HEADER LIGASE/IMMUNE SYSTEM 26-SEP-24 9DRY TITLE CHIP U-BOX DIMER BOUND TO FAB 2F1 COMPND MOL_ID: 1; COMPND 2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE CHIP; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: U-BOX DOMAIN; COMPND 5 SYNONYM: ANTIGEN NY-CO-7,CLL-ASSOCIATED ANTIGEN KW-8,CARBOXY TERMINUS COMPND 6 OF HSP70-INTERACTING PROTEIN,RING-TYPE E3 UBIQUITIN TRANSFERASE CHIP, COMPND 7 STIP1 HOMOLOGY AND U BOX-CONTAINING PROTEIN 1; COMPND 8 EC: 2.3.2.27; COMPND 9 ENGINEERED: YES; COMPND 10 MOL_ID: 2; COMPND 11 MOLECULE: 2F1 FAB HEAVY CHAIN; COMPND 12 CHAIN: E, G; COMPND 13 ENGINEERED: YES; COMPND 14 MOL_ID: 3; COMPND 15 MOLECULE: 2F1 FAB LIGHT CHAIN; COMPND 16 CHAIN: F, H; COMPND 17 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: STUB1, CHIP, PP1131; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 MOL_ID: 2; SOURCE 9 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 10 ORGANISM_TAXID: 9606; SOURCE 11 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 12 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 13 MOL_ID: 3; SOURCE 14 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 15 ORGANISM_TAXID: 9606; SOURCE 16 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 17 EXPRESSION_SYSTEM_TAXID: 469008 KEYWDS E3 UBIQUITIN LIGASE, FAB, EPITOPE, UBIQUITINATION INHIBITION, LIGASE, KEYWDS 2 LIGASE-IMMUNE SYSTEM COMPLEX EXPDTA ELECTRON MICROSCOPY AUTHOR A.UNNIKRISHNAN,D.SOUTHWORTH REVDAT 1 12-MAR-25 9DRY 0 JRNL AUTH D.H.CHUNG,E.J.CONNELLY,A.UNNIKRISHNAN,S.W.CHUO,K.WUCHERER, JRNL AUTH 2 C.M.NADEL,J.E.GESTWICKI,D.R.SOUTHWORTH,C.S.CRAIK JRNL TITL RECOMBINANT ANTIBODIES INHIBIT ENZYMATIC ACTIVITY OF THE E3 JRNL TITL 2 UBIQUITIN LIGASE CHIP VIA MULTIPLE MECHANISMS. JRNL REF J.BIOL.CHEM. V. 301 08220 2025 JRNL REFN ESSN 1083-351X JRNL PMID 39863102 JRNL DOI 10.1016/J.JBC.2025.108220 REMARK 2 REMARK 2 RESOLUTION. 7.02 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 SOFTWARE PACKAGES : NULL REMARK 3 RECONSTRUCTION SCHEMA : NULL REMARK 3 REMARK 3 EM MAP-MODEL FITTING AND REFINEMENT REMARK 3 PDB ENTRY : NULL REMARK 3 REFINEMENT SPACE : NULL REMARK 3 REFINEMENT PROTOCOL : NULL REMARK 3 REFINEMENT TARGET : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE : NULL REMARK 3 REMARK 3 FITTING PROCEDURE : NULL REMARK 3 REMARK 3 EM IMAGE RECONSTRUCTION STATISTICS REMARK 3 NOMINAL PIXEL SIZE (ANGSTROMS) : NULL REMARK 3 ACTUAL PIXEL SIZE (ANGSTROMS) : NULL REMARK 3 EFFECTIVE RESOLUTION (ANGSTROMS) : 7.020 REMARK 3 NUMBER OF PARTICLES : 16310 REMARK 3 CTF CORRECTION METHOD : PHASE FLIPPING AND AMPLITUDE REMARK 3 CORRECTION REMARK 3 REMARK 3 EM RECONSTRUCTION MAGNIFICATION CALIBRATION: NULL REMARK 3 REMARK 3 OTHER DETAILS: NULL REMARK 4 REMARK 4 9DRY COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 08-OCT-24. REMARK 100 THE DEPOSITION ID IS D_1000288588. REMARK 245 REMARK 245 EXPERIMENTAL DETAILS REMARK 245 RECONSTRUCTION METHOD : SINGLE PARTICLE REMARK 245 SPECIMEN TYPE : NULL REMARK 245 REMARK 245 ELECTRON MICROSCOPE SAMPLE REMARK 245 SAMPLE TYPE : PARTICLE REMARK 245 PARTICLE TYPE : POINT REMARK 245 NAME OF SAMPLE : CHIP U-BOX DIMER BOUND TO FAB REMARK 245 2F1 REMARK 245 SAMPLE CONCENTRATION (MG ML-1) : NULL REMARK 245 SAMPLE SUPPORT DETAILS : NULL REMARK 245 SAMPLE VITRIFICATION DETAILS : WAIT TIME 10 SEC, BLOT TIME 3 REMARK 245 SEC, BLOT FORCE 0, GRAPHENE REMARK 245 OXIDE COATED GRIDS REMARK 245 SAMPLE BUFFER : NULL REMARK 245 PH : 7.00 REMARK 245 SAMPLE DETAILS : NULL REMARK 245 REMARK 245 DATA ACQUISITION REMARK 245 DATE OF EXPERIMENT : NULL REMARK 245 NUMBER OF MICROGRAPHS-IMAGES : NULL REMARK 245 TEMPERATURE (KELVIN) : NULL REMARK 245 MICROSCOPE MODEL : TFS KRIOS REMARK 245 DETECTOR TYPE : GATAN K3 (6K X 4K) REMARK 245 MINIMUM DEFOCUS (NM) : 800.00 REMARK 245 MAXIMUM DEFOCUS (NM) : 1800.00 REMARK 245 MINIMUM TILT ANGLE (DEGREES) : NULL REMARK 245 MAXIMUM TILT ANGLE (DEGREES) : NULL REMARK 245 NOMINAL CS : NULL REMARK 245 IMAGING MODE : BRIGHT FIELD REMARK 245 ELECTRON DOSE (ELECTRONS NM**-2) : 6600.00 REMARK 245 ILLUMINATION MODE : FLOOD BEAM REMARK 245 NOMINAL MAGNIFICATION : NULL REMARK 245 CALIBRATED MAGNIFICATION : NULL REMARK 245 SOURCE : FIELD EMISSION GUN REMARK 245 ACCELERATION VOLTAGE (KV) : 300 REMARK 245 IMAGING DETAILS : NULL REMARK 247 REMARK 247 ELECTRON MICROSCOPY REMARK 247 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM ELECTRON REMARK 247 MICROSCOPY DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE REMARK 247 THAT CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES REMARK 247 ON THESE RECORDS ARE MEANINGLESS EXCEPT FOR THE CALCULATION REMARK 247 OF THE STRUCTURE FACTORS. REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: HEXAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: HEXAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, E, F, B, G, H REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 ASP A 226 CB CG OD1 OD2 REMARK 470 ILE A 227 CB CG1 CG2 CD1 REMARK 470 PRO A 228 CB CG CD REMARK 470 ASP A 229 CB CG OD1 OD2 REMARK 470 TYR A 230 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR A 230 OH REMARK 470 LEU A 231 CB CG CD1 CD2 REMARK 470 CYS A 232 CB SG REMARK 470 LYS A 234 CB CG CD CE NZ REMARK 470 ILE A 235 CB CG1 CG2 CD1 REMARK 470 SER A 236 CB OG REMARK 470 PHE A 237 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 GLU A 238 CB CG CD OE1 OE2 REMARK 470 LEU A 239 CB CG CD1 CD2 REMARK 470 MET A 240 CB CG SD CE REMARK 470 ARG A 241 CB CG CD NE CZ NH1 NH2 REMARK 470 GLU A 242 CB CG CD OE1 OE2 REMARK 470 PRO A 243 CB CG CD REMARK 470 CYS A 244 CB SG REMARK 470 ILE A 245 CB CG1 CG2 CD1 REMARK 470 THR A 246 CB OG1 CG2 REMARK 470 PRO A 247 CB CG CD REMARK 470 SER A 248 CB OG REMARK 470 ILE A 250 CB CG1 CG2 CD1 REMARK 470 THR A 251 CB OG1 CG2 REMARK 470 TYR A 252 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR A 252 OH REMARK 470 ASP A 253 CB CG OD1 OD2 REMARK 470 ARG A 254 CB CG CD NE CZ NH1 NH2 REMARK 470 LYS A 255 CB CG CD CE NZ REMARK 470 ASP A 256 CB CG OD1 OD2 REMARK 470 ILE A 257 CB CG1 CG2 CD1 REMARK 470 GLU A 258 CB CG CD OE1 OE2 REMARK 470 GLU A 259 CB CG CD OE1 OE2 REMARK 470 HIS A 260 CB CG ND1 CD2 CE1 NE2 REMARK 470 LEU A 261 CB CG CD1 CD2 REMARK 470 GLN A 262 CB CG CD OE1 NE2 REMARK 470 ARG A 263 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL A 264 CB CG1 CG2 REMARK 470 HIS A 266 CB CG ND1 CD2 CE1 NE2 REMARK 470 PHE A 267 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 ASP A 268 CB CG OD1 OD2 REMARK 470 PRO A 269 CB CG CD REMARK 470 VAL A 270 CB CG1 CG2 REMARK 470 THR A 271 CB OG1 CG2 