA3 H -0.363 4.827 5.120 1.00 . A A . 6 GLY HA3 1 1 20 6694 1 1 6 GLY N N 1.472 4.601 4.113 1.00 . A A . 6 GLY N 1 1 20 6695 1 1 6 GLY O O 0.998 4.179 7.605 1.00 . A A . 6 GLY O 1 1 20 6696 1 1 7 PHE C C 2.445 0.387 6.272 1.00 . A A . 7 PHE C 1 1 20 6697 1 1 7 PHE CA C 1.668 1.561 6.932 1.00 . A A . 7 PHE CA 1 1 20 6698 1 1 7 PHE CB C 0.346 1.051 7.591 1.00 . A A . 7 PHE CB 1 1 20 6699 1 1 7 PHE CD1 C -0.617 -0.439 5.763 1.00 . A A . 7 PHE CD1 1 1 20 6700 1 1 7 PHE CD2 C -1.869 1.464 6.440 1.00 . A A . 7 PHE CD2 1 1 20 6701 1 1 7 PHE CE1 C -1.600 -0.766 4.854 1.00 . A A . 7 PHE CE1 1 1 20 6702 1 1 7 PHE CE2 C -2.855 1.140 5.532 1.00 . A A . 7 PHE CE2 1 1 20 6703 1 1 7 PHE CG C -0.740 0.677 6.564 1.00 . A A . 7 PHE CG 1 1 20 6704 1 1 7 PHE CZ C -2.721 0.023 4.739 1.00 . A A . 7 PHE CZ 1 1 20 6705 1 1 7 PHE H H 1.320 2.494 5.030 1.00 . A A . 7 PHE H 1 1 20 6706 1 1 7 PHE HA H 2.288 1.990 7.704 1.00 . A A . 7 PHE HA 1 1 20 6707 1 1 7 PHE HB2 H 0.554 0.180 8.194 1.00 . A A . 7 PHE HB2 1 1 20 6708 1 1 7 PHE HB3 H -0.045 1.819 8.245 1.00 . A A . 7 PHE HB3 1 1 20 6709 1 1 7 PHE HD1 H 0.257 -1.062 5.850 1.00 . A A . 7 PHE HD1 1 1 20 6710 1 1 7 PHE HD2 H -1.985 2.343 7.058 1.00 . A A . 7 PHE HD2 1 1 20 6711 1 1 7 PHE HE1 H -1.493 -1.642 4.232 1.00 . A A . 7 PHE HE1 1 1 20 6712 1 1 7 PHE HE2 H -3.733 1.761 5.443 1.00 . A A . 7 PHE HE2 1 1 20 6713 1 1 7 PHE HZ H -3.492 -0.233 4.027 1.00 . A A . 7 PHE HZ 1 1 20 6714 1 1 7 PHE N N 1.320 2.667 5.992 1.00 . A A . 7 PHE N 1 1 20 6715 1 1 7 PHE O O 2.197 -0.003 5.140 1.00 . A A . 7 PHE O 1 1 20 6716 1 1 8 HYP C C 3.785 -2.423 6.063 1.00 . A A . 8 HYP C 1 1 20 6717 1 1 8 HYP CA C 4.390 -1.090 6.519 1.00 . A A . 8 HYP CA 1 1 20 6718 1 1 8 HYP CB C 5.385 -1.250 7.664 1.00 . A A . 8 HYP CB 1 1 20 6719 1 1 8 HYP CD C 3.584 0.068 8.485 1.00 . A A . 8 HYP CD 1 1 20 6720 1 1 8 HYP CG C 4.555 -1.014 8.874 1.00 . A A . 8 HYP CG 1 1 20 6721 1 1 8 HYP HA H 4.913 -0.648 5.687 1.00 . A A . 8 HYP HA 1 1 20 6722 1 1 8 HYP HB2 H 6.184 -0.528 7.567 1.00 . A A . 8 HYP HB2 1 1 20 6723 1 1 8 HYP HB3 H 5.828 -2.236 7.662 1.00 . A A . 8 HYP HB3 1 1 20 6724 1 1 8 HYP HD1 H 4.792 -0.219 10.633 1.00 . A A . 8 HYP HD1 1 1 20 6725 1 1 8 HYP HD22 H 4.013 1.043 8.671 1.00 . A A . 8 HYP HD22 1 1 20 6726 1 1 8 HYP HD23 H 2.661 -0.050 9.034 1.00 . A A . 8 HYP HD23 1 1 20 6727 1 1 8 HYP HG H 4.022 -1.918 9.135 1.00 . A A . 