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HEADER HYDROLASE 28-APR-20 6WPY
TITLE CRYSTAL STRUCTURE OF BACILLUS LICHENIFORMIS LIPASE BLEST2 IN MATURE
TITLE 2 FORM
CAVEAT 6WPY THERE IS A DIFFERENCE OF RFREE VALUES: REPORTED (0.2580)
CAVEAT 2 6WPY CALCULATED (0.2787).
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: BLEST2;
COMPND 3 CHAIN: A, B, C, D, E, F;
COMPND 4 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS LICHENIFORMIS;
SOURCE 3 ORGANISM_TAXID: 1402;
SOURCE 4 GENE: DW032_06865;
SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562
KEYWDS ESTERASE, LIPASE, PROPETIDE, HYDROLASE
EXPDTA X-RAY DIFFRACTION
AUTHOR A.M.NAKAMURA,A.S.GODOY,M.A.S.KADOWAKI,I.POLIKARPOV
REVDAT 1 09-JUN-21 6WPY 0
JRNL AUTH A.M.NAKAMURA,A.S.GODOY,M.A.S.KADOWAKI,I.POLIKARPOV
JRNL TITL THE FIRST STRUCTURE OF BACILLUS LICHENIFORMIS LIPASE BLEST2
JRNL TITL 2 IN ITS PROPEPTIDE AND MATURE FORM REVEALING MOLECULAR
JRNL TITL 3 DETAILS OF INHIBITION BY ITS C-TERMINAL DOMAINS
JRNL REF TO BE PUBLISHED
JRNL REFN
REMARK 2
REMARK 2 RESOLUTION. 3.60 ANGSTROMS.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : BUSTER 2.10.3
REMARK 3 AUTHORS : BRICOGNE,BLANC,BRANDL,FLENSBURG,KELLER,
REMARK 3 : PACIOREK,ROVERSI,SHARFF,SMART,VONRHEIN,
REMARK 3 : WOMACK,MATTHEWS,TEN EYCK,TRONRUD
REMARK 3
REMARK 3 DATA USED IN REFINEMENT.
REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 3.60
REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 40.49
REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000
REMARK 3 COMPLETENESS FOR RANGE (%) : 99.9
REMARK 3 NUMBER OF REFLECTIONS : 23568
REMARK 3
REMARK 3 FIT TO DATA USED IN REFINEMENT.
REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT
REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM
REMARK 3 R VALUE (WORKING + TEST SET) : 0.216
REMARK 3 R VALUE (WORKING SET) : 0.214
REMARK 3 FREE R VALUE : 0.258
REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100
REMARK 3 FREE R VALUE TEST SET COUNT : 1202
REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.000
REMARK 3
REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN.
REMARK 3 TOTAL NUMBER OF BINS USED : 12
REMARK 3 BIN RESOLUTION RANGE HIGH (ANGSTROMS) : 3.60
REMARK 3 BIN RESOLUTION RANGE LOW (ANGSTROMS) : 3.76
REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.93
REMARK 3 REFLECTIONS IN BIN (WORKING + TEST SET) : 2830
REMARK 3 BIN R VALUE (WORKING + TEST SET) : 0.2350
REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2693
REMARK 3 BIN R VALUE (WORKING SET) : 0.2330
REMARK 3 BIN FREE R VALUE : 0.2740
REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 4.84
REMARK 3 BIN FREE R VALUE TEST SET COUNT : 137
REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.000
REMARK 3
REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
REMARK 3 PROTEIN ATOMS : 11580
REMARK 3 NUCLEIC ACID ATOMS : 0
REMARK 3 HETEROGEN ATOMS : 0
REMARK 3 SOLVENT ATOMS : 279
REMARK 3
REMARK 3 B VALUES.
REMARK 3 FROM WILSON PLOT (A**2) : NULL
REMARK 3 MEAN B VALUE (OVERALL, A**2) : 38.11
REMARK 3 OVERALL ANISOTROPIC B VALUE.
REMARK 3 B11 (A**2) : -10.03860
REMARK 3 B22 (A**2) : -7.48260
REMARK 3 B33 (A**2) : 17.52120
REMARK 3 B12 (A**2) : 0.00000
REMARK 3 B13 (A**2) : 0.00000
REMARK 3 B23 (A**2) : 0.00000
REMARK 3
REMARK 3 ESTIMATED COORDINATE ERROR.
REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.500
REMARK 3 DPI (BLOW EQ-10) BASED ON R VALUE (A) : NULL
REMARK 3 DPI (BLOW EQ-9) BASED ON FREE R VALUE (A) : 0.652
REMARK 3 DPI (CRUICKSHANK) BASED ON R VALUE (A) : NULL
REMARK 3 DPI (CRUICKSHANK) BASED ON FREE R VALUE (A) : NULL
REMARK 3
REMARK 3 REFERENCES: BLOW, D. (2002) ACTA CRYST D58, 792-797
REMARK 3 CRUICKSHANK, D.W.J. (1999) ACTA CRYST D55, 583-601
REMARK 3
REMARK 3 CORRELATION COEFFICIENTS.
REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.806
REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.764
REMARK 3
REMARK 3 NUMBER OF GEOMETRIC FUNCTION TERMS DEFINED : 15
REMARK 3 TERM COUNT WEIGHT FUNCTION.
REMARK 3 BOND LENGTHS : 11976 ; 2.000 ; HARMONIC
REMARK 3 BOND ANGLES : 16278 ; 2.000 ; HARMONIC
REMARK 3 TORSION ANGLES : 3912 ; 2.000 ; SINUSOIDAL
REMARK 3 TRIGONAL CARBON PLANES : 300 ; 2.000 ; HARMONIC
REMARK 3 GENERAL PLANES : 1770 ; 5.000 ; HARMONIC
REMARK 3 ISOTROPIC THERMAL FACTORS : 11976 ; 20.000 ; HARMONIC
REMARK 3 BAD NON-BONDED CONTACTS : NULL ; NULL ; NULL
REMARK 3 IMPROPER TORSIONS : NULL ; NULL ; NULL
REMARK 3 PSEUDOROTATION ANGLES : NULL ; NULL ; NULL
REMARK 3 CHIRAL IMPROPER TORSION : 1464 ; 5.000 ; SEMIHARMONIC
REMARK 3 SUM OF OCCUPANCIES : NULL ; NULL ; NULL
REMARK 3 UTILITY DISTANCES : NULL ; NULL ; NULL
REMARK 3 UTILITY ANGLES : NULL ; NULL ; NULL
REMARK 3 UTILITY TORSION : NULL ; NULL ; NULL
REMARK 3 IDEAL-DIST CONTACT TERM : 14600 ; 4.000 ; SEMIHARMONIC
REMARK 3
REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES.
REMARK 3 BOND LENGTHS (A) : 0.010
REMARK 3 BOND ANGLES (DEGREES) : 1.08
REMARK 3 PEPTIDE OMEGA TORSION ANGLES (DEGREES) : 2.83
REMARK 3 OTHER TORSION ANGLES (DEGREES) : 19.40
REMARK 3
REMARK 3 TLS DETAILS
REMARK 3 NUMBER OF TLS GROUPS : NULL
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 6WPY COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 29-APR-20.
REMARK 100 THE DEPOSITION ID IS D_1000248805.
REMARK 200
REMARK 200 EXPERIMENTAL DETAILS
REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION
REMARK 200 DATE OF DATA COLLECTION : 27-JUN-19
REMARK 200 TEMPERATURE (KELVIN) : 100
REMARK 200 PH : NULL
REMARK 200 NUMBER OF CRYSTALS USED : 1
REMARK 200
REMARK 200 SYNCHROTRON (Y/N) : Y
REMARK 200 RADIATION SOURCE : LNLS
REMARK 200 BEAMLINE : W01B-MX2
REMARK 200 X-RAY GENERATOR MODEL : NULL
REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M
REMARK 200 WAVELENGTH OR RANGE (A) : 1.4585
REMARK 200 MONOCHROMATOR : NULL
REMARK 200 OPTICS : NULL
REMARK 200
REMARK 200 DETECTOR TYPE : PIXEL
REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 2M
REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS
REMARK 200 DATA SCALING SOFTWARE : AIMLESS
REMARK 200
REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 23568
REMARK 200 RESOLUTION RANGE HIGH (A) : 3.600
REMARK 200 RESOLUTION RANGE LOW (A) : 40.490
REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL
REMARK 200
REMARK 200 OVERALL.
REMARK 200 COMPLETENESS FOR RANGE (%) : 99.3
REMARK 200 DATA REDUNDANCY : 6.400
REMARK 200 R MERGE (I) : NULL
REMARK 200 R SYM (I) : NULL
REMARK 200 FOR THE DATA SET : 4.8000
REMARK 200
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.
REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 3.60
REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 3.70
REMARK 200 COMPLETENESS FOR SHELL (%) : NULL
REMARK 200 DATA REDUNDANCY IN SHELL : NULL
REMARK 200 R MERGE FOR SHELL (I) : NULL
REMARK 200 R SYM FOR SHELL (I) : NULL
REMARK 200 FOR SHELL : 1.800
REMARK 200
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT
REMARK 200 SOFTWARE USED: PHASER
REMARK 200 STARTING MODEL: 6WPX
REMARK 200
REMARK 200 REMARK: NULL
REMARK 280
REMARK 280 CRYSTAL
REMARK 280 SOLVENT CONTENT, VS (%): 19.67
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.53
REMARK 280
REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1 M MMT PH 5.0 AND 25% (W/V) PEG
REMARK 280 1500, VAPOR DIFFUSION, TEMPERATURE 291K
REMARK 290
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 2 21
REMARK 290
REMARK 290 SYMOP SYMMETRY
REMARK 290 NNNMMM OPERATOR
REMARK 290 1555 X,Y,Z
REMARK 290 2555 -X,Y,-Z
REMARK 290 3555 X+1/2,-Y,-Z+1/2
REMARK 290 4555 -X+1/2,-Y,Z+1/2
REMARK 290
REMARK 290 WHERE NNN -> OPERATOR NUMBER
REMARK 290 MMM -> TRANSLATION VECTOR
REMARK 290
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY
REMARK 290 RELATED MOLECULES.
REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000
REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000
REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000
REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000
REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 0.00000
REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000
REMARK 290 SMTRY1 3 1.000000 0.000000 0.000000 51.03850
REMARK 290 SMTRY2 3 0.000000 -1.000000 0.000000 0.00000
REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 78.96000
REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 51.03850
REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000
REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 78.96000
REMARK 290
REMARK 290 REMARK: NULL
REMARK 300
REMARK 300 BIOMOLECULE: 1, 2, 3, 4, 5, 6
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: MONOMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A
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 350
REMARK 350 BIOMOLECULE: 2
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: B
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 350
REMARK 350 BIOMOLECULE: 3
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: C
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 350
REMARK 350 BIOMOLECULE: 4
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: D
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 350
REMARK 350 BIOMOLECULE: 5
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: E
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 350
REMARK 350 BIOMOLECULE: 6
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: F
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 465
REMARK 465 MISSING RESIDUES
REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE
REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)
REMARK 465
REMARK 465 M RES C SSSEQI
REMARK 465 MET A 1
REMARK 465 LYS A 2
REMARK 465 LYS A 3
REMARK 465 LEU A 4
REMARK 465 VAL A 5
REMARK 465 LEU A 6
REMARK 465 LEU A 7
REMARK 465 MET A 8
REMARK 465 LEU A 9
REMARK 465 VAL A 10
REMARK 465 LEU A 11
REMARK 465 LEU A 12
REMARK 465 LEU A 13
REMARK 465 VAL A 14
REMARK 465 TYR A 15
REMARK 465 PRO A 16
REMARK 465 HIS A 17
REMARK 465 VAL A 18
REMARK 465 SER A 19
REMARK 465 LYS A 20
REMARK 465 ALA A 21
REMARK 465 GLY A 22
REMARK 465 GLY A 23
REMARK 465 PHE A 24
REMARK 465 LYS A 25
REMARK 465 GLY A 26
REMARK 465 GLY A 27
REMARK 465 GLY A 28
REMARK 465 GLN A 274
REMARK 465 ALA A 275
REMARK 465 ASN A 276
REMARK 465 ALA A 277
REMARK 465 ASN A 278
REMARK 465 GLU A 279
REMARK 465 THR A 280
REMARK 465 ALA A 281
REMARK 465 ALA A 282
REMARK 465 THR A 283
REMARK 465 LYS A 284
REMARK 465 GLU A 285
REMARK 465 ASN A 286
REMARK 465 LEU A 287
REMARK 465 SER A 288
REMARK 465 TYR A 289
REMARK 465 PRO A 290
REMARK 465 PHE A 291
REMARK 465 ILE A 292
REMARK 465 ARG A 293
REMARK 465 GLY A 294
REMARK 465 GLY A 295
REMARK 465 GLU A 296
REMARK 465 ASN A 297
REMARK 465 HIS A 298
REMARK 465 GLY A 299
REMARK 465 LEU A 300
REMARK 465 ARG A 301
REMARK 465 GLU A 302
REMARK 465 GLU A 303
REMARK 465 GLU A 304
REMARK 465 PHE A 305
REMARK 465 ALA A 306
REMARK 465 VAL A 307
REMARK 465 GLU A 308
REMARK 465 LYS A 309
REMARK 465 GLY A 310
REMARK 465 VAL A 311
REMARK 465 LYS A 312
REMARK 465 GLU A 313
REMARK 465 ILE A 314
REMARK 465 THR A 315
REMARK 465 VAL A 316
REMARK 465 HIS A 317
REMARK 465 TRP A 318
REMARK 465 LEU A 319
REMARK 465 SER A 320
REMARK 465 ASN A 321
REMARK 465 HIS A 322
REMARK 465 SER A 323
REMARK 465 SER A 324
REMARK 465 GLY A 325
REMARK 465 ASN A 326
REMARK 465 ILE A 327
REMARK 465 LYS A 328
REMARK 465 LEU A 329
REMARK 465 THR A 330
REMARK 465 ASP A 331
REMARK 465 PRO A 332
REMARK 465 ARG A 333
REMARK 465 GLY A 334
REMARK 465 LYS A 335
REMARK 465 PRO A 336
REMARK 465 PHE A 337
REMARK 465 LYS A 338
REMARK 465 ASP A 339
REMARK 465 PHE A 340
REMARK 465 SER A 341
REMARK 465 ILE A 342
REMARK 465 ALA A 343
REMARK 465 LYS A 344
REMARK 465 THR A 345
REMARK 465 ALA A 346
REMARK 465 ASP A 347
REMARK 465 VAL A 348
REMARK 465 PHE A 349
REMARK 465 GLU A 350
REMARK 465 GLY A 351
REMARK 465 GLY A 352
REMARK 465 PHE A 353
REMARK 465 VAL A 354
REMARK 465 HIS A 355
REMARK 465 SER A 356
REMARK 465 ALA A 357
REMARK 465 ALA A 358
REMARK 465 ILE A 359
REMARK 465 LYS A 360
REMARK 465 ASN A 361
REMARK 465 PRO A 362
REMARK 465 ALA A 363
REMARK 465 ALA A 364