REMARK 470 ARG A 272 CB CG CD NE CZ NH1 NH2 REMARK 470 SER A 273 CB OG REMARK 470 PRO A 274 CB CG CD REMARK 470 LEU A 275 CB CG CD1 CD2 REMARK 470 THR A 276 CB OG1 CG2 REMARK 470 GLN A 277 CB CG CD OE1 NE2 REMARK 470 GLU A 278 CB CG CD OE1 OE2 REMARK 470 GLN A 279 CB CG CD OE1 NE2 REMARK 470 LEU A 280 CB CG CD1 CD2 REMARK 470 ILE A 281 CB CG1 CG2 CD1 REMARK 470 PRO A 282 CB CG CD REMARK 470 ASN A 283 CB CG OD1 ND2 REMARK 470 LEU A 284 CB CG CD1 CD2 REMARK 470 ALA A 285 CB REMARK 470 MET A 286 CB CG SD CE REMARK 470 LYS A 287 CB CG CD CE NZ REMARK 470 GLU A 288 CB CG CD OE1 OE2 REMARK 470 VAL A 289 CB CG1 CG2 REMARK 470 ILE A 290 CB CG1 CG2 CD1 REMARK 470 ASP A 291 CB CG OD1 OD2 REMARK 470 ALA A 292 CB REMARK 470 PHE A 293 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 ILE A 294 CB CG1 CG2 CD1 REMARK 470 SER A 295 CB OG REMARK 470 GLU A 296 CB CG CD OE1 OE2 REMARK 470 ASN A 297 CB CG OD1 ND2 REMARK 470 TRP A 299 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP A 299 CZ2 CZ3 CH2 REMARK 470 VAL A 300 CB CG1 CG2 REMARK 470 GLN E 1 CB CG CD OE1 NE2 REMARK 470 VAL E 2 CB CG1 CG2 REMARK 470 GLN E 3 CB CG CD OE1 NE2 REMARK 470 LEU E 4 CB CG CD1 CD2 REMARK 470 GLN E 5 CB CG CD OE1 NE2 REMARK 470 GLN E 6 CB CG CD OE1 NE2 REMARK 470 TRP E 7 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP E 7 CZ2 CZ3 CH2 REMARK 470 ALA E 9 CB REMARK 470 LEU E 11 CB CG CD1 CD2 REMARK 470 LEU E 12 CB CG CD1 CD2 REMARK 470 LYS E 13 CB CG CD CE NZ REMARK 470 PRO E 14 CB CG CD REMARK 470 SER E 15 CB OG REMARK 470 GLU E 16 CB CG CD OE1 OE2 REMARK 470 THR E 17 CB OG1 CG2 REMARK 470 LEU E 18 CB CG CD1 CD2 REMARK 470 SER E 19 CB OG REMARK 470 LEU E 20 CB CG CD1 CD2 REMARK 470 THR E 21 CB OG1 CG2 REMARK 470 CYS E 22 CB SG REMARK 470 ALA E 23 CB REMARK 470 VAL E 24 CB CG1 CG2 REMARK 470 TYR E 25 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 25 OH REMARK 470 SER E 28 CB OG REMARK 470 PHE E 29 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 SER E 30 CB OG REMARK 470 TYR E 32 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 32 OH REMARK 470 TYR E 33 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 33 OH REMARK 470 TRP E 34 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP E 34 CZ2 CZ3 CH2 REMARK 470 SER E 35 CB OG REMARK 470 TRP E 36 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP E 36 CZ2 CZ3 CH2 REMARK 470 ILE E 37 CB CG1 CG2 CD1 REMARK 470 ARG E 38 CB CG CD NE CZ NH1 NH2 REMARK 470 GLN E 39 CB CG CD OE1 NE2 REMARK 470 PRO E 40 CB CG CD REMARK 470 PRO E 41 CB CG CD REMARK 470 LYS E 43 CB CG CD CE NZ REMARK 470 LEU E 45 CB CG CD1 CD2 REMARK 470 GLU E 46 CB CG CD OE1 OE2 REMARK 470 TRP E 47 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP E 47 CZ2 CZ3 CH2 REMARK 470 ILE E 48 CB CG1 CG2 CD1 REMARK 470 GLU E 50 CB CG CD OE1 OE2 REMARK 470 ILE E 51 CB CG1 CG2 CD1 REMARK 470 ASN E 52 CB CG OD1 ND2 REMARK 470 HIS E 53 CB CG ND1 CD2 CE1 NE2 REMARK 470 SER E 54 CB OG REMARK 470 SER E 56 CB OG REMARK 470 THR E 57 CB OG1 CG2 REMARK 470 ASN E 58 CB CG OD1 ND2 REMARK 470 TYR E 59 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 59 OH REMARK 470 ASN E 60 CB CG OD1 ND2 REMARK 470 PRO E 61 CB CG CD REMARK 470 SER E 62 CB OG REMARK 470 LEU E 63 CB CG CD1 CD2 REMARK 470 LYS E 64 CB CG CD CE NZ REMARK 470 SER E 65 CB OG REMARK 470 ARG E 66 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL E 67 CB CG1 CG2 REMARK 470 THR E 68 CB OG1 CG2 REMARK 470 ILE E 69 CB CG1 CG2 CD1 REMARK 470 SER E 70 CB OG REMARK 470 VAL E 71 CB CG1 CG2 REMARK 470 ASP E 72 CB CG OD1 OD2 REMARK 470 THR E 73 CB OG1 CG2 REMARK 470 SER E 74 CB OG REMARK 470 LYS E 75 CB CG CD CE NZ REMARK 470 ASN E 76 CB CG OD1 ND2 REMARK 470 GLN E 77 CB CG CD OE1 NE2 REMARK 470 PHE E 78 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 SER E 79 CB OG REMARK 470 LEU E 80 CB CG CD1 CD2 REMARK 470 LYS E 81 CB CG CD CE NZ REMARK 470 LEU E 82 CB CG CD1 CD2 REMARK 470 SER E 83 CB OG REMARK 470 SER E 84 CB OG REMARK 470 VAL E 85 CB CG1 CG2 REMARK 470 THR E 86 CB OG1 CG2 REMARK 470 ALA E 87 CB REMARK 470 ALA E 88 CB REMARK 470 ASP E 89 CB CG OD1 OD2 REMARK 470 THR E 90 CB OG1 CG2 REMARK 470 ALA E 91 CB REMARK 470 VAL E 92 CB CG1 CG2 REMARK 470 TYR E 93 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 93 OH REMARK 470 TYR E 94 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 94 OH REMARK 470 CYS E 95 CB SG REMARK 470 ALA E 96 CB REMARK 470 ARG E 97 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL E 100 CB CG1 CG2 REMARK 470 ARG E 102 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL E 103 CB CG1 CG2 REMARK 470 ARG E 104 CB CG CD NE CZ NH1 NH2 REMARK 470 ASP E 106 CB CG OD1 OD2 REMARK 470 SER E 107 CB OG REMARK 470 MET E 108 CB CG SD CE REMARK 470 ASP E 109 CB CG OD1 OD2 REMARK 470 VAL E 110 CB CG1 CG2 REMARK 470 TRP E 111 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP E 111 CZ2 CZ3 CH2 REMARK 470 GLN E 113 CB CG CD OE1 NE2 REMARK 470 THR E 115 CB OG1 CG2 REMARK 470 THR E 116 CB OG1 CG2 REMARK 470 VAL E 117 CB CG1 CG2 REMARK 470 THR E 118 CB OG1 CG2 REMARK 470 VAL E 119 CB CG1 CG2 REMARK 470 SER E 120 CB OG REMARK 470 SER E 121 CB OG REMARK 470 ALA E 122 CB REMARK 470 SER E 123 CB OG REMARK 470 THR E 124 CB OG1 CG2 REMARK 470 LYS E 125 CB CG CD CE NZ REMARK 470 PRO E 127 CB CG CD REMARK 470 SER E 128 CB OG REMARK 470 VAL E 129 CB CG1 CG2 REMARK 470 PHE E 130 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 PRO E 131 CB CG CD REMARK 470 LEU E 132 CB CG CD1 CD2 REMARK 470 ALA E 133 CB REMARK 470 PRO E 134 CB CG CD REMARK 470 SER E 135 CB OG REMARK 470 SER E 136 CB OG REMARK 470 LYS E 137 CB CG CD CE NZ REMARK 470 SER E 138 CB OG REMARK 470 THR E 139 CB OG1 CG2 REMARK 470 SER E 140 CB OG REMARK 470 THR E 143 CB OG1 CG2 REMARK 470 ALA E 144 CB REMARK 470 ALA E 145 CB REMARK 470 LEU E 146 CB CG CD1 CD2 REMARK 470 CYS E 148 CB SG REMARK 470 LEU E 149 CB CG CD1 CD2 REMARK 470 VAL E 150 CB CG1 CG2 REMARK 470 LYS E 151 CB CG CD CE NZ REMARK 470 ASP E 152 CB CG OD1 OD2 REMARK 470 TYR E 153 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 153 OH REMARK 470 PHE E 154 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 PRO E 155 CB CG CD REMARK 470 GLU E 156 CB CG CD OE1 OE2 REMARK 470 PRO E 157 CB CG CD REMARK 470 VAL E 158 CB CG1 CG2 REMARK 470 THR E 159 CB OG1 CG2 REMARK 470 VAL E 160 CB CG1 CG2 REMARK 470 SER E 161 CB OG REMARK 470 TRP E 162 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP E 162 CZ2 CZ3 CH2 REMARK 470 ASN E 163 CB CG OD1 ND2 REMARK 470 SER E 164 CB OG REMARK 470 ALA E 166 CB REMARK 470 LEU E 167 CB CG CD1 