8 HYP HG 1 1 20 6728 1 1 8 HYP N N 3.379 -0.149 7.034 1.00 . A A . 8 HYP N 1 1 20 6729 1 1 8 HYP O O 4.498 -3.265 5.551 1.00 . A A . 8 HYP O 1 1 20 6730 1 1 8 HYP OD1 O 5.367 -0.596 9.962 1.00 . A A . 8 HYP OD1 1 1 20 6731 1 1 9 LYS C C 1.930 -3.985 4.355 1.00 . A A . 9 LYS C 1 1 20 6732 1 1 9 LYS CA C 1.792 -3.808 5.867 1.00 . A A . 9 LYS CA 1 1 20 6733 1 1 9 LYS CB C 0.294 -3.723 6.217 1.00 . A A . 9 LYS CB 1 1 20 6734 1 1 9 LYS CD C -1.406 -3.270 8.008 1.00 . A A . 9 LYS CD 1 1 20 6735 1 1 9 LYS CE C -1.625 -2.854 9.474 1.00 . A A . 9 LYS CE 1 1 20 6736 1 1 9 LYS CG C 0.104 -3.369 7.708 1.00 . A A . 9 LYS CG 1 1 20 6737 1 1 9 LYS H H 1.990 -1.831 6.682 1.00 . A A . 9 LYS H 1 1 20 6738 1 1 9 LYS HA H 2.250 -4.647 6.369 1.00 . A A . 9 LYS HA 1 1 20 6739 1 1 9 LYS HB2 H -0.206 -3.014 5.580 1.00 . A A . 9 LYS HB2 1 1 20 6740 1 1 9 LYS HB3 H -0.149 -4.692 6.038 1.00 . A A . 9 LYS HB3 1 1 20 6741 1 1 9 LYS HD2 H -1.866 -2.543 7.355 1.00 . A A . 9 LYS HD2 1 1 20 6742 1 1 9 LYS HD3 H -1.875 -4.229 7.838 1.00 . A A . 9 LYS HD3 1 1 20 6743 1 1 9 LYS HE2 H -2.683 -2.802 9.687 1.00 . A A . 9 LYS HE2 1 1 20 6744 1 1 9 LYS HE3 H -1.169 -3.567 10.144 1.00 . A A . 9 LYS HE3 1 1 20 6745 1 1 9 LYS HG2 H 0.548 -4.138 8.323 1.00 . A A . 9 LYS HG2 1 1 20 6746 1 1 9 LYS HG3 H 0.586 -2.427 7.931 1.00 . A A . 9 LYS HG3 1 1 20 6747 1 1 9 LYS HZ1 H 0.006 -1.604 9.812 1.00 . A A . 9 LYS HZ1 1 1 20 6748 1 1 9 LYS HZ2 H -1.416 -1.115 10.602 1.00 . A A . 9 LYS HZ2 1 1 20 6749 1 1 9 LYS HZ3 H -1.249 -0.879 8.929 1.00 . A A . 9 LYS HZ3 1 1 20 6750 1 1 9 LYS N N 2.497 -2.557 6.266 1.00 . A A . 9 LYS N 1 1 20 6751 1 1 9 LYS NZ N -1.026 -1.512 9.724 1.00 . A A . 9 LYS NZ 1 1 20 6752 1 1 9 LYS O O 2.138 -5.095 3.903 1.00 . A A . 9 LYS O 1 1 20 6753 1 1 10 SER C C 3.365 -2.743 1.629 1.00 . A A . 10 SER C 1 1 20 6754 1 1 10 SER CA C 1.941 -3.040 2.127 1.00 . A A . 10 SER CA 1 1 20 6755 1 1 10 SER CB C 0.915 -2.090 1.497 1.00 . A A . 10 SER CB 1 1 20 6756 1 1 10 SER H H 1.651 -2.006 3.997 1.00 . A A . 10 SER H 1 1 20 6757 1 1 10 SER HA H 1.688 -4.050 1.837 1.00 . A A . 10 SER HA 1 1 20 6758 1 1 10 SER HB2 H 1.020 -1.084 1.857 1.00 . A A . 10 SER HB2 1 1 20 6759 1 1 10 SER HB3 H 0.933 -2.113 0.417 1.00 . A A . 10 SER HB3 1 1 20 6760 1 1 10 SER HG H -0.327 -2.548 2.921 1.00 . A A . 10 SER HG 1 1 20 6761 1 1 10 SER N N 1.815 -2.901 3.613 1.00 . A A . 