REMARK 465 GLY A 365
REMARK 465 THR A 366
REMARK 465 TRP A 367
REMARK 465 LYS A 368
REMARK 465 ILE A 369
REMARK 465 ALA A 370
REMARK 465 SER A 371
REMARK 465 SER A 372
REMARK 465 VAL A 373
REMARK 465 LYS A 374
REMARK 465 GLN A 375
REMARK 465 LYS A 376
REMARK 465 GLU A 377
REMARK 465 ALA A 378
REMARK 465 PHE A 379
REMARK 465 LEU A 380
REMARK 465 PHE A 381
REMARK 465 ILE A 382
REMARK 465 VAL A 383
REMARK 465 THR A 384
REMARK 465 PHE A 385
REMARK 465 ASP A 386
REMARK 465 SER A 387
REMARK 465 PRO A 388
REMARK 465 LEU A 389
REMARK 465 ASN A 390
REMARK 465 GLN A 391
REMARK 465 GLN A 392
REMARK 465 ILE A 393
REMARK 465 LYS A 394
REMARK 465 ASN A 395
REMARK 465 ALA A 396
REMARK 465 VAL A 397
REMARK 465 THR A 398
REMARK 465 ARG A 399
REMARK 465 GLU A 400
REMARK 465 SER A 401
REMARK 465 SER A 402
REMARK 465 ASN A 403
REMARK 465 LEU A 404
REMARK 465 ALA A 405
REMARK 465 ASN A 406
REMARK 465 VAL A 407
REMARK 465 LYS A 408
REMARK 465 ALA A 409
REMARK 465 SER A 410
REMARK 465 VAL A 411
REMARK 465 ARG A 412
REMARK 465 SER A 413
REMARK 465 ILE A 414
REMARK 465 ARG A 415
REMARK 465 TYR A 416
REMARK 465 GLU A 417
REMARK 465 ASN A 418
REMARK 465 GLY A 419
REMARK 465 LYS A 420
REMARK 465 GLN A 421
REMARK 465 ALA A 422
REMARK 465 GLU A 423
REMARK 465 LYS A 424
REMARK 465 LYS A 425
REMARK 465 SER A 426
REMARK 465 LEU A 427
REMARK 465 LYS A 428
REMARK 465 PRO A 429
REMARK 465 ALA A 430
REMARK 465 SER A 431
REMARK 465 ILE A 432
REMARK 465 ASN A 433
REMARK 465 ALA A 434
REMARK 465 LEU A 435
REMARK 465 GLN A 436
REMARK 465 ASN A 437
REMARK 465 SER A 438
REMARK 465 LEU A 439
REMARK 465 SER A 440
REMARK 465 PHE A 441
REMARK 465 LYS A 442
REMARK 465 LYS A 443
REMARK 465 ALA A 444
REMARK 465 GLY A 445
REMARK 465 MET A 446
REMARK 465 TYR A 447
REMARK 465 SER A 448
REMARK 465 VAL A 449
REMARK 465 THR A 450
REMARK 465 ILE A 451
REMARK 465 ASP A 452
REMARK 465 LEU A 453
REMARK 465 SER A 454
REMARK 465 GLY A 455
REMARK 465 LYS A 456
REMARK 465 THR A 457
REMARK 465 ALA A 458
REMARK 465 ASP A 459
REMARK 465 ASN A 460
REMARK 465 SER A 461
REMARK 465 PRO A 462
REMARK 465 PHE A 463
REMARK 465 ASN A 464
REMARK 465 ARG A 465
REMARK 465 THR A 466
REMARK 465 ILE A 467
REMARK 465 ILE A 468
REMARK 465 ARG A 469
REMARK 465 SER A 470
REMARK 465 ILE A 471
REMARK 465 TYR A 472
REMARK 465 VAL A 473
REMARK 465 ASN A 474
REMARK 465 ASP A 475
REMARK 465 LYS A 476
REMARK 465 GLY A 477
REMARK 465 GLU A 478
REMARK 465 LYS A 479
REMARK 465 PHE A 480
REMARK 465 GLU A 481
REMARK 465 ASN A 482
REMARK 465 SER A 483
REMARK 465 PRO A 484
REMARK 465 LEU A 485
REMARK 465 SER A 486
REMARK 465 ASP A 487
REMARK 465 MET B 1
REMARK 465 LYS B 2
REMARK 465 LYS B 3
REMARK 465 LEU B 4
REMARK 465 VAL B 5
REMARK 465 LEU B 6
REMARK 465 LEU B 7
REMARK 465 MET B 8
REMARK 465 LEU B 9
REMARK 465 VAL B 10
REMARK 465 LEU B 11
REMARK 465 LEU B 12
REMARK 465 LEU B 13
REMARK 465 VAL B 14
REMARK 465 TYR B 15
REMARK 465 PRO B 16
REMARK 465 HIS B 17
REMARK 465 VAL B 18
REMARK 465 SER B 19
REMARK 465 LYS B 20
REMARK 465 ALA B 21
REMARK 465 GLY B 22
REMARK 465 GLY B 23
REMARK 465 PHE B 24
REMARK 465 LYS B 25
REMARK 465 GLY B 26
REMARK 465 GLY B 27
REMARK 465 GLY B 28
REMARK 465 GLN B 274
REMARK 465 ALA B 275
REMARK 465 ASN B 276
REMARK 465 ALA B 277
REMARK 465 ASN B 278
REMARK 465 GLU B 279
REMARK 465 THR B 280
REMARK 465 ALA B 281
REMARK 465 ALA B 282
REMARK 465 THR B 283
REMARK 465 LYS B 284
REMARK 465 GLU B 285
REMARK 465 ASN B 286
REMARK 465 LEU B 287
REMARK 465 SER B 288
REMARK 465 TYR B 289
REMARK 465 PRO B 290
REMARK 465 PHE B 291
REMARK 465 ILE B 292
REMARK 465 ARG B 293
REMARK 465 GLY B 294
REMARK 465 GLY B 295
REMARK 465 GLU B 296
REMARK 465 ASN B 297
REMARK 465 HIS B 298
REMARK 465 GLY B 299
REMARK 465 LEU B 300
REMARK 465 ARG B 301
REMARK 465 GLU B 302
REMARK 465 GLU B 303
REMARK 465 GLU B 304
REMARK 465 PHE B 305
REMARK 465 ALA B 306
REMARK 465 VAL B 307
REMARK 465 GLU B 308
REMARK 465 LYS B 309
REMARK 465 GLY B 310
REMARK 465 VAL B 311
REMARK 465 LYS B 312
REMARK 465 GLU B 313
REMARK 465 ILE B 314
REMARK 465 THR B 315
REMARK 465 VAL B 316
REMARK 465 HIS B 317
REMARK 465 TRP B 318
REMARK 465 LEU B 319
REMARK 465 SER B 320
REMARK 465 ASN B 321
REMARK 465 HIS B 322
REMARK 465 SER B 323
REMARK 465 SER B 324
REMARK 465 GLY B 325
REMARK 465 ASN B 326
REMARK 465 ILE B 327
REMARK 465 LYS B 328
REMARK 465 LEU B 329
REMARK 465 THR B 330
REMARK 465 ASP B 331
REMARK 465 PRO B 332
REMARK 465 ARG B 333
REMARK 465 GLY B 334
REMARK 465 LYS B 335
REMARK 465 PRO B 336
REMARK 465 PHE B 337
REMARK 465 LYS B 338
REMARK 465 ASP B 339
REMARK 465 PHE B 340
REMARK 465 SER B 341
REMARK 465 ILE B 342
REMARK 465 ALA B 343
REMARK 465 LYS B 344
REMARK 465 THR B 345
REMARK 465 ALA B 346
REMARK 465 ASP B 347
REMARK 465 VAL B 348
REMARK 465 PHE B 349
REMARK 465 GLU B 350
REMARK 465 GLY B 351
REMARK 465 GLY B 352
REMARK 465 PHE B 353
REMARK 465 VAL B 354
REMARK 465 HIS B 355
REMARK 465 SER B 356
REMARK 465 ALA B 357
REMARK 465 ALA B 358
REMARK 465 ILE B 359
REMARK 465 LYS B 360
REMARK 465 ASN B 361
REMARK 465 PRO B 362
REMARK 465 ALA B 363
REMARK 465 ALA B 364
REMARK 465 GLY B 365
REMARK 465 THR B 366
REMARK 465 TRP B 367
REMARK 465 LYS B 368
REMARK 465 ILE B 369
REMARK 465 ALA B 370
REMARK 465 SER B 371
REMARK 465 SER B 372
REMARK 465 VAL B 373
REMARK 465 LYS B 374
REMARK 465 GLN B 375
REMARK 465 LYS B 376
REMARK 465 GLU B 377
REMARK 465 ALA B 378
REMARK 465 PHE B 379
REMARK 465 LEU B 380
REMARK 465 PHE B 381
REMARK 465 ILE B 382
REMARK 465 VAL B 383
REMARK 465 THR B 384
REMARK 465 PHE B 385
REMARK 465 ASP B 386
REMARK 465 SER B 387