CD2 REMARK 470 THR E 168 CB OG1 CG2 REMARK 470 SER E 169 CB OG REMARK 470 VAL E 171 CB CG1 CG2 REMARK 470 HIS E 172 CB CG ND1 CD2 CE1 NE2 REMARK 470 THR E 173 CB OG1 CG2 REMARK 470 PHE E 174 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 PRO E 175 CB CG CD REMARK 470 ALA E 176 CB REMARK 470 VAL E 177 CB CG1 CG2 REMARK 470 LEU E 178 CB CG CD1 CD2 REMARK 470 GLN E 179 CB CG CD OE1 NE2 REMARK 470 SER E 180 CB OG REMARK 470 SER E 181 CB OG REMARK 470 LEU E 183 CB CG CD1 CD2 REMARK 470 TYR E 184 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 184 OH REMARK 470 SER E 185 CB OG REMARK 470 LEU E 186 CB CG CD1 CD2 REMARK 470 SER E 187 CB OG REMARK 470 SER E 188 CB OG REMARK 470 VAL E 189 CB CG1 CG2 REMARK 470 VAL E 190 CB CG1 CG2 REMARK 470 THR E 191 CB OG1 CG2 REMARK 470 VAL E 192 CB CG1 CG2 REMARK 470 PRO E 193 CB CG CD REMARK 470 SER E 194 CB OG REMARK 470 SER E 195 CB OG REMARK 470 SER E 196 CB OG REMARK 470 LEU E 197 CB CG CD1 CD2 REMARK 470 THR E 199 CB OG1 CG2 REMARK 470 GLN E 200 CB CG CD OE1 NE2 REMARK 470 THR E 201 CB OG1 CG2 REMARK 470 TYR E 202 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR E 202 OH REMARK 470 ILE E 203 CB CG1 CG2 CD1 REMARK 470 CYS E 204 CB SG REMARK 470 ASN E 205 CB CG OD1 ND2 REMARK 470 VAL E 206 CB CG1 CG2 REMARK 470 ASN E 207 CB CG OD1 ND2 REMARK 470 HIS E 208 CB CG ND1 CD2 CE1 NE2 REMARK 470 LYS E 209 CB CG CD CE NZ REMARK 470 PRO E 210 CB CG CD REMARK 470 SER E 211 CB OG REMARK 470 ASN E 212 CB CG OD1 ND2 REMARK 470 THR E 213 CB OG1 CG2 REMARK 470 LYS E 214 CB CG CD CE NZ REMARK 470 VAL E 215 CB CG1 CG2 REMARK 470 ASP E 216 CB CG OD1 OD2 REMARK 470 LYS E 217 CB CG CD CE NZ REMARK 470 LYS E 218 CB CG CD CE NZ REMARK 470 VAL E 219 CB CG1 CG2 REMARK 470 GLU E 220 CB CG CD OE1 OE2 REMARK 470 PRO E 221 CB CG CD REMARK 470 LYS E 222 CB CG CD CE NZ REMARK 470 PRO F 2 CB CG CD REMARK 470 VAL F 3 CB CG1 CG2 REMARK 470 LEU F 4 CB CG CD1 CD2 REMARK 470 THR F 5 CB OG1 CG2 REMARK 470 GLN F 6 CB CG CD OE1 NE2 REMARK 470 PRO F 7 CB CG CD REMARK 470 PRO F 8 CB CG CD REMARK 470 SER F 9 CB OG REMARK 470 VAL F 10 CB CG1 CG2 REMARK 470 SER F 11 CB OG REMARK 470 LYS F 12 CB CG CD CE NZ REMARK 470 ALA F 13 CB REMARK 470 LEU F 14 CB CG CD1 CD2 REMARK 470 ARG F 15 CB CG CD NE CZ NH1 NH2 REMARK 470 GLN F 16 CB CG CD OE1 NE2 REMARK 470 THR F 17 CB OG1 CG2 REMARK 470 ALA F 18 CB REMARK 470 THR F 19 CB OG1 CG2 REMARK 470 LEU F 20 CB CG CD1 CD2 REMARK 470 THR F 21 CB OG1 CG2 REMARK 470 CYS F 22 CB SG REMARK 470 THR F 23 CB OG1 CG2 REMARK 470 ASP F 25 CB CG OD1 OD2 REMARK 470 SER F 26 CB OG REMARK 470 ASN F 27 CB CG OD1 ND2 REMARK 470 ASN F 28 CB CG OD1 ND2 REMARK 470 VAL F 29 CB CG1 CG2 REMARK 470 ASN F 31 CB CG OD1 ND2 REMARK 470 ARG F 32 CB CG CD NE CZ NH1 NH2 REMARK 470 ALA F 34 CB REMARK 470 ALA F 35 CB REMARK 470 TRP F 36 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP F 36 CZ2 CZ3 CH2 REMARK 470 PHE F 37 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 LEU F 38 CB CG CD1 CD2 REMARK 470 LEU F 39 CB CG CD1 CD2 REMARK 470 HIS F 40 CB CG ND1 CD2 CE1 NE2 REMARK 470 GLN F 41 CB CG CD OE1 NE2 REMARK 470 HIS F 43 CB CG ND1 CD2 CE1 NE2 REMARK 470 PRO F 44 CB CG CD REMARK 470 PRO F 45 CB CG CD REMARK 470 LYS F 46 CB CG CD CE NZ REMARK 470 LEU F 47 CB CG CD1 CD2 REMARK 470 LEU F 48 CB CG CD1 CD2 REMARK 470 ALA F 49 CB REMARK 470 TYR F 50 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR F 50 OH REMARK 470 ARG F 51 CB CG CD NE CZ NH1 NH2 REMARK 470 ASN F 52 CB CG OD1 ND2 REMARK 470 ASN F 53 CB CG OD1 ND2 REMARK 470 ASP F 54 CB CG OD1 OD2 REMARK 470 ARG F 55 CB CG CD NE CZ NH1 NH2 REMARK 470 PRO F 56 CB CG CD REMARK 470 SER F 57 CB OG REMARK 470 ILE F 59 CB CG1 CG2 CD1 REMARK 470 SER F 60 CB OG REMARK 470 GLU F 61 CB CG CD OE1 OE2 REMARK 470 ARG F 62 CB CG CD NE CZ NH1 NH2 REMARK 470 LEU F 63 CB CG CD1 CD2 REMARK 470 SER F 64 CB OG REMARK 470 ALA F 65 CB REMARK 470 SER F 66 CB OG REMARK 470 ARG F 67 CB CG CD NE CZ NH1 NH2 REMARK 470 SER F 68 CB OG REMARK 470 ASN F 70 CB CG OD1 ND2 REMARK 470 THR F 71 CB OG1 CG2 REMARK 470 ALA F 72 CB REMARK 470 SER F 73 CB OG REMARK 470 LEU F 74 CB CG CD1 CD2 REMARK 470 THR F 75 CB OG1 CG2 REMARK 470 ILE F 76 CB CG1 CG2 CD1 REMARK 470 THR F 77 CB OG1 CG2 REMARK 470 LEU F 79 CB CG CD1 CD2 REMARK 470 GLN F 80 CB CG CD OE1 NE2 REMARK 470 PRO F 81 CB CG CD REMARK 470 GLU F 82 CB CG CD OE1 OE2 REMARK 470 ASP F 83 CB CG OD1 OD2 REMARK 470 GLU F 84 CB CG CD OE1 OE2 REMARK 470 ALA F 85 CB REMARK 470 ASP F 86 CB CG OD1 OD2 REMARK 470 TYR F 87 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR F 87 OH REMARK 470 TYR F 88 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR F 88 OH REMARK 470 CYS F 89 CB SG REMARK 470 SER F 90 CB OG REMARK 470 ALA F 91 CB REMARK 470 TRP F 92 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP F 92 CZ2 CZ3 CH2 REMARK 470 ASP F 93 CB CG OD1 OD2 REMARK 470 SER F 94 CB OG REMARK 470 SER F 95 CB OG REMARK 470 LEU F 96 CB CG CD1 CD2 REMARK 470 ARG F 97 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL F 98 CB CG1 CG2 REMARK 470 GLN F 99 CB CG CD OE1 NE2 REMARK 470 VAL F 100 CB CG1 CG2 REMARK 470 PHE F 101 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 THR F 105 CB OG1 CG2 REMARK 470 LYS F 106 CB CG CD CE NZ REMARK 470 LEU F 107 CB CG CD1 CD2 REMARK 470 THR F 108 CB OG1 CG2 REMARK 470 VAL F 109 CB CG1 CG2 REMARK 470 LEU F 110 CB CG CD1 CD2 REMARK 470 GLN F 112 CB CG CD OE1 NE2 REMARK 470 PRO F 113 CB CG CD REMARK 470 LYS F 114 CB CG CD CE NZ REMARK 470 ALA F 115 CB REMARK 470 ALA F 116 CB REMARK 470 PRO F 117 CB CG CD REMARK 470 SER F 118 CB OG REMARK 470 VAL F 119 CB CG1 CG2 REMARK 470 THR F 120 CB OG1 CG2 REMARK 470 LEU F 121 CB CG CD1 CD2 REMARK 470 PHE F 122 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 PRO F 123 CB CG CD REMARK 470 PRO F 124 CB CG CD REMARK 470 SER F 125 CB OG REMARK 470 SER F 126 CB OG REMARK 470 GLU F 127 CB CG CD OE1 OE2 REMARK 470 GLU F 128 CB CG CD OE1 OE2 REMARK 470 LEU F 129 CB CG CD1 CD2 REMARK 470 GLN F 130 CB CG CD OE1 NE2 REMARK 470 ALA F 131 CB REMARK 470 ASN F 132 CB CG OD1 ND2 REMARK 470 LYS F 133 CB CG CD CE NZ REMARK 470 ALA F 134 CB REMARK 470 THR F 135 CB OG1 CG2 REMARK 470 LEU F 136 CB CG CD1 CD2 REMARK 470 VAL F 137 CB CG1 CG2 REMARK 470 CYS F 138 CB SG REMARK 470 LEU F 139 CB CG CD1 CD2 REMARK 470 ILE F 140 CB CG1 CG2 CD1 REMARK 470 SER F 141 CB OG REMARK 470 ASP F 142 CB CG OD1 OD2 REMARK 470 PHE F 143 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR F 144 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR F 144 OH REMARK 470 PRO F 145 CB CG CD REMARK 