10 SER N 1 1 20 6762 1 1 10 SER O O 3.812 -3.347 0.675 1.00 . A A . 10 SER O 1 1 20 6763 1 1 10 SER OG O -0.327 -2.597 1.962 1.00 . A A . 10 SER OG 1 1 20 6764 1 1 11 CYS C C 6.442 -2.391 1.456 1.00 . A A . 11 CYS C 1 1 20 6765 1 1 11 CYS CA C 5.421 -1.372 2.007 1.00 . A A . 11 CYS CA 1 1 20 6766 1 1 11 CYS CB C 5.961 -0.776 3.296 1.00 . A A . 11 CYS CB 1 1 20 6767 1 1 11 CYS H H 3.555 -1.420 3.069 1.00 . A A . 11 CYS H 1 1 20 6768 1 1 11 CYS HA H 5.344 -0.568 1.291 1.00 . A A . 11 CYS HA 1 1 20 6769 1 1 11 CYS HB2 H 5.296 0.022 3.593 1.00 . A A . 11 CYS HB2 1 1 20 6770 1 1 11 CYS HB3 H 5.890 -1.549 4.046 1.00 . A A . 11 CYS HB3 1 1 20 6771 1 1 11 CYS N N 4.017 -1.833 2.309 1.00 . A A . 11 CYS N 1 1 20 6772 1 1 11 CYS O O 7.352 -2.008 0.747 1.00 . A A . 11 CYS O 1 1 20 6773 1 1 11 CYS SG S 7.647 -0.125 3.406 1.00 . A A . 11 CYS SG 1 1 20 6774 1 1 12 ARG C C 6.929 -5.149 -0.152 1.00 . A A . 12 ARG C 1 1 20 6775 1 1 12 ARG CA C 7.209 -4.714 1.309 1.00 . A A . 12 ARG CA 1 1 20 6776 1 1 12 ARG CB C 7.056 -5.889 2.307 1.00 . A A . 12 ARG CB 1 1 20 6777 1 1 12 ARG CD C 7.842 -8.158 3.080 1.00 . A A . 12 ARG CD 1 1 20 6778 1 1 12 ARG CG C 8.052 -7.047 2.035 1.00 . A A . 12 ARG CG 1 1 20 6779 1 1 12 ARG CZ C 5.952 -9.562 3.766 1.00 . A A . 12 ARG CZ 1 1 20 6780 1 1 12 ARG H H 5.509 -3.890 2.353 1.00 . A A . 12 ARG H 1 1 20 6781 1 1 12 ARG HA H 8.220 -4.335 1.363 1.00 . A A . 12 ARG HA 1 1 20 6782 1 1 12 ARG HB2 H 7.217 -5.517 3.309 1.00 . A A . 12 ARG HB2 1 1 20 6783 1 1 12 ARG HB3 H 6.044 -6.263 2.247 1.00 . A A . 12 ARG HB3 1 1 20 6784 1 1 12 ARG HD2 H 8.546 -8.962 2.924 1.00 . A A . 12 ARG HD2 1 1 20 6785 1 1 12 ARG HD3 H 7.964 -7.766 4.080 1.00 . A A . 12 ARG HD3 1 1 20 6786 1 1 12 ARG HE H 5.901 -8.378 2.177 1.00 . A A . 12 ARG HE 1 1 20 6787 1 1 12 ARG HG2 H 7.889 -7.481 1.063 1.00 . A A . 12 ARG HG2 1 1 20 6788 1 1 12 ARG HG3 H 9.068 -6.682 2.089 1.00 . A A . 12 ARG HG3 1 1 20 6789 1 1 12 ARG HH11 H 7.592 -9.663 4.915 1.00 . A A . 12 ARG HH11 1 1 20 6790 1 1 12 ARG HH12 H 6.266 -10.663 5.407 1.00 . A A . 12 ARG HH12 1 1 20 6791 1 1 12 ARG HH21 H 4.210 -9.634 2.783 1.00 . A A . 12 ARG HH21 1 1 20 6792 1 1 12 ARG HH22 H 4.323 -10.647 4.185 1.00 . A A . 12 ARG HH22 1 1 20 6793 1 1 12 ARG N N 6.268 -3.645 1.785 1.00 . A A . 12 ARG N 1 1 20 6794 1 1 12 ARG NE N 6.451 -8.690 2.926 1.00 . A A . 12 ARG NE 1 1 20 6795 1 1 12 ARG NH1 N 6.660 -9.996 4.775 1.00 . A A . 