REMARK 465 PRO B 388
REMARK 465 LEU B 389
REMARK 465 ASN B 390
REMARK 465 GLN B 391
REMARK 465 GLN B 392
REMARK 465 ILE B 393
REMARK 465 LYS B 394
REMARK 465 ASN B 395
REMARK 465 ALA B 396
REMARK 465 VAL B 397
REMARK 465 THR B 398
REMARK 465 ARG B 399
REMARK 465 GLU B 400
REMARK 465 SER B 401
REMARK 465 SER B 402
REMARK 465 ASN B 403
REMARK 465 LEU B 404
REMARK 465 ALA B 405
REMARK 465 ASN B 406
REMARK 465 VAL B 407
REMARK 465 LYS B 408
REMARK 465 ALA B 409
REMARK 465 SER B 410
REMARK 465 VAL B 411
REMARK 465 ARG B 412
REMARK 465 SER B 413
REMARK 465 ILE B 414
REMARK 465 ARG B 415
REMARK 465 TYR B 416
REMARK 465 GLU B 417
REMARK 465 ASN B 418
REMARK 465 GLY B 419
REMARK 465 LYS B 420
REMARK 465 GLN B 421
REMARK 465 ALA B 422
REMARK 465 GLU B 423
REMARK 465 LYS B 424
REMARK 465 LYS B 425
REMARK 465 SER B 426
REMARK 465 LEU B 427
REMARK 465 LYS B 428
REMARK 465 PRO B 429
REMARK 465 ALA B 430
REMARK 465 SER B 431
REMARK 465 ILE B 432
REMARK 465 ASN B 433
REMARK 465 ALA B 434
REMARK 465 LEU B 435
REMARK 465 GLN B 436
REMARK 465 ASN B 437
REMARK 465 SER B 438
REMARK 465 LEU B 439
REMARK 465 SER B 440
REMARK 465 PHE B 441
REMARK 465 LYS B 442
REMARK 465 LYS B 443
REMARK 465 ALA B 444
REMARK 465 GLY B 445
REMARK 465 MET B 446
REMARK 465 TYR B 447
REMARK 465 SER B 448
REMARK 465 VAL B 449
REMARK 465 THR B 450
REMARK 465 ILE B 451
REMARK 465 ASP B 452
REMARK 465 LEU B 453
REMARK 465 SER B 454
REMARK 465 GLY B 455
REMARK 465 LYS B 456
REMARK 465 THR B 457
REMARK 465 ALA B 458
REMARK 465 ASP B 459
REMARK 465 ASN B 460
REMARK 465 SER B 461
REMARK 465 PRO B 462
REMARK 465 PHE B 463
REMARK 465 ASN B 464
REMARK 465 ARG B 465
REMARK 465 THR B 466
REMARK 465 ILE B 467
REMARK 465 ILE B 468
REMARK 465 ARG B 469
REMARK 465 SER B 470
REMARK 465 ILE B 471
REMARK 465 TYR B 472
REMARK 465 VAL B 473
REMARK 465 ASN B 474
REMARK 465 ASP B 475
REMARK 465 LYS B 476
REMARK 465 GLY B 477
REMARK 465 GLU B 478
REMARK 465 LYS B 479
REMARK 465 PHE B 480
REMARK 465 GLU B 481
REMARK 465 ASN B 482
REMARK 465 SER B 483
REMARK 465 PRO B 484
REMARK 465 LEU B 485
REMARK 465 SER B 486
REMARK 465 ASP B 487
REMARK 465 MET C 1
REMARK 465 LYS C 2
REMARK 465 LYS C 3
REMARK 465 LEU C 4
REMARK 465 VAL C 5
REMARK 465 LEU C 6
REMARK 465 LEU C 7
REMARK 465 MET C 8
REMARK 465 LEU C 9
REMARK 465 VAL C 10
REMARK 465 LEU C 11
REMARK 465 LEU C 12
REMARK 465 LEU C 13
REMARK 465 VAL C 14
REMARK 465 TYR C 15
REMARK 465 PRO C 16
REMARK 465 HIS C 17
REMARK 465 VAL C 18
REMARK 465 SER C 19
REMARK 465 LYS C 20
REMARK 465 ALA C 21
REMARK 465 GLY C 22
REMARK 465 GLY C 23
REMARK 465 PHE C 24
REMARK 465 LYS C 25
REMARK 465 GLY C 26
REMARK 465 GLY C 27
REMARK 465 GLY C 28
REMARK 465 GLN C 274
REMARK 465 ALA C 275
REMARK 465 ASN C 276
REMARK 465 ALA C 277
REMARK 465 ASN C 278
REMARK 465 GLU C 279
REMARK 465 THR C 280
REMARK 465 ALA C 281
REMARK 465 ALA C 282
REMARK 465 THR C 283
REMARK 465 LYS C 284
REMARK 465 GLU C 285
REMARK 465 ASN C 286
REMARK 465 LEU C 287
REMARK 465 SER C 288
REMARK 465 TYR C 289
REMARK 465 PRO C 290
REMARK 465 PHE C 291
REMARK 465 ILE C 292
REMARK 465 ARG C 293
REMARK 465 GLY C 294
REMARK 465 GLY C 295
REMARK 465 GLU C 296
REMARK 465 ASN C 297
REMARK 465 HIS C 298
REMARK 465 GLY C 299
REMARK 465 LEU C 300
REMARK 465 ARG C 301
REMARK 465 GLU C 302
REMARK 465 GLU C 303
REMARK 465 GLU C 304
REMARK 465 PHE C 305
REMARK 465 ALA C 306
REMARK 465 VAL C 307
REMARK 465 GLU C 308
REMARK 465 LYS C 309
REMARK 465 GLY C 310
REMARK 465 VAL C 311
REMARK 465 LYS C 312
REMARK 465 GLU C 313
REMARK 465 ILE C 314
REMARK 465 THR C 315
REMARK 465 VAL C 316
REMARK 465 HIS C 317
REMARK 465 TRP C 318
REMARK 465 LEU C 319
REMARK 465 SER C 320
REMARK 465 ASN C 321
REMARK 465 HIS C 322
REMARK 465 SER C 323
REMARK 465 SER C 324
REMARK 465 GLY C 325
REMARK 465 ASN C 326
REMARK 465 ILE C 327
REMARK 465 LYS C 328
REMARK 465 LEU C 329
REMARK 465 THR C 330
REMARK 465 ASP C 331
REMARK 465 PRO C 332
REMARK 465 ARG C 333
REMARK 465 GLY C 334
REMARK 465 LYS C 335
REMARK 465 PRO C 336
REMARK 465 PHE C 337
REMARK 465 LYS C 338
REMARK 465 ASP C 339
REMARK 465 PHE C 340
REMARK 465 SER C 341
REMARK 465 ILE C 342
REMARK 465 ALA C 343
REMARK 465 LYS C 344
REMARK 465 THR C 345
REMARK 465 ALA C 346
REMARK 465 ASP C 347
REMARK 465 VAL C 348
REMARK 465 PHE C 349
REMARK 465 GLU C 350
REMARK 465 GLY C 351
REMARK 465 GLY C 352
REMARK 465 PHE C 353
REMARK 465 VAL C 354
REMARK 465 HIS C 355
REMARK 465 SER C 356
REMARK 465 ALA C 357
REMARK 465 ALA C 358
REMARK 465 ILE C 359
REMARK 465 LYS C 360
REMARK 465 ASN C 361
REMARK 465 PRO C 362
REMARK 465 ALA C 363
REMARK 465 ALA C 364
REMARK 465 GLY C 365
REMARK 465 THR C 366
REMARK 465 TRP C 367
REMARK 465 LYS C 368
REMARK 465 ILE C 369
REMARK 465 ALA C 370
REMARK 465 SER C 371
REMARK 465 SER C 372
REMARK 465 VAL C 373
REMARK 465 LYS C 374
REMARK 465 GLN C 375
REMARK 465 LYS C 376
REMARK 465 GLU C 377
REMARK 465 ALA C 378
REMARK 465 PHE C 379
REMARK 465 LEU C 380
REMARK 465 PHE C 381
REMARK 465 ILE C 382
REMARK 465 VAL C 383
REMARK 465 THR C 384
REMARK 465 PHE C 385
REMARK 465 ASP C 386
REMARK 465 SER C 387
REMARK 465 PRO C 388
REMARK 465 LEU C 389
REMARK 465 ASN C 390
REMARK 465 GLN C 391
REMARK 465 GLN C 392
REMARK 465 ILE C 393
REMARK 465 LYS C 394
REMARK 465 ASN C 395
REMARK 465 ALA C 396
REMARK 465 VAL C 397
REMARK 465 THR C 398
REMARK 465 ARG C 399
REMARK 465 GLU C 400
REMARK 465 SER C 401
REMARK 465 SER C 402
REMARK 465 ASN C 403
REMARK 465 LEU C 404
REMARK 465 ALA C 405
REMARK 465 ASN C 406
REMARK 465 VAL C 407
REMARK 465 LYS C 408
REMARK 465 ALA C 409
REMARK 465 SER C 410