470 ALA F 147 CB REMARK 470 VAL F 148 CB CG1 CG2 REMARK 470 THR F 149 CB OG1 CG2 REMARK 470 VAL F 150 CB CG1 CG2 REMARK 470 ALA F 151 CB REMARK 470 TRP F 152 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP F 152 CZ2 CZ3 CH2 REMARK 470 LYS F 153 CB CG CD CE NZ REMARK 470 ALA F 154 CB REMARK 470 ASP F 155 CB CG OD1 OD2 REMARK 470 SER F 156 CB OG REMARK 470 SER F 157 CB OG REMARK 470 PRO F 158 CB CG CD REMARK 470 VAL F 159 CB CG1 CG2 REMARK 470 LYS F 160 CB CG CD CE NZ REMARK 470 ALA F 161 CB REMARK 470 VAL F 163 CB CG1 CG2 REMARK 470 GLU F 164 CB CG CD OE1 OE2 REMARK 470 THR F 165 CB OG1 CG2 REMARK 470 THR F 166 CB OG1 CG2 REMARK 470 THR F 167 CB OG1 CG2 REMARK 470 PRO F 168 CB CG CD REMARK 470 SER F 169 CB OG REMARK 470 LYS F 170 CB CG CD CE NZ REMARK 470 GLN F 171 CB CG CD OE1 NE2 REMARK 470 SER F 172 CB OG REMARK 470 ASN F 173 CB CG OD1 ND2 REMARK 470 ASN F 174 CB CG OD1 ND2 REMARK 470 LYS F 175 CB CG CD CE NZ REMARK 470 TYR F 176 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR F 176 OH REMARK 470 ALA F 177 CB REMARK 470 ALA F 178 CB REMARK 470 SER F 179 CB OG REMARK 470 SER F 180 CB OG REMARK 470 TYR F 181 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR F 181 OH REMARK 470 LEU F 182 CB CG CD1 CD2 REMARK 470 SER F 183 CB OG REMARK 470 LEU F 184 CB CG CD1 CD2 REMARK 470 THR F 185 CB OG1 CG2 REMARK 470 PRO F 186 CB CG CD REMARK 470 GLU F 187 CB CG CD OE1 OE2 REMARK 470 GLN F 188 CB CG CD OE1 NE2 REMARK 470 TRP F 189 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP F 189 CZ2 CZ3 CH2 REMARK 470 LYS F 190 CB CG CD CE NZ REMARK 470 SER F 191 CB OG REMARK 470 HIS F 192 CB CG ND1 CD2 CE1 NE2 REMARK 470 LYS F 193 CB CG CD CE NZ REMARK 470 SER F 194 CB OG REMARK 470 TYR F 195 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR F 195 OH REMARK 470 SER F 196 CB OG REMARK 470 CYS F 197 CB SG REMARK 470 GLN F 198 CB CG CD OE1 NE2 REMARK 470 VAL F 199 CB CG1 CG2 REMARK 470 THR F 200 CB OG1 CG2 REMARK 470 HIS F 201 CB CG ND1 CD2 CE1 NE2 REMARK 470 GLU F 202 CB CG CD OE1 OE2 REMARK 470 SER F 204 CB OG REMARK 470 THR F 205 CB OG1 CG2 REMARK 470 VAL F 206 CB CG1 CG2 REMARK 470 GLU F 207 CB CG CD OE1 OE2 REMARK 470 LYS F 208 CB CG CD CE NZ REMARK 470 THR F 209 CB OG1 CG2 REMARK 470 VAL F 210 CB CG1 CG2 REMARK 470 ALA F 211 CB REMARK 470 PRO F 212 CB CG CD REMARK 470 THR F 213 CB OG1 CG2 REMARK 470 GLU F 214 CB CG CD OE1 OE2 REMARK 470 CYS F 215 CB SG REMARK 470 SER F 216 CB OG REMARK 470 ASP B 226 CB CG OD1 OD2 REMARK 470 ILE B 227 CB CG1 CG2 CD1 REMARK 470 PRO B 228 CB CG CD REMARK 470 ASP B 229 CB CG OD1 OD2 REMARK 470 TYR B 230 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR B 230 OH REMARK 470 LEU B 231 CB CG CD1 CD2 REMARK 470 CYS B 232 CB SG REMARK 470 LYS B 234 CB CG CD CE NZ REMARK 470 ILE B 235 CB CG1 CG2 CD1 REMARK 470 SER B 236 CB OG REMARK 470 PHE B 237 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 GLU B 238 CB CG CD OE1 OE2 REMARK 470 LEU B 239 CB CG CD1 CD2 REMARK 470 MET B 240 CB CG SD CE REMARK 470 ARG B 241 CB CG CD NE CZ NH1 NH2 REMARK 470 GLU B 242 CB CG CD OE1 OE2 REMARK 470 PRO B 243 CB CG CD REMARK 470 CYS B 244 CB SG REMARK 470 ILE B 245 CB CG1 CG2 CD1 REMARK 470 THR B 246 CB OG1 CG2 REMARK 470 PRO B 247 CB CG CD REMARK 470 SER B 248 CB OG REMARK 470 ILE B 250 CB CG1 CG2 CD1 REMARK 470 THR B 251 CB OG1 CG2 REMARK 470 TYR B 252 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR B 252 OH REMARK 470 ASP B 253 CB CG OD1 OD2 REMARK 470 ARG B 254 CB CG CD NE CZ NH1 NH2 REMARK 470 LYS B 255 CB CG CD CE NZ REMARK 470 ASP B 256 CB CG OD1 OD2 REMARK 470 ILE B 257 CB CG1 CG2 CD1 REMARK 470 GLU B 258 CB CG CD OE1 OE2 REMARK 470 GLU B 259 CB CG CD OE1 OE2 REMARK 470 HIS B 260 CB CG ND1 CD2 CE1 NE2 REMARK 470 LEU B 261 CB CG CD1 CD2 REMARK 470 GLN B 262 CB CG CD OE1 NE2 REMARK 470 ARG B 263 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL B 264 CB CG1 CG2 REMARK 470 HIS B 266 CB CG ND1 CD2 CE1 NE2 REMARK 470 PHE B 267 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 ASP B 268 CB CG OD1 OD2 REMARK 470 PRO B 269 CB CG CD REMARK 470 VAL B 270 CB CG1 CG2 REMARK 470 THR B 271 CB OG1 CG2 REMARK 470 ARG B 272 CB CG CD NE CZ NH1 NH2 REMARK 470 SER B 273 CB OG REMARK 470 PRO B 274 CB CG CD REMARK 470 LEU B 275 CB CG CD1 CD2 REMARK 470 THR B 276 CB OG1 CG2 REMARK 470 GLN B 277 CB CG CD OE1 NE2 REMARK 470 GLU B 278 CB CG CD OE1 OE2 REMARK 470 GLN B 279 CB CG CD OE1 NE2 REMARK 470 LEU B 280 CB CG CD1 CD2 REMARK 470 ILE B 281 CB CG1 CG2 CD1 REMARK 470 PRO B 282 CB CG CD REMARK 470 ASN B 283 CB CG OD1 ND2 REMARK 470 LEU B 284 CB CG CD1 CD2 REMARK 470 ALA B 285 CB REMARK 470 MET B 286 CB CG SD CE REMARK 470 LYS B 287 CB CG CD CE NZ REMARK 470 GLU B 288 CB CG CD OE1 OE2 REMARK 470 VAL B 289 CB CG1 CG2 REMARK 470 ILE B 290 CB CG1 CG2 CD1 REMARK 470 ASP B 291 CB CG OD1 OD2 REMARK 470 ALA B 292 CB REMARK 470 PHE B 293 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 ILE B 294 CB CG1 CG2 CD1 REMARK 470 SER B 295 CB OG REMARK 470 GLU B 296 CB CG CD OE1 OE2 REMARK 470 ASN B 297 CB CG OD1 ND2 REMARK 470 TRP B 299 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP B 299 CZ2 CZ3 CH2 REMARK 470 VAL B 300 CB CG1 CG2 REMARK 470 GLN G 1 CB CG CD OE1 NE2 REMARK 470 VAL G 2 CB CG1 CG2 REMARK 470 GLN G 3 CB CG CD OE1 NE2 REMARK 470 LEU G 4 CB CG CD1 CD2 REMARK 470 GLN G 5 CB CG CD OE1 NE2 REMARK 470 GLN G 6 CB CG CD OE1 NE2 REMARK 470 TRP G 7 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP G 7 CZ2 CZ3 CH2 REMARK 470 ALA G 9 CB REMARK 470 LEU G 11 CB CG CD1 CD2 REMARK 470 LEU G 12 CB CG CD1 CD2 REMARK 470 LYS G 13 CB CG CD CE NZ REMARK 470 PRO G 14 CB CG CD REMARK 470 SER G 15 CB OG REMARK 470 GLU G 16 CB CG CD OE1 OE2 REMARK 470 THR G 17 CB OG1 CG2 REMARK 470 LEU G 18 CB CG CD1 CD2 REMARK 470 SER G 19 CB OG REMARK 470 LEU G 20 CB CG CD1 CD2 REMARK 470 THR G 21 CB OG1 CG2 REMARK 470 CYS G 22 CB SG REMARK 470 ALA G 23 CB REMARK 470 VAL G 24 CB CG1 CG2 REMARK 470 TYR G 25 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 25 OH REMARK 470 SER G 28 CB OG REMARK 470 PHE G 29 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 SER G 30 CB OG REMARK 470 TYR G 32 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 32 OH REMARK 470 TYR G 33 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 33 OH REMARK 470 TRP G 34 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP G 34 CZ2 CZ3 CH2 REMARK 470 SER G 35 CB OG REMARK 470 TRP G 36 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP G 36 CZ2 CZ3 CH2 REMARK 470 ILE G 37 CB CG1 CG2 CD1 REMARK 470 ARG G 38 CB CG CD NE CZ NH1 NH2 