12 ARG NH1 1 1 20 6796 1 1 12 ARG NH2 N 4.734 -9.981 3.562 1.00 . A A . 12 ARG NH2 1 1 20 6797 1 1 12 ARG O O 7.577 -6.038 -0.667 1.00 . A A . 12 ARG O 1 1 20 6798 1 1 13 SER C C 6.447 -4.076 -3.239 1.00 . A A . 13 SER C 1 1 20 6799 1 1 13 SER CA C 5.630 -4.859 -2.201 1.00 . A A . 13 SER CA 1 1 20 6800 1 1 13 SER CB C 4.125 -4.586 -2.404 1.00 . A A . 13 SER CB 1 1 20 6801 1 1 13 SER H H 5.497 -3.786 -0.339 1.00 . A A . 13 SER H 1 1 20 6802 1 1 13 SER HA H 5.808 -5.915 -2.351 1.00 . A A . 13 SER HA 1 1 20 6803 1 1 13 SER HB2 H 3.523 -5.185 -1.738 1.00 . A A . 13 SER HB2 1 1 20 6804 1 1 13 SER HB3 H 3.895 -3.541 -2.269 1.00 . A A . 13 SER HB3 1 1 20 6805 1 1 13 SER HG H 4.441 -5.653 -4.011 1.00 . A A . 13 SER HG 1 1 20 6806 1 1 13 SER N N 5.981 -4.508 -0.788 1.00 . A A . 13 SER N 1 1 20 6807 1 1 13 SER O O 6.958 -3.004 -2.976 1.00 . A A . 13 SER O 1 1 20 6808 1 1 13 SER OG O 3.841 -4.951 -3.750 1.00 . A A . 13 SER OG 1 1 20 6809 1 1 14 ARG C C 6.484 -2.810 -5.957 1.00 . A A . 14 ARG C 1 1 20 6810 1 1 14 ARG CA C 7.280 -4.055 -5.541 1.00 . A A . 14 ARG CA 1 1 20 6811 1 1 14 ARG CB C 7.357 -5.088 -6.679 1.00 . A A . 14 ARG CB 1 1 20 6812 1 1 14 ARG CD C 8.188 -5.585 -8.991 1.00 . A A . 14 ARG CD 1 1 20 6813 1 1 14 ARG CG C 8.107 -4.506 -7.897 1.00 . A A . 14 ARG CG 1 1 20 6814 1 1 14 ARG CZ C 8.295 -4.742 -11.312 1.00 . A A . 14 ARG CZ 1 1 20 6815 1 1 14 ARG H H 6.094 -5.537 -4.529 1.00 . A A . 14 ARG H 1 1 20 6816 1 1 14 ARG HA H 8.266 -3.762 -5.206 1.00 . A A . 14 ARG HA 1 1 20 6817 1 1 14 ARG HB2 H 7.876 -5.966 -6.322 1.00 . A A . 14 ARG HB2 1 1 20 6818 1 1 14 ARG HB3 H 6.357 -5.377 -6.970 1.00 . A A . 14 ARG HB3 1 1 20 6819 1 1 14 ARG HD2 H 8.762 -6.427 -8.636 1.00 . A A . 14 ARG HD2 1 1 20 6820 1 1 14 ARG HD3 H 7.202 -5.928 -9.265 1.00 . A A . 14 ARG HD3 1 1 20 6821 1 1 14 ARG HE H 9.852 -4.800 -10.097 1.00 . A A . 14 ARG HE 1 1 20 6822 1 1 14 ARG HG2 H 7.577 -3.647 -8.284 1.00 . A A . 14 ARG HG2 1 1 20 6823 1 1 14 ARG HG3 H 9.103 -4.199 -7.611 1.00 . A A . 14 ARG HG3 1 1 20 6824 1 1 14 ARG HH11 H 6.470 -5.371 -10.749 1.00 . A A . 14 ARG HH11 1 1 20 6825 1 1 14 ARG HH12 H 6.595 -4.777 -12.365 1.00 . A A . 14 ARG HH12 1 1 20 6826 1 1 14 ARG HH21 H 9.987 -4.055 -12.126 1.00 . A A . 14 ARG HH21 1 1 20 6827 1 1 14 ARG HH22 H 8.594 -4.024 -13.156 1.00 . A A . 14 ARG HH22 1 1 20 6828 1 1 14 ARG N N 6.532 -4.671 -4.402 1.00 . A A . 