REMARK 465 VAL C 411
REMARK 465 ARG C 412
REMARK 465 SER C 413
REMARK 465 ILE C 414
REMARK 465 ARG C 415
REMARK 465 TYR C 416
REMARK 465 GLU C 417
REMARK 465 ASN C 418
REMARK 465 GLY C 419
REMARK 465 LYS C 420
REMARK 465 GLN C 421
REMARK 465 ALA C 422
REMARK 465 GLU C 423
REMARK 465 LYS C 424
REMARK 465 LYS C 425
REMARK 465 SER C 426
REMARK 465 LEU C 427
REMARK 465 LYS C 428
REMARK 465 PRO C 429
REMARK 465 ALA C 430
REMARK 465 SER C 431
REMARK 465 ILE C 432
REMARK 465 ASN C 433
REMARK 465 ALA C 434
REMARK 465 LEU C 435
REMARK 465 GLN C 436
REMARK 465 ASN C 437
REMARK 465 SER C 438
REMARK 465 LEU C 439
REMARK 465 SER C 440
REMARK 465 PHE C 441
REMARK 465 LYS C 442
REMARK 465 LYS C 443
REMARK 465 ALA C 444
REMARK 465 GLY C 445
REMARK 465 MET C 446
REMARK 465 TYR C 447
REMARK 465 SER C 448
REMARK 465 VAL C 449
REMARK 465 THR C 450
REMARK 465 ILE C 451
REMARK 465 ASP C 452
REMARK 465 LEU C 453
REMARK 465 SER C 454
REMARK 465 GLY C 455
REMARK 465 LYS C 456
REMARK 465 THR C 457
REMARK 465 ALA C 458
REMARK 465 ASP C 459
REMARK 465 ASN C 460
REMARK 465 SER C 461
REMARK 465 PRO C 462
REMARK 465 PHE C 463
REMARK 465 ASN C 464
REMARK 465 ARG C 465
REMARK 465 THR C 466
REMARK 465 ILE C 467
REMARK 465 ILE C 468
REMARK 465 ARG C 469
REMARK 465 SER C 470
REMARK 465 ILE C 471
REMARK 465 TYR C 472
REMARK 465 VAL C 473
REMARK 465 ASN C 474
REMARK 465 ASP C 475
REMARK 465 LYS C 476
REMARK 465 GLY C 477
REMARK 465 GLU C 478
REMARK 465 LYS C 479
REMARK 465 PHE C 480
REMARK 465 GLU C 481
REMARK 465 ASN C 482
REMARK 465 SER C 483
REMARK 465 PRO C 484
REMARK 465 LEU C 485
REMARK 465 SER C 486
REMARK 465 ASP C 487
REMARK 465 MET D 1
REMARK 465 LYS D 2
REMARK 465 LYS D 3
REMARK 465 LEU D 4
REMARK 465 VAL D 5
REMARK 465 LEU D 6
REMARK 465 LEU D 7
REMARK 465 MET D 8
REMARK 465 LEU D 9
REMARK 465 VAL D 10
REMARK 465 LEU D 11
REMARK 465 LEU D 12
REMARK 465 LEU D 13
REMARK 465 VAL D 14
REMARK 465 TYR D 15
REMARK 465 PRO D 16
REMARK 465 HIS D 17
REMARK 465 VAL D 18
REMARK 465 SER D 19
REMARK 465 LYS D 20
REMARK 465 ALA D 21
REMARK 465 GLY D 22
REMARK 465 GLY D 23
REMARK 465 PHE D 24
REMARK 465 LYS D 25
REMARK 465 GLY D 26
REMARK 465 GLY D 27
REMARK 465 GLY D 28
REMARK 465 GLN D 274
REMARK 465 ALA D 275
REMARK 465 ASN D 276
REMARK 465 ALA D 277
REMARK 465 ASN D 278
REMARK 465 GLU D 279
REMARK 465 THR D 280
REMARK 465 ALA D 281
REMARK 465 ALA D 282
REMARK 465 THR D 283
REMARK 465 LYS D 284
REMARK 465 GLU D 285
REMARK 465 ASN D 286
REMARK 465 LEU D 287
REMARK 465 SER D 288
REMARK 465 TYR D 289
REMARK 465 PRO D 290
REMARK 465 PHE D 291
REMARK 465 ILE D 292
REMARK 465 ARG D 293
REMARK 465 GLY D 294
REMARK 465 GLY D 295
REMARK 465 GLU D 296
REMARK 465 ASN D 297
REMARK 465 HIS D 298
REMARK 465 GLY D 299
REMARK 465 LEU D 300
REMARK 465 ARG D 301
REMARK 465 GLU D 302
REMARK 465 GLU D 303
REMARK 465 GLU D 304
REMARK 465 PHE D 305
REMARK 465 ALA D 306
REMARK 465 VAL D 307
REMARK 465 GLU D 308
REMARK 465 LYS D 309
REMARK 465 GLY D 310
REMARK 465 VAL D 311
REMARK 465 LYS D 312
REMARK 465 GLU D 313
REMARK 465 ILE D 314
REMARK 465 THR D 315
REMARK 465 VAL D 316
REMARK 465 HIS D 317
REMARK 465 TRP D 318
REMARK 465 LEU D 319
REMARK 465 SER D 320
REMARK 465 ASN D 321
REMARK 465 HIS D 322
REMARK 465 SER D 323
REMARK 465 SER D 324
REMARK 465 GLY D 325
REMARK 465 ASN D 326
REMARK 465 ILE D 327
REMARK 465 LYS D 328
REMARK 465 LEU D 329
REMARK 465 THR D 330
REMARK 465 ASP D 331
REMARK 465 PRO D 332
REMARK 465 ARG D 333
REMARK 465 GLY D 334
REMARK 465 LYS D 335
REMARK 465 PRO D 336
REMARK 465 PHE D 337
REMARK 465 LYS D 338
REMARK 465 ASP D 339
REMARK 465 PHE D 340
REMARK 465 SER D 341
REMARK 465 ILE D 342
REMARK 465 ALA D 343
REMARK 465 LYS D 344
REMARK 465 THR D 345
REMARK 465 ALA D 346
REMARK 465 ASP D 347
REMARK 465 VAL D 348
REMARK 465 PHE D 349
REMARK 465 GLU D 350
REMARK 465 GLY D 351
REMARK 465 GLY D 352
REMARK 465 PHE D 353
REMARK 465 VAL D 354
REMARK 465 HIS D 355
REMARK 465 SER D 356
REMARK 465 ALA D 357
REMARK 465 ALA D 358
REMARK 465 ILE D 359
REMARK 465 LYS D 360
REMARK 465 ASN D 361
REMARK 465 PRO D 362
REMARK 465 ALA D 363
REMARK 465 ALA D 364
REMARK 465 GLY D 365
REMARK 465 THR D 366
REMARK 465 TRP D 367
REMARK 465 LYS D 368
REMARK 465 ILE D 369
REMARK 465 ALA D 370
REMARK 465 SER D 371
REMARK 465 SER D 372
REMARK 465 VAL D 373
REMARK 465 LYS D 374
REMARK 465 GLN D 375
REMARK 465 LYS D 376
REMARK 465 GLU D 377
REMARK 465 ALA D 378
REMARK 465 PHE D 379
REMARK 465 LEU D 380
REMARK 465 PHE D 381
REMARK 465 ILE D 382
REMARK 465 VAL D 383
REMARK 465 THR D 384
REMARK 465 PHE D 385
REMARK 465 ASP D 386
REMARK 465 SER D 387
REMARK 465 PRO D 388
REMARK 465 LEU D 389
REMARK 465 ASN D 390
REMARK 465 GLN D 391
REMARK 465 GLN D 392
REMARK 465 ILE D 393
REMARK 465 LYS D 394
REMARK 465 ASN D 395
REMARK 465 ALA D 396
REMARK 465 VAL D 397
REMARK 465 THR D 398
REMARK 465 ARG D 399
REMARK 465 GLU D 400
REMARK 465 SER D 401
REMARK 465 SER D 402
REMARK 465 ASN D 403
REMARK 465 LEU D 404
REMARK 465 ALA D 405
REMARK 465 ASN D 406
REMARK 465 VAL D 407
REMARK 465 LYS D 408
REMARK 465 ALA D 409
REMARK 465 SER D 410
REMARK 465 VAL D 411
REMARK 465 ARG D 412
REMARK 465 SER D 413
REMARK 465 ILE D 414
REMARK 465 ARG D 415
REMARK 465 TYR D 416
REMARK 465 GLU D 417
REMARK 465 ASN D 418
REMARK 465 GLY D 419
REMARK 465 LYS D 420
REMARK 465 GLN D 421
REMARK 465 ALA D 422
REMARK 465 GLU D 423
REMARK 465 LYS D 424
REMARK 465 LYS D 425
REMARK 465 SER D 426
REMARK 465 LEU D 427
REMARK 465 LYS D 428
REMARK 465 PRO D 429
REMARK 465 ALA D 430
REMARK 465 SER D 431
REMARK 465 ILE D 432
REMARK 465 ASN D 433