REMARK 470 GLN G 39 CB CG CD OE1 NE2 REMARK 470 PRO G 40 CB CG CD REMARK 470 PRO G 41 CB CG CD REMARK 470 LYS G 43 CB CG CD CE NZ REMARK 470 LEU G 45 CB CG CD1 CD2 REMARK 470 GLU G 46 CB CG CD OE1 OE2 REMARK 470 TRP G 47 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP G 47 CZ2 CZ3 CH2 REMARK 470 ILE G 48 CB CG1 CG2 CD1 REMARK 470 GLU G 50 CB CG CD OE1 OE2 REMARK 470 ILE G 51 CB CG1 CG2 CD1 REMARK 470 ASN G 52 CB CG OD1 ND2 REMARK 470 HIS G 53 CB CG ND1 CD2 CE1 NE2 REMARK 470 SER G 54 CB OG REMARK 470 SER G 56 CB OG REMARK 470 THR G 57 CB OG1 CG2 REMARK 470 ASN G 58 CB CG OD1 ND2 REMARK 470 TYR G 59 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 59 OH REMARK 470 ASN G 60 CB CG OD1 ND2 REMARK 470 PRO G 61 CB CG CD REMARK 470 SER G 62 CB OG REMARK 470 LEU G 63 CB CG CD1 CD2 REMARK 470 LYS G 64 CB CG CD CE NZ REMARK 470 SER G 65 CB OG REMARK 470 ARG G 66 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL G 67 CB CG1 CG2 REMARK 470 THR G 68 CB OG1 CG2 REMARK 470 ILE G 69 CB CG1 CG2 CD1 REMARK 470 SER G 70 CB OG REMARK 470 VAL G 71 CB CG1 CG2 REMARK 470 ASP G 72 CB CG OD1 OD2 REMARK 470 THR G 73 CB OG1 CG2 REMARK 470 SER G 74 CB OG REMARK 470 LYS G 75 CB CG CD CE NZ REMARK 470 ASN G 76 CB CG OD1 ND2 REMARK 470 GLN G 77 CB CG CD OE1 NE2 REMARK 470 PHE G 78 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 SER G 79 CB OG REMARK 470 LEU G 80 CB CG CD1 CD2 REMARK 470 LYS G 81 CB CG CD CE NZ REMARK 470 LEU G 82 CB CG CD1 CD2 REMARK 470 SER G 83 CB OG REMARK 470 SER G 84 CB OG REMARK 470 VAL G 85 CB CG1 CG2 REMARK 470 THR G 86 CB OG1 CG2 REMARK 470 ALA G 87 CB REMARK 470 ALA G 88 CB REMARK 470 ASP G 89 CB CG OD1 OD2 REMARK 470 THR G 90 CB OG1 CG2 REMARK 470 ALA G 91 CB REMARK 470 VAL G 92 CB CG1 CG2 REMARK 470 TYR G 93 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 93 OH REMARK 470 TYR G 94 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 94 OH REMARK 470 CYS G 95 CB SG REMARK 470 ALA G 96 CB REMARK 470 ARG G 97 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL G 100 CB CG1 CG2 REMARK 470 ARG G 102 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL G 103 CB CG1 CG2 REMARK 470 ARG G 104 CB CG CD NE CZ NH1 NH2 REMARK 470 ASP G 106 CB CG OD1 OD2 REMARK 470 SER G 107 CB OG REMARK 470 MET G 108 CB CG SD CE REMARK 470 ASP G 109 CB CG OD1 OD2 REMARK 470 VAL G 110 CB CG1 CG2 REMARK 470 TRP G 111 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP G 111 CZ2 CZ3 CH2 REMARK 470 GLN G 113 CB CG CD OE1 NE2 REMARK 470 THR G 115 CB OG1 CG2 REMARK 470 THR G 116 CB OG1 CG2 REMARK 470 VAL G 117 CB CG1 CG2 REMARK 470 THR G 118 CB OG1 CG2 REMARK 470 VAL G 119 CB CG1 CG2 REMARK 470 SER G 120 CB OG REMARK 470 SER G 121 CB OG REMARK 470 ALA G 122 CB REMARK 470 SER G 123 CB OG REMARK 470 THR G 124 CB OG1 CG2 REMARK 470 LYS G 125 CB CG CD CE NZ REMARK 470 PRO G 127 CB CG CD REMARK 470 SER G 128 CB OG REMARK 470 VAL G 129 CB CG1 CG2 REMARK 470 PHE G 130 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 PRO G 131 CB CG CD REMARK 470 LEU G 132 CB CG CD1 CD2 REMARK 470 ALA G 133 CB REMARK 470 PRO G 134 CB CG CD REMARK 470 SER G 135 CB OG REMARK 470 SER G 136 CB OG REMARK 470 LYS G 137 CB CG CD CE NZ REMARK 470 SER G 138 CB OG REMARK 470 THR G 139 CB OG1 CG2 REMARK 470 SER G 140 CB OG REMARK 470 THR G 143 CB OG1 CG2 REMARK 470 ALA G 144 CB REMARK 470 ALA G 145 CB REMARK 470 LEU G 146 CB CG CD1 CD2 REMARK 470 CYS G 148 CB SG REMARK 470 LEU G 149 CB CG CD1 CD2 REMARK 470 VAL G 150 CB CG1 CG2 REMARK 470 LYS G 151 CB CG CD CE NZ REMARK 470 ASP G 152 CB CG OD1 OD2 REMARK 470 TYR G 153 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 153 OH REMARK 470 PHE G 154 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 PRO G 155 CB CG CD REMARK 470 GLU G 156 CB CG CD OE1 OE2 REMARK 470 PRO G 157 CB CG CD REMARK 470 VAL G 158 CB CG1 CG2 REMARK 470 THR G 159 CB OG1 CG2 REMARK 470 VAL G 160 CB CG1 CG2 REMARK 470 SER G 161 CB OG REMARK 470 TRP G 162 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP G 162 CZ2 CZ3 CH2 REMARK 470 ASN G 163 CB CG OD1 ND2 REMARK 470 SER G 164 CB OG REMARK 470 ALA G 166 CB REMARK 470 LEU G 167 CB CG CD1 CD2 REMARK 470 THR G 168 CB OG1 CG2 REMARK 470 SER G 169 CB OG REMARK 470 VAL G 171 CB CG1 CG2 REMARK 470 HIS G 172 CB CG ND1 CD2 CE1 NE2 REMARK 470 THR G 173 CB OG1 CG2 REMARK 470 PHE G 174 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 PRO G 175 CB CG CD REMARK 470 ALA G 176 CB REMARK 470 VAL G 177 CB CG1 CG2 REMARK 470 LEU G 178 CB CG CD1 CD2 REMARK 470 GLN G 179 CB CG CD OE1 NE2 REMARK 470 SER G 180 CB OG REMARK 470 SER G 181 CB OG REMARK 470 LEU G 183 CB CG CD1 CD2 REMARK 470 TYR G 184 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 184 OH REMARK 470 SER G 185 CB OG REMARK 470 LEU G 186 CB CG CD1 CD2 REMARK 470 SER G 187 CB OG REMARK 470 SER G 188 CB OG REMARK 470 VAL G 189 CB CG1 CG2 REMARK 470 VAL G 190 CB CG1 CG2 REMARK 470 THR G 191 CB OG1 CG2 REMARK 470 VAL G 192 CB CG1 CG2 REMARK 470 PRO G 193 CB CG CD REMARK 470 SER G 194 CB OG REMARK 470 SER G 195 CB OG REMARK 470 SER G 196 CB OG REMARK 470 LEU G 197 CB CG CD1 CD2 REMARK 470 THR G 199 CB OG1 CG2 REMARK 470 GLN G 200 CB CG CD OE1 NE2 REMARK 470 THR G 201 CB OG1 CG2 REMARK 470 TYR G 202 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR G 202 OH REMARK 470 ILE G 203 CB CG1 CG2 CD1 REMARK 470 CYS G 204 CB SG REMARK 470 ASN G 205 CB CG OD1 ND2 REMARK 470 VAL G 206 CB CG1 CG2 REMARK 470 ASN G 207 CB CG OD1 ND2 REMARK 470 HIS G 208 CB CG ND1 CD2 CE1 NE2 REMARK 470 LYS G 209 CB CG CD CE NZ REMARK 470 PRO G 210 CB CG CD REMARK 470 SER G 211 CB OG REMARK 470 ASN G 212 CB CG OD1 ND2 REMARK 470 THR G 213 CB OG1 CG2 REMARK 470 LYS G 214 CB CG CD CE NZ REMARK 470 VAL G 215 CB CG1 CG2 REMARK 470 ASP G 216 CB CG OD1 OD2 REMARK 470 LYS G 217 CB CG CD CE NZ REMARK 470 LYS G 218 CB CG CD CE NZ REMARK 470 VAL G 219 CB CG1 CG2 REMARK 470 GLU G 220 CB CG CD OE1 OE2 REMARK 470 PRO G 221 CB CG CD REMARK 470 LYS G 222 CB CG CD CE NZ REMARK 470 PRO H 2 CB CG CD REMARK 470 VAL H 3 CB CG1 CG2 REMARK 470 LEU H 4 CB CG CD1 CD2 REMARK 470 THR H 5 CB OG1 CG2 REMARK 470 GLN H 6 CB CG CD OE1 NE2 REMARK 470 PRO H 7 CB CG CD REMARK 470 PRO H 8 CB CG CD REMARK 470 SER H 9 CB OG REMARK 470 VAL H 10 CB CG1 CG2 REMARK 470 SER H 11 CB OG REMARK 470 LYS H 12 CB CG CD CE NZ REMARK 470 ALA H 13 CB REMARK 470 LEU H 14 CB CG CD1 CD2 REMARK 470 ARG H 15 CB CG CD NE CZ NH1 NH2 REMARK 470 GLN H 16 CB CG CD OE1 NE2 REMARK 470 THR H 17 CB OG1 CG2 REMARK 470 ALA H 18 CB REMARK 470 THR H 19 CB OG1 CG2 REMARK 470 LEU H 20 CB CG CD1 CD2 REMARK 470 THR H 21 CB