14 ARG N 1 1 20 6829 1 1 14 ARG NE N 8.896 -5.000 -10.175 1.00 . A A . 14 ARG NE 1 1 20 6830 1 1 14 ARG NH1 N 7.022 -4.983 -11.485 1.00 . A A . 14 ARG NH1 1 1 20 6831 1 1 14 ARG NH2 N 9.015 -4.234 -12.274 1.00 . A A . 14 ARG NH2 1 1 20 6832 1 1 14 ARG O O 7.044 -1.816 -6.377 1.00 . A A . 14 ARG O 1 1 20 6833 1 1 15 GLN C C 4.494 -0.668 -5.162 1.00 . A A . 15 GLN C 1 1 20 6834 1 1 15 GLN CA C 4.258 -1.806 -6.172 1.00 . A A . 15 GLN CA 1 1 20 6835 1 1 15 GLN CB C 2.815 -2.335 -6.090 1.00 . A A . 15 GLN CB 1 1 20 6836 1 1 15 GLN CD C 0.389 -1.804 -6.378 1.00 . A A . 15 GLN CD 1 1 20 6837 1 1 15 GLN CG C 1.806 -1.228 -6.464 1.00 . A A . 15 GLN CG 1 1 20 6838 1 1 15 GLN H H 4.808 -3.762 -5.476 1.00 . A A . 15 GLN H 1 1 20 6839 1 1 15 GLN HA H 4.487 -1.456 -7.168 1.00 . A A . 15 GLN HA 1 1 20 6840 1 1 15 GLN HB2 H 2.706 -3.168 -6.770 1.00 . A A . 15 GLN HB2 1 1 20 6841 1 1 15 GLN HB3 H 2.616 -2.686 -5.087 1.00 . A A . 15 GLN HB3 1 1 20 6842 1 1 15 GLN HE21 H 0.386 -1.825 -4.393 1.00 . A A . 15 GLN HE21 1 1 20 6843 1 1 15 GLN HE22 H -1.033 -2.397 -5.128 1.00 . A A . 15 GLN HE22 1 1 20 6844 1 1 15 GLN HG2 H 1.877 -0.393 -5.782 1.00 . A A . 15 GLN HG2 1 1 20 6845 1 1 15 GLN HG3 H 1.984 -0.879 -7.472 1.00 . A A . 15 GLN HG3 1 1 20 6846 1 1 15 GLN N N 5.184 -2.924 -5.819 1.00 . A A . 15 GLN N 1 1 20 6847 1 1 15 GLN NE2 N -0.129 -2.027 -5.202 1.00 . A A . 15 GLN NE2 1 1 20 6848 1 1 15 GLN O O 4.254 0.486 -5.459 1.00 . A A . 15 GLN O 1 1 20 6849 1 1 15 GLN OE1 O -0.256 -2.054 -7.376 1.00 . A A . 15 GLN OE1 1 1 20 6850 1 1 16 CYS C C 6.669 0.484 -2.982 1.00 . A A . 16 CYS C 1 1 20 6851 1 1 16 CYS CA C 5.244 -0.080 -2.903 1.00 . A A . 16 CYS CA 1 1 20 6852 1 1 16 CYS CB C 5.072 -0.755 -1.553 1.00 . A A . 16 CYS CB 1 1 20 6853 1 1 16 CYS H H 5.118 -2.004 -3.833 1.00 . A A . 16 CYS H 1 1 20 6854 1 1 16 CYS HA H 4.538 0.729 -2.970 1.00 . A A . 16 CYS HA 1 1 20 6855 1 1 16 CYS HB2 H 5.751 -1.587 -1.486 1.00 . A A . 16 CYS HB2 1 1 20 6856 1 1 16 CYS HB3 H 5.379 -0.045 -0.799 1.00 . A A . 16 CYS HB3 1 1 20 6857 1 1 16 CYS N N 4.956 -1.054 -3.995 1.00 . A A . 16 CYS N 1 1 20 6858 1 1 16 CYS O O 6.955 1.508 -2.390 1.00 . A A . 16 CYS O 1 1 20 6859 1 1 16 CYS SG S 3.441 -1.362 -1.072 1.00 . A A . 16 CYS SG 1 1 20 6860 1 1 17 LYS C C 9.094 1.735 -4.312 1.00 . A A . 17 LYS C 1 1 20 6861 1 1 17 LYS CA C 8.939 0.253 -3.855 1.00 . A A . 