REMARK 465 ALA D 434
REMARK 465 LEU D 435
REMARK 465 GLN D 436
REMARK 465 ASN D 437
REMARK 465 SER D 438
REMARK 465 LEU D 439
REMARK 465 SER D 440
REMARK 465 PHE D 441
REMARK 465 LYS D 442
REMARK 465 LYS D 443
REMARK 465 ALA D 444
REMARK 465 GLY D 445
REMARK 465 MET D 446
REMARK 465 TYR D 447
REMARK 465 SER D 448
REMARK 465 VAL D 449
REMARK 465 THR D 450
REMARK 465 ILE D 451
REMARK 465 ASP D 452
REMARK 465 LEU D 453
REMARK 465 SER D 454
REMARK 465 GLY D 455
REMARK 465 LYS D 456
REMARK 465 THR D 457
REMARK 465 ALA D 458
REMARK 465 ASP D 459
REMARK 465 ASN D 460
REMARK 465 SER D 461
REMARK 465 PRO D 462
REMARK 465 PHE D 463
REMARK 465 ASN D 464
REMARK 465 ARG D 465
REMARK 465 THR D 466
REMARK 465 ILE D 467
REMARK 465 ILE D 468
REMARK 465 ARG D 469
REMARK 465 SER D 470
REMARK 465 ILE D 471
REMARK 465 TYR D 472
REMARK 465 VAL D 473
REMARK 465 ASN D 474
REMARK 465 ASP D 475
REMARK 465 LYS D 476
REMARK 465 GLY D 477
REMARK 465 GLU D 478
REMARK 465 LYS D 479
REMARK 465 PHE D 480
REMARK 465 GLU D 481
REMARK 465 ASN D 482
REMARK 465 SER D 483
REMARK 465 PRO D 484
REMARK 465 LEU D 485
REMARK 465 SER D 486
REMARK 465 ASP D 487
REMARK 465 MET E 1
REMARK 465 LYS E 2
REMARK 465 LYS E 3
REMARK 465 LEU E 4
REMARK 465 VAL E 5
REMARK 465 LEU E 6
REMARK 465 LEU E 7
REMARK 465 MET E 8
REMARK 465 LEU E 9
REMARK 465 VAL E 10
REMARK 465 LEU E 11
REMARK 465 LEU E 12
REMARK 465 LEU E 13
REMARK 465 VAL E 14
REMARK 465 TYR E 15
REMARK 465 PRO E 16
REMARK 465 HIS E 17
REMARK 465 VAL E 18
REMARK 465 SER E 19
REMARK 465 LYS E 20
REMARK 465 ALA E 21
REMARK 465 GLY E 22
REMARK 465 GLY E 23
REMARK 465 PHE E 24
REMARK 465 LYS E 25
REMARK 465 GLY E 26
REMARK 465 GLY E 27
REMARK 465 GLY E 28
REMARK 465 GLN E 274
REMARK 465 ALA E 275
REMARK 465 ASN E 276
REMARK 465 ALA E 277
REMARK 465 ASN E 278
REMARK 465 GLU E 279
REMARK 465 THR E 280
REMARK 465 ALA E 281
REMARK 465 ALA E 282
REMARK 465 THR E 283
REMARK 465 LYS E 284
REMARK 465 GLU E 285
REMARK 465 ASN E 286
REMARK 465 LEU E 287
REMARK 465 SER E 288
REMARK 465 TYR E 289
REMARK 465 PRO E 290
REMARK 465 PHE E 291
REMARK 465 ILE E 292
REMARK 465 ARG E 293
REMARK 465 GLY E 294
REMARK 465 GLY E 295
REMARK 465 GLU E 296
REMARK 465 ASN E 297
REMARK 465 HIS E 298
REMARK 465 GLY E 299
REMARK 465 LEU E 300
REMARK 465 ARG E 301
REMARK 465 GLU E 302
REMARK 465 GLU E 303
REMARK 465 GLU E 304
REMARK 465 PHE E 305
REMARK 465 ALA E 306
REMARK 465 VAL E 307
REMARK 465 GLU E 308
REMARK 465 LYS E 309
REMARK 465 GLY E 310
REMARK 465 VAL E 311
REMARK 465 LYS E 312
REMARK 465 GLU E 313
REMARK 465 ILE E 314
REMARK 465 THR E 315
REMARK 465 VAL E 316
REMARK 465 HIS E 317
REMARK 465 TRP E 318
REMARK 465 LEU E 319
REMARK 465 SER E 320
REMARK 465 ASN E 321
REMARK 465 HIS E 322
REMARK 465 SER E 323
REMARK 465 SER E 324
REMARK 465 GLY E 325
REMARK 465 ASN E 326
REMARK 465 ILE E 327
REMARK 465 LYS E 328
REMARK 465 LEU E 329
REMARK 465 THR E 330
REMARK 465 ASP E 331
REMARK 465 PRO E 332
REMARK 465 ARG E 333
REMARK 465 GLY E 334
REMARK 465 LYS E 335
REMARK 465 PRO E 336
REMARK 465 PHE E 337
REMARK 465 LYS E 338
REMARK 465 ASP E 339
REMARK 465 PHE E 340
REMARK 465 SER E 341
REMARK 465 ILE E 342
REMARK 465 ALA E 343
REMARK 465 LYS E 344
REMARK 465 THR E 345
REMARK 465 ALA E 346
REMARK 465 ASP E 347
REMARK 465 VAL E 348
REMARK 465 PHE E 349
REMARK 465 GLU E 350
REMARK 465 GLY E 351
REMARK 465 GLY E 352
REMARK 465 PHE E 353
REMARK 465 VAL E 354
REMARK 465 HIS E 355
REMARK 465 SER E 356
REMARK 465 ALA E 357
REMARK 465 ALA E 358
REMARK 465 ILE E 359
REMARK 465 LYS E 360
REMARK 465 ASN E 361
REMARK 465 PRO E 362
REMARK 465 ALA E 363
REMARK 465 ALA E 364
REMARK 465 GLY E 365
REMARK 465 THR E 366
REMARK 465 TRP E 367
REMARK 465 LYS E 368
REMARK 465 ILE E 369
REMARK 465 ALA E 370
REMARK 465 SER E 371
REMARK 465 SER E 372
REMARK 465 VAL E 373
REMARK 465 LYS E 374
REMARK 465 GLN E 375
REMARK 465 LYS E 376
REMARK 465 GLU E 377
REMARK 465 ALA E 378
REMARK 465 PHE E 379
REMARK 465 LEU E 380
REMARK 465 PHE E 381
REMARK 465 ILE E 382
REMARK 465 VAL E 383
REMARK 465 THR E 384
REMARK 465 PHE E 385
REMARK 465 ASP E 386
REMARK 465 SER E 387
REMARK 465 PRO E 388
REMARK 465 LEU E 389
REMARK 465 ASN E 390
REMARK 465 GLN E 391
REMARK 465 GLN E 392
REMARK 465 ILE E 393
REMARK 465 LYS E 394
REMARK 465 ASN E 395
REMARK 465 ALA E 396
REMARK 465 VAL E 397
REMARK 465 THR E 398
REMARK 465 ARG E 399
REMARK 465 GLU E 400
REMARK 465 SER E 401
REMARK 465 SER E 402
REMARK 465 ASN E 403
REMARK 465 LEU E 404
REMARK 465 ALA E 405
REMARK 465 ASN E 406
REMARK 465 VAL E 407
REMARK 465 LYS E 408
REMARK 465 ALA E 409
REMARK 465 SER E 410
REMARK 465 VAL E 411
REMARK 465 ARG E 412
REMARK 465 SER E 413
REMARK 465 ILE E 414
REMARK 465 ARG E 415
REMARK 465 TYR E 416
REMARK 465 GLU E 417
REMARK 465 ASN E 418
REMARK 465 GLY E 419
REMARK 465 LYS E 420
REMARK 465 GLN E 421
REMARK 465 ALA E 422
REMARK 465 GLU E 423
REMARK 465 LYS E 424
REMARK 465 LYS E 425
REMARK 465 SER E 426
REMARK 465 LEU E 427
REMARK 465 LYS E 428
REMARK 465 PRO E 429
REMARK 465 ALA E 430
REMARK 465 SER E 431
REMARK 465 ILE E 432
REMARK 465 ASN E 433
REMARK 465 ALA E 434
REMARK 465 LEU E 435
REMARK 465 GLN E 436
REMARK 465 ASN E 437
REMARK 465 SER E 438
REMARK 465 LEU E 439
REMARK 465 SER E 440
REMARK 465 PHE E 441
REMARK 465 LYS E 442
REMARK 465 LYS E 443
REMARK 465 ALA E 444
REMARK 465 GLY E 445
REMARK 465 MET E 446
REMARK 465 TYR E 447
REMARK 465 SER E 448
REMARK 465 VAL E 449
REMARK 465 THR E 450
REMARK 465 ILE E 451
REMARK 465 ASP E 452
REMARK 465 LEU E 453
REMARK 465 SER E 454
REMARK 465 GLY E 455