OG1 CG2 REMARK 470 CYS H 22 CB SG REMARK 470 THR H 23 CB OG1 CG2 REMARK 470 ASP H 25 CB CG OD1 OD2 REMARK 470 SER H 26 CB OG REMARK 470 ASN H 27 CB CG OD1 ND2 REMARK 470 ASN H 28 CB CG OD1 ND2 REMARK 470 VAL H 29 CB CG1 CG2 REMARK 470 ASN H 31 CB CG OD1 ND2 REMARK 470 ARG H 32 CB CG CD NE CZ NH1 NH2 REMARK 470 ALA H 34 CB REMARK 470 ALA H 35 CB REMARK 470 TRP H 36 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP H 36 CZ2 CZ3 CH2 REMARK 470 PHE H 37 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 LEU H 38 CB CG CD1 CD2 REMARK 470 LEU H 39 CB CG CD1 CD2 REMARK 470 HIS H 40 CB CG ND1 CD2 CE1 NE2 REMARK 470 GLN H 41 CB CG CD OE1 NE2 REMARK 470 HIS H 43 CB CG ND1 CD2 CE1 NE2 REMARK 470 PRO H 44 CB CG CD REMARK 470 PRO H 45 CB CG CD REMARK 470 LYS H 46 CB CG CD CE NZ REMARK 470 LEU H 47 CB CG CD1 CD2 REMARK 470 LEU H 48 CB CG CD1 CD2 REMARK 470 ALA H 49 CB REMARK 470 TYR H 50 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR H 50 OH REMARK 470 ARG H 51 CB CG CD NE CZ NH1 NH2 REMARK 470 ASN H 52 CB CG OD1 ND2 REMARK 470 ASN H 53 CB CG OD1 ND2 REMARK 470 ASP H 54 CB CG OD1 OD2 REMARK 470 ARG H 55 CB CG CD NE CZ NH1 NH2 REMARK 470 PRO H 56 CB CG CD REMARK 470 SER H 57 CB OG REMARK 470 ILE H 59 CB CG1 CG2 CD1 REMARK 470 SER H 60 CB OG REMARK 470 GLU H 61 CB CG CD OE1 OE2 REMARK 470 ARG H 62 CB CG CD NE CZ NH1 NH2 REMARK 470 LEU H 63 CB CG CD1 CD2 REMARK 470 SER H 64 CB OG REMARK 470 ALA H 65 CB REMARK 470 SER H 66 CB OG REMARK 470 ARG H 67 CB CG CD NE CZ NH1 NH2 REMARK 470 SER H 68 CB OG REMARK 470 ASN H 70 CB CG OD1 ND2 REMARK 470 THR H 71 CB OG1 CG2 REMARK 470 ALA H 72 CB REMARK 470 SER H 73 CB OG REMARK 470 LEU H 74 CB CG CD1 CD2 REMARK 470 THR H 75 CB OG1 CG2 REMARK 470 ILE H 76 CB CG1 CG2 CD1 REMARK 470 THR H 77 CB OG1 CG2 REMARK 470 LEU H 79 CB CG CD1 CD2 REMARK 470 GLN H 80 CB CG CD OE1 NE2 REMARK 470 PRO H 81 CB CG CD REMARK 470 GLU H 82 CB CG CD OE1 OE2 REMARK 470 ASP H 83 CB CG OD1 OD2 REMARK 470 GLU H 84 CB CG CD OE1 OE2 REMARK 470 ALA H 85 CB REMARK 470 ASP H 86 CB CG OD1 OD2 REMARK 470 TYR H 87 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR H 87 OH REMARK 470 TYR H 88 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR H 88 OH REMARK 470 CYS H 89 CB SG REMARK 470 SER H 90 CB OG REMARK 470 ALA H 91 CB REMARK 470 TRP H 92 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP H 92 CZ2 CZ3 CH2 REMARK 470 ASP H 93 CB CG OD1 OD2 REMARK 470 SER H 94 CB OG REMARK 470 SER H 95 CB OG REMARK 470 LEU H 96 CB CG CD1 CD2 REMARK 470 ARG H 97 CB CG CD NE CZ NH1 NH2 REMARK 470 VAL H 98 CB CG1 CG2 REMARK 470 GLN H 99 CB CG CD OE1 NE2 REMARK 470 VAL H 100 CB CG1 CG2 REMARK 470 PHE H 101 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 THR H 105 CB OG1 CG2 REMARK 470 LYS H 106 CB CG CD CE NZ REMARK 470 LEU H 107 CB CG CD1 CD2 REMARK 470 THR H 108 CB OG1 CG2 REMARK 470 VAL H 109 CB CG1 CG2 REMARK 470 LEU H 110 CB CG CD1 CD2 REMARK 470 GLN H 112 CB CG CD OE1 NE2 REMARK 470 PRO H 113 CB CG CD REMARK 470 LYS H 114 CB CG CD CE NZ REMARK 470 ALA H 115 CB REMARK 470 ALA H 116 CB REMARK 470 PRO H 117 CB CG CD REMARK 470 SER H 118 CB OG REMARK 470 VAL H 119 CB CG1 CG2 REMARK 470 THR H 120 CB OG1 CG2 REMARK 470 LEU H 121 CB CG CD1 CD2 REMARK 470 PHE H 122 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 PRO H 123 CB CG CD REMARK 470 PRO H 124 CB CG CD REMARK 470 SER H 125 CB OG REMARK 470 SER H 126 CB OG REMARK 470 GLU H 127 CB CG CD OE1 OE2 REMARK 470 GLU H 128 CB CG CD OE1 OE2 REMARK 470 LEU H 129 CB CG CD1 CD2 REMARK 470 GLN H 130 CB CG CD OE1 NE2 REMARK 470 ALA H 131 CB REMARK 470 ASN H 132 CB CG OD1 ND2 REMARK 470 LYS H 133 CB CG CD CE NZ REMARK 470 ALA H 134 CB REMARK 470 THR H 135 CB OG1 CG2 REMARK 470 LEU H 136 CB CG CD1 CD2 REMARK 470 VAL H 137 CB CG1 CG2 REMARK 470 CYS H 138 CB SG REMARK 470 LEU H 139 CB CG CD1 CD2 REMARK 470 ILE H 140 CB CG1 CG2 CD1 REMARK 470 SER H 141 CB OG REMARK 470 ASP H 142 CB CG OD1 OD2 REMARK 470 PHE H 143 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR H 144 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR H 144 OH REMARK 470 PRO H 145 CB CG CD REMARK 470 ALA H 147 CB REMARK 470 VAL H 148 CB CG1 CG2 REMARK 470 THR H 149 CB OG1 CG2 REMARK 470 VAL H 150 CB CG1 CG2 REMARK 470 ALA H 151 CB REMARK 470 TRP H 152 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP H 152 CZ2 CZ3 CH2 REMARK 470 LYS H 153 CB CG CD CE NZ REMARK 470 ALA H 154 CB REMARK 470 ASP H 155 CB CG OD1 OD2 REMARK 470 SER H 156 CB OG REMARK 470 SER H 157 CB OG REMARK 470 PRO H 158 CB CG CD REMARK 470 VAL H 159 CB CG1 CG2 REMARK 470 LYS H 160 CB CG CD CE NZ REMARK 470 ALA H 161 CB REMARK 470 VAL H 163 CB CG1 CG2 REMARK 470 GLU H 164 CB CG CD OE1 OE2 REMARK 470 THR H 165 CB OG1 CG2 REMARK 470 THR H 166 CB OG1 CG2 REMARK 470 THR H 167 CB OG1 CG2 REMARK 470 PRO H 168 CB CG CD REMARK 470 SER H 169 CB OG REMARK 470 LYS H 170 CB CG CD CE NZ REMARK 470 GLN H 171 CB CG CD OE1 NE2 REMARK 470 SER H 172 CB OG REMARK 470 ASN H 173 CB CG OD1 ND2 REMARK 470 ASN H 174 CB CG OD1 ND2 REMARK 470 LYS H 175 CB CG CD CE NZ REMARK 470 TYR H 176 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR H 176 OH REMARK 470 ALA H 177 CB REMARK 470 ALA H 178 CB REMARK 470 SER H 179 CB OG REMARK 470 SER H 180 CB OG REMARK 470 TYR H 181 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR H 181 OH REMARK 470 LEU H 182 CB CG CD1 CD2 REMARK 470 SER H 183 CB OG REMARK 470 LEU H 184 CB CG CD1 CD2 REMARK 470 THR H 185 CB OG1 CG2 REMARK 470 PRO H 186 CB CG CD REMARK 470 GLU H 187 CB CG CD OE1 OE2 REMARK 470 GLN H 188 CB CG CD OE1 NE2 REMARK 470 TRP H 189 CB CG CD1 CD2 NE1 CE2 CE3 REMARK 470 TRP H 189 CZ2 CZ3 CH2 REMARK 470 LYS H 190 CB CG CD CE NZ REMARK 470 SER H 191 CB OG REMARK 470 HIS H 192 CB CG ND1 CD2 CE1 NE2 REMARK 470 LYS H 193 CB CG CD CE NZ REMARK 470 SER H 194 CB OG REMARK 470 TYR H 195 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 TYR H 195 OH REMARK 470 SER H 196 CB OG REMARK 470 CYS H 197 CB SG REMARK 470 GLN H 198 CB CG CD OE1 NE2 REMARK 470 VAL H 199 CB CG1 CG2 REMARK 470 THR H 200 CB OG1 CG2 REMARK 470 HIS H 201 CB CG ND1 CD2 CE1 NE2 REMARK 470 GLU H 202 CB CG CD OE1 OE2 REMARK 470 SER H 204 CB OG REMARK 470 THR H 205 CB OG1 CG2 REMARK 470 VAL H 206 CB CG1 CG2 REMARK 470 GLU H 207 CB CG CD OE1 OE2 REMARK 470 LYS H 208 CB CG CD CE NZ REMARK 470 THR H 209 CB OG1 CG2 REMARK 470 VAL H 210 CB CG1 CG2 REMARK 470 ALA H 211 CB REMARK 470 PRO H 212 CB CG CD REMARK 470 THR H 213 CB OG1 CG2 REMARK 470 GLU H 214 CB CG CD OE1 OE2 REMARK 470 CYS H 215 CB SG REMARK 470 SER H 216 CB OG REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 