17 LYS CA 1 1 20 6862 1 1 17 LYS CB C 9.644 -0.703 -4.862 1.00 . A A . 17 LYS CB 1 1 20 6863 1 1 17 LYS CD C 11.921 -0.460 -3.722 1.00 . A A . 17 LYS CD 1 1 20 6864 1 1 17 LYS CE C 13.407 -0.128 -3.945 1.00 . A A . 17 LYS CE 1 1 20 6865 1 1 17 LYS CG C 11.143 -0.346 -5.061 1.00 . A A . 17 LYS CG 1 1 20 6866 1 1 17 LYS H H 7.222 -1.022 -4.150 1.00 . A A . 17 LYS H 1 1 20 6867 1 1 17 LYS HA H 9.409 0.140 -2.891 1.00 . A A . 17 LYS HA 1 1 20 6868 1 1 17 LYS HB2 H 9.569 -1.716 -4.493 1.00 . A A . 17 LYS HB2 1 1 20 6869 1 1 17 LYS HB3 H 9.153 -0.663 -5.821 1.00 . A A . 17 LYS HB3 1 1 20 6870 1 1 17 LYS HD2 H 11.522 0.233 -2.997 1.00 . A A . 17 LYS HD2 1 1 20 6871 1 1 17 LYS HD3 H 11.831 -1.462 -3.328 1.00 . A A . 17 LYS HD3 1 1 20 6872 1 1 17 LYS HE2 H 13.515 0.874 -4.336 1.00 . A A . 17 LYS HE2 1 1 20 6873 1 1 17 LYS HE3 H 13.943 -0.197 -3.011 1.00 . A A . 17 LYS HE3 1 1 20 6874 1 1 17 LYS HG2 H 11.565 -1.034 -5.780 1.00 . A A . 17 LYS HG2 1 1 20 6875 1 1 17 LYS HG3 H 11.236 0.654 -5.457 1.00 . A A . 17 LYS HG3 1 1 20 6876 1 1 17 LYS HZ1 H 13.773 -0.799 -5.882 1.00 . A A . 17 LYS HZ1 1 1 20 6877 1 1 17 LYS HZ2 H 13.645 -2.041 -4.730 1.00 . A A . 17 LYS HZ2 1 1 20 6878 1 1 17 LYS HZ3 H 15.048 -1.086 -4.796 1.00 . A A . 17 LYS HZ3 1 1 20 6879 1 1 17 LYS N N 7.521 -0.201 -3.705 1.00 . A A . 17 LYS N 1 1 20 6880 1 1 17 LYS NZ N 14.014 -1.087 -4.912 1.00 . A A . 17 LYS NZ 1 1 20 6881 1 1 17 LYS O O 9.913 2.436 -3.752 1.00 . A A . 17 LYS O 1 1 20 6882 1 1 18 HYP C C 7.776 4.632 -4.841 1.00 . A A . 18 HYP C 1 1 20 6883 1 1 18 HYP CA C 8.428 3.583 -5.773 1.00 . A A . 18 HYP CA 1 1 20 6884 1 1 18 HYP CB C 7.793 3.528 -7.157 1.00 . A A . 18 HYP CB 1 1 20 6885 1 1 18 HYP CD C 7.313 1.451 -6.065 1.00 . A A . 18 HYP CD 1 1 20 6886 1 1 18 HYP CG C 6.743 2.482 -7.009 1.00 . A A . 18 HYP CG 1 1 20 6887 1 1 18 HYP HA H 9.462 3.865 -5.906 1.00 . A A . 18 HYP HA 1 1 20 6888 1 1 18 HYP HB2 H 8.534 3.264 -7.897 1.00 . A A . 18 HYP HB2 1 1 20 6889 1 1 18 HYP HB3 H 7.375 4.486 -7.433 1.00 . A A . 18 HYP HB3 1 1 20 6890 1 1 18 HYP HD1 H 7.241 1.453 -8.583 1.00 . A A . 18 HYP HD1 1 1 20 6891 1 1 18 HYP HD22 H 7.756 0.641 -6.624 1.00 . A A . 18 HYP HD22 1 1 20 6892 1 1 18 HYP HD23 H 6.528 1.087 -5.427 1.00 . A A . 18 HYP HD23 1 1 20 6893 1 1 18 HYP HG H 5.849 2.920 -6.590 1.00 . A A . 18 HYP HG 1 1 20 6894 1 1 18 HYP N N 8.336 2.187 -5.291 1.00 . A A . 