REMARK 465 LYS E 456
REMARK 465 THR E 457
REMARK 465 ALA E 458
REMARK 465 ASP E 459
REMARK 465 ASN E 460
REMARK 465 SER E 461
REMARK 465 PRO E 462
REMARK 465 PHE E 463
REMARK 465 ASN E 464
REMARK 465 ARG E 465
REMARK 465 THR E 466
REMARK 465 ILE E 467
REMARK 465 ILE E 468
REMARK 465 ARG E 469
REMARK 465 SER E 470
REMARK 465 ILE E 471
REMARK 465 TYR E 472
REMARK 465 VAL E 473
REMARK 465 ASN E 474
REMARK 465 ASP E 475
REMARK 465 LYS E 476
REMARK 465 GLY E 477
REMARK 465 GLU E 478
REMARK 465 LYS E 479
REMARK 465 PHE E 480
REMARK 465 GLU E 481
REMARK 465 ASN E 482
REMARK 465 SER E 483
REMARK 465 PRO E 484
REMARK 465 LEU E 485
REMARK 465 SER E 486
REMARK 465 ASP E 487
REMARK 465 MET F 1
REMARK 465 LYS F 2
REMARK 465 LYS F 3
REMARK 465 LEU F 4
REMARK 465 VAL F 5
REMARK 465 LEU F 6
REMARK 465 LEU F 7
REMARK 465 MET F 8
REMARK 465 LEU F 9
REMARK 465 VAL F 10
REMARK 465 LEU F 11
REMARK 465 LEU F 12
REMARK 465 LEU F 13
REMARK 465 VAL F 14
REMARK 465 TYR F 15
REMARK 465 PRO F 16
REMARK 465 HIS F 17
REMARK 465 VAL F 18
REMARK 465 SER F 19
REMARK 465 LYS F 20
REMARK 465 ALA F 21
REMARK 465 GLY F 22
REMARK 465 GLY F 23
REMARK 465 PHE F 24
REMARK 465 LYS F 25
REMARK 465 GLY F 26
REMARK 465 GLY F 27
REMARK 465 GLY F 28
REMARK 465 GLN F 274
REMARK 465 ALA F 275
REMARK 465 ASN F 276
REMARK 465 ALA F 277
REMARK 465 ASN F 278
REMARK 465 GLU F 279
REMARK 465 THR F 280
REMARK 465 ALA F 281
REMARK 465 ALA F 282
REMARK 465 THR F 283
REMARK 465 LYS F 284
REMARK 465 GLU F 285
REMARK 465 ASN F 286
REMARK 465 LEU F 287
REMARK 465 SER F 288
REMARK 465 TYR F 289
REMARK 465 PRO F 290
REMARK 465 PHE F 291
REMARK 465 ILE F 292
REMARK 465 ARG F 293
REMARK 465 GLY F 294
REMARK 465 GLY F 295
REMARK 465 GLU F 296
REMARK 465 ASN F 297
REMARK 465 HIS F 298
REMARK 465 GLY F 299
REMARK 465 LEU F 300
REMARK 465 ARG F 301
REMARK 465 GLU F 302
REMARK 465 GLU F 303
REMARK 465 GLU F 304
REMARK 465 PHE F 305
REMARK 465 ALA F 306
REMARK 465 VAL F 307
REMARK 465 GLU F 308
REMARK 465 LYS F 309
REMARK 465 GLY F 310
REMARK 465 VAL F 311
REMARK 465 LYS F 312
REMARK 465 GLU F 313
REMARK 465 ILE F 314
REMARK 465 THR F 315
REMARK 465 VAL F 316
REMARK 465 HIS F 317
REMARK 465 TRP F 318
REMARK 465 LEU F 319
REMARK 465 SER F 320
REMARK 465 ASN F 321
REMARK 465 HIS F 322
REMARK 465 SER F 323
REMARK 465 SER F 324
REMARK 465 GLY F 325
REMARK 465 ASN F 326
REMARK 465 ILE F 327
REMARK 465 LYS F 328
REMARK 465 LEU F 329
REMARK 465 THR F 330
REMARK 465 ASP F 331
REMARK 465 PRO F 332
REMARK 465 ARG F 333
REMARK 465 GLY F 334
REMARK 465 LYS F 335
REMARK 465 PRO F 336
REMARK 465 PHE F 337
REMARK 465 LYS F 338
REMARK 465 ASP F 339
REMARK 465 PHE F 340
REMARK 465 SER F 341
REMARK 465 ILE F 342
REMARK 465 ALA F 343
REMARK 465 LYS F 344
REMARK 465 THR F 345
REMARK 465 ALA F 346
REMARK 465 ASP F 347
REMARK 465 VAL F 348
REMARK 465 PHE F 349
REMARK 465 GLU F 350
REMARK 465 GLY F 351
REMARK 465 GLY F 352
REMARK 465 PHE F 353
REMARK 465 VAL F 354
REMARK 465 HIS F 355
REMARK 465 SER F 356
REMARK 465 ALA F 357
REMARK 465 ALA F 358
REMARK 465 ILE F 359
REMARK 465 LYS F 360
REMARK 465 ASN F 361
REMARK 465 PRO F 362
REMARK 465 ALA F 363
REMARK 465 ALA F 364
REMARK 465 GLY F 365
REMARK 465 THR F 366
REMARK 465 TRP F 367
REMARK 465 LYS F 368
REMARK 465 ILE F 369
REMARK 465 ALA F 370
REMARK 465 SER F 371
REMARK 465 SER F 372
REMARK 465 VAL F 373
REMARK 465 LYS F 374
REMARK 465 GLN F 375
REMARK 465 LYS F 376
REMARK 465 GLU F 377
REMARK 465 ALA F 378
REMARK 465 PHE F 379
REMARK 465 LEU F 380
REMARK 465 PHE F 381
REMARK 465 ILE F 382
REMARK 465 VAL F 383
REMARK 465 THR F 384
REMARK 465 PHE F 385
REMARK 465 ASP F 386
REMARK 465 SER F 387
REMARK 465 PRO F 388
REMARK 465 LEU F 389
REMARK 465 ASN F 390
REMARK 465 GLN F 391
REMARK 465 GLN F 392
REMARK 465 ILE F 393
REMARK 465 LYS F 394
REMARK 465 ASN F 395
REMARK 465 ALA F 396
REMARK 465 VAL F 397
REMARK 465 THR F 398
REMARK 465 ARG F 399
REMARK 465 GLU F 400
REMARK 465 SER F 401
REMARK 465 SER F 402
REMARK 465 ASN F 403
REMARK 465 LEU F 404
REMARK 465 ALA F 405
REMARK 465 ASN F 406
REMARK 465 VAL F 407
REMARK 465 LYS F 408
REMARK 465 ALA F 409
REMARK 465 SER F 410
REMARK 465 VAL F 411
REMARK 465 ARG F 412
REMARK 465 SER F 413
REMARK 465 ILE F 414
REMARK 465 ARG F 415
REMARK 465 TYR F 416
REMARK 465 GLU F 417
REMARK 465 ASN F 418
REMARK 465 GLY F 419
REMARK 465 LYS F 420
REMARK 465 GLN F 421
REMARK 465 ALA F 422
REMARK 465 GLU F 423
REMARK 465 LYS F 424
REMARK 465 LYS F 425
REMARK 465 SER F 426
REMARK 465 LEU F 427
REMARK 465 LYS F 428
REMARK 465 PRO F 429
REMARK 465 ALA F 430
REMARK 465 SER F 431
REMARK 465 ILE F 432
REMARK 465 ASN F 433
REMARK 465 ALA F 434
REMARK 465 LEU F 435
REMARK 465 GLN F 436
REMARK 465 ASN F 437
REMARK 465 SER F 438
REMARK 465 LEU F 439
REMARK 465 SER F 440
REMARK 465 PHE F 441
REMARK 465 LYS F 442
REMARK 465 LYS F 443
REMARK 465 ALA F 444
REMARK 465 GLY F 445
REMARK 465 MET F 446
REMARK 465 TYR F 447
REMARK 465 SER F 448
REMARK 465 VAL F 449
REMARK 465 THR F 450
REMARK 465 ILE F 451
REMARK 465 ASP F 452
REMARK 465 LEU F 453
REMARK 465 SER F 454
REMARK 465 GLY F 455
REMARK 465 LYS F 456
REMARK 465 THR F 457
REMARK 465 ALA F 458
REMARK 465 ASP F 459
REMARK 465 ASN F 460
REMARK 465 SER F 461
REMARK 465 PRO F 462
REMARK 465 PHE F 463
REMARK 465 ASN F 464
REMARK 465 ARG F 465
REMARK 465 THR F 466
REMARK 465 ILE F 467
REMARK 465 ILE F 468
REMARK 465 ARG F 469
REMARK 465 SER F 470
REMARK 465 ILE F 471
REMARK 465 TYR F 472
REMARK 465 VAL F 473
REMARK 465 ASN F 474
REMARK 465 ASP F 475
REMARK 465 LYS F 476
REMARK 465 GLY F 477
REMARK 465 GLU F 478