THR E 116 O - C - N ANGL. DEV. = -11.1 DEGREES REMARK 500 VAL F 109 CA - C - N ANGL. DEV. = -13.2 DEGREES REMARK 500 THR G 116 O - C - N ANGL. DEV. = -11.0 DEGREES REMARK 500 VAL H 109 CA - C - N ANGL. DEV. = -13.2 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 GLU A 296 -35.37 -137.24 REMARK 500 ALA E 9 -122.42 51.24 REMARK 500 ILE E 48 40.00 -141.47 REMARK 500 GLU E 50 123.78 -36.08 REMARK 500 HIS E 53 -125.06 56.29 REMARK 500 SER E 65 -79.34 -125.82 REMARK 500 VAL E 67 35.93 31.86 REMARK 500 THR E 68 41.33 22.73 REMARK 500 ILE E 69 50.25 31.86 REMARK 500 SER E 70 59.66 -69.20 REMARK 500 ASP E 72 -159.07 51.83 REMARK 500 ARG E 104 6.72 -69.31 REMARK 500 VAL F 29 -50.75 62.56 REMARK 500 ARG F 51 78.92 44.26 REMARK 500 ASN F 52 -105.25 66.14 REMARK 500 ASN F 70 15.75 -155.56 REMARK 500 GLN F 99 35.11 -62.62 REMARK 500 ASP F 155 -60.76 60.05 REMARK 500 SER F 156 -6.89 -154.91 REMARK 500 GLU F 202 -111.77 52.47 REMARK 500 GLU B 296 -35.39 -137.24 REMARK 500 ALA G 9 -122.46 51.28 REMARK 500 ILE G 48 40.08 -141.52 REMARK 500 GLU G 50 123.82 -36.17 REMARK 500 HIS G 53 -125.04 56.27 REMARK 500 SER G 65 -79.35 -125.78 REMARK 500 VAL G 67 35.92 31.84 REMARK 500 THR G 68 41.30 22.77 REMARK 500 ILE G 69 50.24 31.88 REMARK 500 SER G 70 59.66 -69.17 REMARK 500 ASP G 72 -159.07 51.84 REMARK 500 ARG G 104 6.68 -69.27 REMARK 500 VAL H 29 -50.71 62.53 REMARK 500 ARG H 51 78.89 44.29 REMARK 500 ASN H 52 -105.27 66.19 REMARK 500 ASN H 70 15.73 -155.58 REMARK 500 GLN H 99 35.10 -62.67 REMARK 500 ASP H 155 -60.70 60.03 REMARK 500 SER H 156 -6.89 -154.95 REMARK 500 GLU H 202 -111.75 52.53 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: EMD-47134 RELATED DB: EMDB REMARK 900 CHIP U-BOX DIMER BOUND TO FAB 2F1 DBREF 9DRY A 226 300 UNP Q9UNE7 CHIP_HUMAN 226 300 DBREF 9DRY E 1 222 PDB 9DRY 9DRY 1 222 DBREF 9DRY F 2 216 PDB 9DRY 9DRY 2 216 DBREF 9DRY B 226 300 UNP Q9UNE7 CHIP_HUMAN 226 300 DBREF 9DRY G 1 222 PDB 9DRY 9DRY 1 222 DBREF 9DRY H 2 216 PDB 9DRY 9DRY 2 216 SEQRES 1 A 75 ASP ILE PRO ASP TYR LEU CYS GLY LYS ILE SER PHE GLU SEQRES 2 A 75 LEU MET ARG GLU PRO CYS ILE THR PRO SER GLY ILE THR SEQRES 3 A 75 TYR ASP ARG LYS ASP ILE GLU GLU HIS LEU GLN ARG VAL SEQRES 4 A 75 GLY HIS PHE ASP PRO VAL THR ARG SER PRO LEU THR GLN SEQRES 5 A 75 GLU GLN LEU ILE PRO ASN LEU ALA MET LYS GLU VAL ILE SEQRES 6 A 75 ASP ALA PHE ILE SER GLU ASN GLY TRP VAL SEQRES 1 E 222 GLN VAL GLN LEU GLN GLN TRP GLY ALA GLY LEU LEU LYS SEQRES 2 E 222 PRO SER GLU THR LEU SER LEU THR CYS ALA VAL TYR GLY SEQRES 3 E 222 GLY SER PHE SER GLY TYR TYR TRP SER TRP ILE ARG GLN SEQRES 4 E 222 PRO PRO GLY LYS GLY LEU GLU TRP ILE GLY GLU ILE ASN SEQRES 5 E 222 HIS SER GLY SER THR ASN TYR ASN PRO SER LEU LYS SER SEQRES 6 E 222 ARG VAL THR ILE SER VAL ASP THR SER LYS ASN GLN PHE SEQRES 7 E 222 SER LEU LYS LEU SER SER VAL THR ALA ALA ASP THR ALA SEQRES 8 E 222 VAL TYR TYR CYS ALA ARG GLY GLY VAL GLY ARG VAL ARG SEQRES 9 E 222 GLY ASP SER MET ASP VAL TRP GLY GLN GLY THR THR VAL SEQRES 10 E 222 THR VAL SER SER ALA SER THR LYS GLY PRO SER VAL PHE SEQRES 11 E 222 PRO LEU ALA PRO SER SER LYS SER THR SER GLY GLY THR SEQRES 12 E 222 ALA ALA LEU GLY CYS LEU VAL LYS ASP TYR PHE PRO GLU SEQRES 13 E 222 PRO VAL THR VAL SER TRP ASN SER GLY ALA LEU THR SER SEQRES 14 E 222 GLY VAL HIS THR PHE PRO ALA VAL LEU GLN SER SER GLY SEQRES 15 E 222 LEU TYR SER LEU SER SER VAL VAL THR VAL PRO SER SER SEQRES 16 E 222 SER LEU GLY THR GLN THR TYR ILE CYS ASN VAL ASN HIS SEQRES 17 E 222 LYS PRO SER ASN THR LYS VAL ASP LYS LYS VAL GLU PRO SEQRES 18 E 222 LYS SEQRES 1 F 215 PRO VAL LEU THR GLN PRO PRO SER VAL SER LYS ALA LEU SEQRES 2 F 215 ARG GLN THR ALA THR LEU THR CYS THR GLY ASP SER ASN SEQRES 3 F 215 ASN VAL GLY ASN ARG GLY ALA ALA TRP PHE LEU LEU HIS SEQRES 4 F 215 GLN GLY HIS PRO PRO LYS LEU LEU ALA TYR ARG ASN ASN SEQRES 5 F 215 ASP ARG PRO SER GLY ILE SER GLU ARG LEU SER ALA SER SEQRES 6 F 215 ARG SER GLY ASN THR ALA SER LEU THR ILE THR GLY LEU SEQRES 7 F 215 GLN PRO GLU ASP GLU ALA ASP TYR TYR CYS SER ALA TRP SEQRES 8 F 215 ASP SER SER LEU ARG VAL GLN VAL PHE GLY GLY GLY THR SEQRES 9 F 215 LYS LEU THR VAL LEU GLY GLN PRO LYS ALA ALA PRO SER SEQRES 10 F 215 VAL THR LEU PHE PRO PRO SER SER GLU GLU LEU GLN ALA SEQRES 11 F 215 ASN LYS ALA THR LEU VAL CYS LEU ILE SER ASP PHE TYR SEQRES 12 F 215 PRO GLY ALA VAL THR VAL ALA TRP LYS ALA ASP SER SER SEQRES 13 F 215 PRO VAL LYS ALA GLY VAL GLU THR THR THR PRO SER LYS SEQRES 14 F 215 GLN SER ASN ASN LYS TYR ALA ALA SER SER TYR LEU SER SEQRES 15 F 215 LEU THR PRO GLU GLN TRP LYS SER HIS LYS SER TYR SER SEQRES 16 F 215 CYS GLN VAL THR HIS GLU GLY SER THR VAL GLU LYS THR SEQRES 17 F 215 VAL ALA PRO THR GLU CYS SER SEQRES 1 B 75 ASP ILE PRO ASP TYR LEU CYS GLY LYS ILE SER PHE GLU SEQRES 2 B 75 LEU MET ARG GLU PRO CYS ILE THR PRO SER GLY ILE THR SEQRES 3 B 75 TYR ASP ARG LYS ASP ILE GLU GLU HIS LEU GLN ARG VAL SEQRES 4 B 75 GLY HIS PHE ASP PRO VAL THR ARG SER PRO LEU THR GLN SEQRES 5 B 75 GLU GLN LEU ILE PRO ASN LEU ALA MET LYS GLU VAL ILE SEQRES 6 B 75 ASP ALA PHE ILE SER GLU ASN GLY TRP VAL SEQRES 1 G 222 GLN VAL GLN LEU GLN GLN TRP GLY ALA GLY LEU LEU LYS SEQRES 2 G 222 PRO SER GLU THR LEU SER LEU THR CYS ALA VAL TYR GLY SEQRES 3 G 222 GLY SER PHE SER GLY TYR TYR TRP SER TRP ILE ARG GLN SEQRES 4 G 222 PRO PRO GLY LYS GLY LEU GLU TRP ILE GLY GLU ILE ASN SEQRES 5 G 222 HIS SER GLY SER THR ASN TYR ASN PRO SER LEU LYS SER SEQRES 6 G 222 ARG VAL THR ILE SER VAL ASP THR SER LYS ASN GLN PHE SEQRES 7 G 222 SER LEU LYS LEU SER SER VAL THR ALA ALA ASP THR ALA SEQRES 8 G 222 VAL TYR TYR CYS ALA ARG GLY GLY VAL GLY ARG VAL ARG SEQRES 9 G 222 GLY ASP SER MET ASP VAL TRP GLY GLN GLY THR THR VAL SEQRES 10 G 222 THR VAL SER SER ALA SER THR LYS GLY PRO SER VAL PHE SEQRES 11 G 222 PRO LEU ALA PRO SER SER LYS SER THR SER GLY GLY THR SEQRES 12 G 222 ALA ALA LEU GLY CYS LEU VAL LYS ASP TYR PHE PRO GLU SEQRES 13 G 222 PRO VAL THR VAL SER TRP ASN SER GLY ALA LEU THR SER SEQRES 14 G 222 GLY VAL HIS THR PHE PRO ALA VAL LEU GLN SER SER GLY SEQRES 15 G 222 LEU TYR SER LEU SER SER VAL VAL THR VAL PRO SER SER SEQRES 16 G 222 SER LEU GLY THR GLN THR TYR ILE CYS ASN VAL ASN HIS SEQRES 17 G 222 LYS PRO SER ASN THR LYS VAL ASP LYS LYS VAL GLU PRO SEQRES 18 G 222 LYS SEQRES 1 H 215 PRO VAL LEU THR GLN PRO PRO SER VAL SER LYS ALA LEU SEQRES 2 H 215 ARG GLN THR ALA THR LEU THR CYS THR GLY ASP SER ASN SEQRES 3 H 215 ASN VAL GLY ASN ARG GLY ALA ALA TRP PHE LEU LEU HIS SEQRES 4 H 215 GLN GLY HIS PRO PRO LYS LEU LEU ALA TYR ARG ASN ASN SEQRES 5 H 215 ASP ARG PRO SER