18 HYP N 1 1 20 6895 1 1 18 HYP O O 7.666 5.778 -5.234 1.00 . A A . 18 HYP O 1 1 20 6896 1 1 18 HYP OD1 O 6.450 1.898 -8.270 1.00 . A A . 18 HYP OD1 1 1 20 6897 1 1 19 HIS C C 7.773 6.005 -1.945 1.00 . A A . 19 HIS C 1 1 20 6898 1 1 19 HIS CA C 6.730 5.197 -2.714 1.00 . A A . 19 HIS CA 1 1 20 6899 1 1 19 HIS CB C 5.837 4.429 -1.722 1.00 . A A . 19 HIS CB 1 1 20 6900 1 1 19 HIS CD2 C 4.584 3.138 -3.694 1.00 . A A . 19 HIS CD2 1 1 20 6901 1 1 19 HIS CE1 C 2.670 3.206 -2.905 1.00 . A A . 19 HIS CE1 1 1 20 6902 1 1 19 HIS CG C 4.656 3.802 -2.478 1.00 . A A . 19 HIS CG 1 1 20 6903 1 1 19 HIS H H 7.488 3.292 -3.389 1.00 . A A . 19 HIS H 1 1 20 6904 1 1 19 HIS HA H 6.116 5.883 -3.282 1.00 . A A . 19 HIS HA 1 1 20 6905 1 1 19 HIS HB2 H 6.397 3.647 -1.234 1.00 . A A . 19 HIS HB2 1 1 20 6906 1 1 19 HIS HB3 H 5.449 5.102 -0.971 1.00 . A A . 19 HIS HB3 1 1 20 6907 1 1 19 HIS HD1 H 3.138 4.200 -1.205 1.00 . A A . 19 HIS HD1 1 1 20 6908 1 1 19 HIS HD2 H 5.421 2.944 -4.346 1.00 . A A . 19 HIS HD2 1 1 20 6909 1 1 19 HIS HE1 H 1.605 3.076 -2.776 1.00 . A A . 19 HIS HE1 1 1 20 6910 1 1 19 HIS N N 7.372 4.226 -3.661 1.00 . A A . 19 HIS N 1 1 20 6911 1 1 19 HIS ND1 N 3.436 3.804 -2.051 1.00 . A A . 19 HIS ND1 1 1 20 6912 1 1 19 HIS NE2 N 3.342 2.776 -3.943 1.00 . A A . 19 HIS NE2 1 1 20 6913 1 1 19 HIS O O 8.867 5.541 -1.697 1.00 . A A . 19 HIS O 1 1 20 6914 1 1 20 ARG C C 8.657 7.561 0.549 1.00 . A A . 20 ARG C 1 1 20 6915 1 1 20 ARG CA C 8.291 8.123 -0.833 1.00 . A A . 20 ARG CA 1 1 20 6916 1 1 20 ARG CB C 7.592 9.501 -0.666 1.00 . A A . 20 ARG CB 1 1 20 6917 1 1 20 ARG CD C 6.451 9.486 -3.001 1.00 . A A . 20 ARG CD 1 1 20 6918 1 1 20 ARG CG C 7.361 10.255 -2.017 1.00 . A A . 20 ARG CG 1 1 20 6919 1 1 20 ARG CZ C 5.596 9.879 -5.259 1.00 . A A . 20 ARG CZ 1 1 20 6920 1 1 20 ARG H H 6.483 7.498 -1.822 1.00 . A A . 20 ARG H 1 1 20 6921 1 1 20 ARG HA H 9.201 8.250 -1.400 1.00 . A A . 20 ARG HA 1 1 20 6922 1 1 20 ARG HB2 H 6.638 9.355 -0.179 1.00 . A A . 20 ARG HB2 1 1 20 6923 1 1 20 ARG HB3 H 8.198 10.125 -0.026 1.00 . A A . 20 ARG HB3 1 1 20 6924 1 1 20 ARG HD2 H 6.932 8.582 -3.339 1.00 . A A . 20 ARG HD2 1 1 20 6925 1 1 20 ARG HD3 H 5.500 9.247 -2.547 1.00 . A A . 20 ARG HD3 1 1 20 6926 1 1 20 ARG HE H 6.547 11.266 -4.207 1.00 . A A . 20 ARG HE 1 1 20 6927 1 1 20 ARG HG2 H 6.916 11.216 -1.807 1.00 . A A . 20 ARG HG2 1 1 20 6928 1 1 20 ARG HG3 H 8.318 10.427 -2.490 1.00 . A A . 20 ARG HG3 1 1 20 6929 1 1 20 ARG HH11 H 5.289 8.047 -4.498 1.00 . A A . 20 ARG HH11 1 1 20 6930 1 1 20 ARG HH12 H 4.675 8.309 -6.095 1.00 . A A . 20 ARG HH12 1 1 20 6931 1 1 20 ARG HH21 H 5.776 11.616 -6.236 1.00 . A A . 20 ARG HH21 1 1 20 6932 1 1 20 ARG HH22 H 4.955 10.354 -7.093 1.00 . A A . 20 ARG HH22 1 1 20 6933 1 1 20 ARG N N 7.387 7.201 -1.589 1.00 . A A . 20 ARG N 1 1 20 6934 1 1 20 ARG NE N 6.222 10.342 -4.205 1.00 . A A . 20 ARG NE 1 1 20 6935 1 1 20 ARG NH1 N 5.153 8.648 -5.284 1.00 . A A . 20 ARG NH1 1 1 20 6936 1 1 20 ARG NH2 N 5.429 10.679 -6.275 1.00 . A A . 20 ARG NH2 1 1 20 6937 1 1 20 ARG O O 9.657 7.945 1.123 1.00 . A A . 20 ARG O 1 1 20 6938 1 1 21 CYS C C 8.758 4.670 2.243 1.00 . A A . 21 CYS C 1 1 20 6939 1 1 21 CYS CA C 8.065 6.034 2.373 1.00 . A A . 21 CYS CA 1 1 20 6940 1 1 21 CYS CB C 6.751 5.761 3.101 1.00 . A A . 21 CYS CB 1 1 20 6941 1 1 21 CYS H H 7.046 6.404 0.510 1.00 . A A . 21 CYS H 1 1 20 6942 1 1 21 CYS HA H 8.698 6.677 2.965 1.00 . A A . 21 CYS HA 1 1 20 6943 1 1 21 CYS HB2 H 6.230 5.055 2.475 1.00 . A A . 21 CYS HB2 1 1 20 6944 1 1 21 CYS HB3 H 6.992 5.244 4.019 1.00 . A A . 21 CYS HB3 1 1 20 6945 1 1 21 CYS N N 7.831 6.666 1.035 1.00 . A A . 21 CYS N 1 1 20 6946 1 1 21 CYS O O 9.318 4.184 3.207 1.00 . A A . 21 CYS O 1 1 20 6947 1 1 21 CYS SG S 5.540 7.029 3.551 1.00 . A A . 21 CYS SG 1 1 20 6948 1 1 22 . C C 9.978 2.702 -0.529 1.00 . A A . 22 CY3 C 1 1 20 6949 1 1 22 . CA C 9.332 2.761 0.845 1.00 . A A . 22 CY3 CA 1 1 20 6950 1 1 22 . CB C 8.195 1.738 1.032 1.00 . A A . 22 CY3 CB 1 1 20 6951 1 1 22 . H H 8.257 4.538 0.312 1.00 . A A . 22 CY3 H 1 1 20 6952 1 1 22 . HA H 10.102 2.593 1.585 1.00 . A A . 22 CY3 HA 1 1 20 6953 1 1 22 . HB2 H 8.556 0.745 0.811 1.00 . A A . 22 CY3 HB2 1 1 20 6954 1 1 22 . HB3 H 7.399 1.964 0.337 1.00 . A A . 22 CY3 HB3 1 1 20 6955 1 1 22 . HN11 H 10.580 4.583 -0.386 1.00 . A A . 22 CY3 HN11 1 1 20 6956 1 1 22 . HN12 H 10.997 3.803 -1.827 1.00 . A A . 22 CY3 HN12 1 1 20 6957 1 1 22 . N N 8.703 4.096 1.067 1.00 . A A . 22 CY3 N 1 1 20 6958 1 1 22 . N1 N 10.569 3.782 -0.951 1.00 . A A . 22 CY3 N1 1 1 20 6959 1 1 22 . O O 9.956 1.702 -1.215 1.00 . A A . 22 CY3 O 1 1 20 6960 1 1 22 . SG S 7.495 1.760 2.702 1.00 . A A . 22 CY3 SG 1 1 stop_ save_
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