GLY ILE SER GLU ARG LEU SER ALA SER SEQRES 6 H 215 ARG SER GLY ASN THR ALA SER LEU THR ILE THR GLY LEU SEQRES 7 H 215 GLN PRO GLU ASP GLU ALA ASP TYR TYR CYS SER ALA TRP SEQRES 8 H 215 ASP SER SER LEU ARG VAL GLN VAL PHE GLY GLY GLY THR SEQRES 9 H 215 LYS LEU THR VAL LEU GLY GLN PRO LYS ALA ALA PRO SER SEQRES 10 H 215 VAL THR LEU PHE PRO PRO SER SER GLU GLU LEU GLN ALA SEQRES 11 H 215 ASN LYS ALA THR LEU VAL CYS LEU ILE SER ASP PHE TYR SEQRES 12 H 215 PRO GLY ALA VAL THR VAL ALA TRP LYS ALA ASP SER SER SEQRES 13 H 215 PRO VAL LYS ALA GLY VAL GLU THR THR THR PRO SER LYS SEQRES 14 H 215 GLN SER ASN ASN LYS TYR ALA ALA SER SER TYR LEU SER SEQRES 15 H 215 LEU THR PRO GLU GLN TRP LYS SER HIS LYS SER TYR SER SEQRES 16 H 215 CYS GLN VAL THR HIS GLU GLY SER THR VAL GLU LYS THR SEQRES 17 H 215 VAL ALA PRO THR GLU CYS SER HELIX 1 AA1 PRO A 228 CYS A 232 5 5 HELIX 2 AA2 ARG A 254 VAL A 264 1 11 HELIX 3 AA3 ASN A 283 SER A 295 1 13 HELIX 4 AA4 SER E 65 SER E 70 5 6 HELIX 5 AA5 THR E 86 THR E 90 5 5 HELIX 6 AA6 SER E 136 GLY E 141 1 6 HELIX 7 AA7 SER E 164 ALA E 166 5 3 HELIX 8 AA8 PRO E 193 LEU E 197 5 5 HELIX 9 AA9 GLN F 80 GLU F 84 5 5 HELIX 10 AB1 SER F 125 ALA F 131 1 7 HELIX 11 AB2 THR F 185 SER F 191 1 7 HELIX 12 AB3 PRO B 228 CYS B 232 5 5 HELIX 13 AB4 ARG B 254 VAL B 264 1 11 HELIX 14 AB5 ASN B 283 SER B 295 1 13 HELIX 15 AB6 SER G 65 SER G 70 5 6 HELIX 16 AB7 THR G 86 THR G 90 5 5 HELIX 17 AB8 SER G 136 GLY G 141 1 6 HELIX 18 AB9 SER G 164 ALA G 166 5 3 HELIX 19 AC1 PRO G 193 LEU G 197 5 5 HELIX 20 AC2 GLN H 80 GLU H 84 5 5 HELIX 21 AC3 SER H 125 ALA H 131 1 7 HELIX 22 AC4 THR H 185 SER H 191 1 7 SHEET 1 AA1 3 THR A 251 ASP A 253 0 SHEET 2 AA1 3 PRO A 243 ILE A 245 -1 N CYS A 244 O TYR A 252 SHEET 3 AA1 3 ILE A 281 PRO A 282 -1 O ILE A 281 N ILE A 245 SHEET 1 AA2 2 GLN E 3 GLN E 6 0 SHEET 2 AA2 2 CYS E 22 TYR E 25 -1 O ALA E 23 N GLN E 5 SHEET 1 AA3 5 LEU E 11 LEU E 12 0 SHEET 2 AA3 5 THR E 115 VAL E 119 1 O THR E 118 N LEU E 12 SHEET 3 AA3 5 ALA E 91 ARG E 97 -1 N TYR E 93 O THR E 115 SHEET 4 AA3 5 TRP E 34 GLN E 39 -1 N ILE E 37 O TYR E 94 SHEET 5 AA3 5 GLU E 46 ILE E 48 -1 O GLU E 46 N ARG E 38 SHEET 1 AA4 2 LEU E 18 LEU E 20 0 SHEET 2 AA4 2 LEU E 80 LEU E 82 -1 O LEU E 82 N LEU E 18 SHEET 1 AA5 2 THR E 73 SER E 74 0 SHEET 2 AA5 2 GLN E 77 PHE E 78 -1 O GLN E 77 N SER E 74 SHEET 1 AA6 4 SER E 128 LEU E 132 0 SHEET 2 AA6 4 ALA E 144 TYR E 153 -1 O LEU E 149 N PHE E 130 SHEET 3 AA6 4 TYR E 184 VAL E 192 -1 O TYR E 184 N TYR E 153 SHEET 4 AA6 4 VAL E 171 THR E 173 -1 N HIS E 172 O VAL E 189 SHEET 1 AA7 4 SER E 128 LEU E 132 0 SHEET 2 AA7 4 ALA E 144 TYR E 153 -1 O LEU E 149 N PHE E 130 SHEET 3 AA7 4 TYR E 184 VAL E 192 -1 O TYR E 184 N TYR E 153 SHEET 4 AA7 4 VAL E 177 LEU E 178 -1 N VAL E 177 O SER E 185 SHEET 1 AA8 3 THR E 159 TRP E 162 0 SHEET 2 AA8 3 TYR E 202 HIS E 208 -1 O ASN E 207 N THR E 159 SHEET 3 AA8 3 THR E 213 VAL E 219 -1 O VAL E 219 N TYR E 202 SHEET 1 AA9 5 SER F 9 ALA F 13 0 SHEET 2 AA9 5 THR F 105 LEU F 110 1 O THR F 108 N VAL F 10 SHEET 3 AA9 5 ALA F 85 CYS F 89 -1 N TYR F 87 O THR F 105 SHEET 4 AA9 5 TRP F 36 LEU F 39 -1 N LEU F 39 O ASP F 86 SHEET 5 AA9 5 LYS F 46 ALA F 49 -1 O LEU F 48 N TRP F 36 SHEET 1 AB1 3 ALA F 18 CYS F 22 0 SHEET 2 AB1 3 ALA F 72 ILE F 76 -1 O ILE F 76 N ALA F 18 SHEET 3 AB1 3 LEU F 63 SER F 66 -1 N SER F 64 O THR F 75 SHEET 1 AB2 4 SER F 118 PHE F 122 0 SHEET 2 AB2 4 ALA F 134 PHE F 143 -1 O VAL F 137 N PHE F 122 SHEET 3 AB2 4 TYR F 176 LEU F 184 -1 O SER F 180 N CYS F 138 SHEET 4 AB2 4 VAL F 163 THR F 165 -1 N GLU F 164 O TYR F 181 SHEET 1 AB3 4 SER F 118 PHE F 122 0 SHEET 2 AB3 4 ALA F 134 PHE F 143 -1 O VAL F 137 N PHE F 122 SHEET 3 AB3 4 TYR F 176 LEU F 184 -1 O SER F 180 N CYS F 138 SHEET 4 AB3 4 SER F 169 LYS F 170 -1 N SER F 169 O ALA F 177 SHEET 1 AB4 4 SER F 157 VAL F 159 0 SHEET 2 AB4 4 THR F 149 ALA F 154 -1 N TRP F 152 O VAL F 159 SHEET 3 AB4 4 TYR F 195 HIS F 201 -1 O GLN F 198 N ALA F 151 SHEET 4 AB4 4 SER F 204 VAL F 210 -1 O SER F 204 N HIS F 201 SHEET 1 AB5 3 THR B 251 ASP B 253 0 SHEET 2 AB5 3 PRO B 243 ILE B 245 -1 N CYS B 244 O TYR B 252 SHEET 3 AB5 3 ILE B 281 PRO B 282 -1 O ILE B 281 N ILE B 245 SHEET 1 AB6 2 GLN G 3 GLN G 6 0 SHEET 2 AB6 2 CYS G 22 TYR G 25 -1 O ALA G 23 N GLN G 5 SHEET 1 AB7 5 LEU G 11 LEU G 12 0 SHEET 2 AB7 5 THR G 115 VAL G 119 1 O THR G 118 N LEU G 12 SHEET 3 AB7 5 ALA G 91 ARG G 97 -1 N TYR G 93 O THR G 115 SHEET 4 AB7 5 TRP G 34 GLN G 39 -1 N ILE G 37 O TYR G 94 SHEET 5 AB7 5 GLU G 46 ILE G 48 -1 O GLU G 46 N ARG G 38 SHEET 1 AB8 2 LEU G 18 LEU G 20 0 SHEET 2 AB8 2 LEU G 80 LEU G 82 -1 O LEU G 82 N LEU G 18 SHEET 1 AB9 2 THR G 73 SER G 74 0 SHEET 2 AB9 2 GLN G 77 PHE G 78 -1 O GLN G 77 N SER G 74 SHEET 1 AC1 4 SER G 128 LEU G 132 0 SHEET 2 AC1 4 ALA G 144 TYR G 153 -1 O LEU G 149 N PHE G 130 SHEET 3 AC1 4 TYR G 184 VAL G 192 -1 O TYR G 184 N TYR G 153 SHEET 4 AC1 4 VAL G 171 THR G 173 -1 N HIS G 172 O VAL G 189 SHEET 1 AC2 4 SER G 128 LEU G 132 0 SHEET 2 AC2 4 ALA G 144 TYR G 153 -1 O LEU G 149 N PHE G 130 SHEET 3 AC2 4 TYR G 184 VAL G 192 -1 O TYR G 184 N TYR G 153 SHEET 4 AC2 4 VAL G 177 LEU G 178 -1 N VAL G 177 O SER G 185 SHEET 1 AC3 3 THR G 159 TRP G 162 0 SHEET 2 AC3 3 TYR G 202 HIS G 208 -1 O ASN G 207 N THR G 159 SHEET 3 AC3 3 THR G 213 VAL G 219 -1 O VAL G 219 N TYR G 202 SHEET 1 AC4 5 SER H 9 ALA H 13 0 SHEET 2 AC4 5 THR H 105 LEU H 110 1 O THR H 108 N VAL H 10 SHEET 3 AC4 5 ALA H 85 CYS H 89 -1 N TYR H 87 O THR H 105 SHEET 4 AC4 5 TRP H 36 LEU H 39 -1 N LEU H 39 O ASP H 86 SHEET 5 AC4 5 LYS H 46 ALA H 49 -1 O LEU H 48 N TRP H 36 SHEET 1 AC5 3 ALA H 18 CYS H 22 0 SHEET 2 AC5 3 ALA H 72 ILE H 76 -1 O ILE H 76 N ALA H 18 SHEET 3 AC5 3 LEU H 63 SER H 66 -1 N SER H 64 O THR H 75 SHEET 1 AC6 4 SER H 118 PHE H 122 0 SHEET 2 AC6 4 ALA H 134 PHE H 143 -1 O VAL H 137 N PHE H 122 SHEET 3 AC6 4 TYR H 176 LEU H 184 -1 O SER H 180 N CYS H 138 SHEET 4 AC6 4 VAL H 163 THR H 165 -1 N GLU H 164 O TYR H 181 SHEET 1 AC7 4 SER H 118 PHE H 122 0 SHEET 2 AC7 4 ALA H 134 PHE H 143 -1 O VAL H 137 N PHE H 122 SHEET 3 AC7 4 TYR H 176 LEU H 184 -1 O SER H 180 N CYS H 138 SHEET 4 AC7 4 SER H 169 LYS H 170 -1 N SER H 169 O ALA H 177 SHEET 1 AC8 4 SER H 157 VAL H 159 0 SHEET 2 AC8 4 THR H 149 ALA H 154 -1 N TRP H 152 O VAL H 159 SHEET 3 AC8 4 TYR H 195 HIS H 201 -1 O GLN H 198 N ALA H 151 SHEET 4 AC8 4 SER H 204 VAL H 210 -1 O SER H 204 N HIS H 201 CISPEP 1 PHE E 154 PRO E 155 0 2.07 CISPEP 2 TYR F 144 PRO F 145 0 -1.97 CISPEP 3 PHE G 154 PRO G 155 0 2.04 CISPEP 4 TYR H 144 PRO H 145 0 -1.92 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000