REMARK 465 LYS F 479
REMARK 465 PHE F 480
REMARK 465 GLU F 481
REMARK 465 ASN F 482
REMARK 465 SER F 483
REMARK 465 PRO F 484
REMARK 465 LEU F 485
REMARK 465 SER F 486
REMARK 465 ASP F 487
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 SER A 119 -129.37 50.69
REMARK 500 ALA A 233 -34.00 -136.92
REMARK 500 SER B 119 -126.62 52.67
REMARK 500 ALA B 233 -36.26 -130.32
REMARK 500 ASP C 38 133.75 -38.08
REMARK 500 SER C 119 -121.76 39.04
REMARK 500 ASN C 160 65.36 -160.21
REMARK 500 ALA C 233 -31.55 -145.81
REMARK 500 THR C 249 87.52 -48.61
REMARK 500 ASN D 57 27.36 43.00
REMARK 500 ASP D 90 -179.34 -65.71
REMARK 500 SER D 119 -130.52 42.72
REMARK 500 LEU D 156 21.21 -71.70
REMARK 500 ASN D 160 89.91 -163.99
REMARK 500 TRP D 161 -145.42 -52.87
REMARK 500 ALA D 162 153.94 145.07
REMARK 500 ALA D 233 -36.80 -140.55
REMARK 500 ASP E 90 -179.58 -59.92
REMARK 500 SER E 119 -127.65 44.17
REMARK 500 LYS E 172 128.65 -38.68
REMARK 500 ALA E 233 -38.10 -141.69
REMARK 500 ASP E 248 126.59 -35.40
REMARK 500 PHE F 64 -71.10 -119.13
REMARK 500 SER F 119 -123.48 46.29
REMARK 500 SER F 159 -65.90 -171.70
REMARK 500 LYS F 172 128.09 -38.72
REMARK 500 ALA F 233 -43.29 -143.00
REMARK 500 ASN F 261 -50.77 -27.46
REMARK 500
REMARK 500 REMARK: NULL
REMARK 525
REMARK 525 SOLVENT
REMARK 525
REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT
REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST
REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT
REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE
REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER;
REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE
REMARK 525 NUMBER; I=INSERTION CODE):
REMARK 525
REMARK 525 M RES CSSEQI
REMARK 525 HOH A 541 DISTANCE = 6.46 ANGSTROMS
REMARK 525 HOH A 542 DISTANCE = 6.60 ANGSTROMS
REMARK 525 HOH A 543 DISTANCE = 6.63 ANGSTROMS
REMARK 525 HOH A 544 DISTANCE = 7.32 ANGSTROMS
REMARK 525 HOH A 545 DISTANCE = 7.47 ANGSTROMS
REMARK 525 HOH A 546 DISTANCE = 7.66 ANGSTROMS
REMARK 525 HOH A 547 DISTANCE = 8.34 ANGSTROMS
REMARK 525 HOH A 548 DISTANCE = 8.48 ANGSTROMS
REMARK 525 HOH A 549 DISTANCE = 8.48 ANGSTROMS
REMARK 525 HOH A 550 DISTANCE = 8.61 ANGSTROMS
REMARK 525 HOH A 551 DISTANCE = 8.94 ANGSTROMS
REMARK 525 HOH A 552 DISTANCE = 10.10 ANGSTROMS
REMARK 525 HOH A 553 DISTANCE = 10.24 ANGSTROMS
REMARK 525 HOH A 554 DISTANCE = 11.02 ANGSTROMS
REMARK 525 HOH A 555 DISTANCE = 12.30 ANGSTROMS
REMARK 525 HOH A 556 DISTANCE = 12.81 ANGSTROMS
REMARK 525 HOH A 557 DISTANCE = 14.56 ANGSTROMS
REMARK 525 HOH A 558 DISTANCE = 15.58 ANGSTROMS
REMARK 525 HOH A 559 DISTANCE = 15.75 ANGSTROMS
REMARK 525 HOH B 545 DISTANCE = 6.17 ANGSTROMS
REMARK 525 HOH B 546 DISTANCE = 6.43 ANGSTROMS
REMARK 525 HOH B 547 DISTANCE = 6.66 ANGSTROMS
REMARK 525 HOH B 548 DISTANCE = 6.85 ANGSTROMS
REMARK 525 HOH B 549 DISTANCE = 7.83 ANGSTROMS
REMARK 525 HOH B 550 DISTANCE = 8.13 ANGSTROMS
REMARK 525 HOH B 551 DISTANCE = 9.12 ANGSTROMS
REMARK 525 HOH B 552 DISTANCE = 11.54 ANGSTROMS
REMARK 525 HOH B 553 DISTANCE = 12.75 ANGSTROMS
REMARK 525 HOH B 554 DISTANCE = 13.71 ANGSTROMS
REMARK 525 HOH C 535 DISTANCE = 5.99 ANGSTROMS
REMARK 525 HOH C 536 DISTANCE = 6.45 ANGSTROMS
REMARK 525 HOH C 537 DISTANCE = 7.04 ANGSTROMS
REMARK 525 HOH C 538 DISTANCE = 7.19 ANGSTROMS
REMARK 525 HOH C 539 DISTANCE = 7.37 ANGSTROMS
REMARK 525 HOH C 540 DISTANCE = 7.40 ANGSTROMS
REMARK 525 HOH C 541 DISTANCE = 7.60 ANGSTROMS
REMARK 525 HOH C 542 DISTANCE = 7.79 ANGSTROMS
REMARK 525 HOH C 543 DISTANCE = 8.17 ANGSTROMS
REMARK 525 HOH C 544 DISTANCE = 10.90 ANGSTROMS
REMARK 525 HOH D 530 DISTANCE = 6.32 ANGSTROMS
REMARK 525 HOH D 531 DISTANCE = 6.36 ANGSTROMS
REMARK 525 HOH D 532 DISTANCE = 6.37 ANGSTROMS
REMARK 525 HOH D 533 DISTANCE = 6.41 ANGSTROMS
REMARK 525 HOH D 534 DISTANCE = 6.61 ANGSTROMS
REMARK 525 HOH D 535 DISTANCE = 6.96 ANGSTROMS
REMARK 525 HOH D 536 DISTANCE = 8.37 ANGSTROMS
REMARK 525 HOH D 537 DISTANCE = 8.96 ANGSTROMS
REMARK 525 HOH D 538 DISTANCE = 9.51 ANGSTROMS
REMARK 525 HOH D 539 DISTANCE = 10.30 ANGSTROMS
REMARK 525 HOH D 540 DISTANCE = 10.43 ANGSTROMS
REMARK 525 HOH D 541 DISTANCE = 11.68 ANGSTROMS
REMARK 525 HOH D 542 DISTANCE = 11.79 ANGSTROMS
REMARK 525 HOH D 543 DISTANCE = 14.71 ANGSTROMS
REMARK 525 HOH D 544 DISTANCE = 15.82 ANGSTROMS
REMARK 525 HOH D 545 DISTANCE = 17.27 ANGSTROMS
REMARK 525 HOH E 529 DISTANCE = 6.64 ANGSTROMS
REMARK 525 HOH E 530 DISTANCE = 6.97 ANGSTROMS
REMARK 525 HOH E 531 DISTANCE = 7.26 ANGSTROMS
REMARK 525 HOH E 532 DISTANCE = 7.51 ANGSTROMS
REMARK 525 HOH E 533 DISTANCE = 8.08 ANGSTROMS
REMARK 525 HOH E 534 DISTANCE = 8.13 ANGSTROMS
REMARK 525 HOH E 535 DISTANCE = 8.50 ANGSTROMS
REMARK 525 HOH E 536 DISTANCE = 8.87 ANGSTROMS
REMARK 525 HOH E 537 DISTANCE = 9.12 ANGSTROMS
REMARK 525 HOH E 538 DISTANCE = 10.20 ANGSTROMS
REMARK 525 HOH E 539 DISTANCE = 11.82 ANGSTROMS
REMARK 525 HOH E 540 DISTANCE = 12.40 ANGSTROMS
REMARK 525 HOH F 523 DISTANCE = 5.81 ANGSTROMS
REMARK 525 HOH F 524 DISTANCE = 5.98 ANGSTROMS
REMARK 525 HOH F 525 DISTANCE = 6.19 ANGSTROMS
REMARK 525 HOH F 526 DISTANCE = 6.20 ANGSTROMS
REMARK 525 HOH F 527 DISTANCE = 6.58 ANGSTROMS
REMARK 525 HOH F 528 DISTANCE = 6.86 ANGSTROMS
REMARK 525 HOH F 529 DISTANCE = 7.12 ANGSTROMS
REMARK 525 HOH F 530 DISTANCE = 7.78 ANGSTROMS
REMARK 525 HOH F 531 DISTANCE = 8.51 ANGSTROMS
REMARK 525 HOH F 532 DISTANCE = 8.70 ANGSTROMS
REMARK 525 HOH F 533 DISTANCE = 9.40 ANGSTROMS
REMARK 525 HOH F 534 DISTANCE = 9.55 ANGSTROMS
REMARK 525 HOH F 535 DISTANCE = 11.92 ANGSTROMS
REMARK 525 HOH F 536 DISTANCE = 12.26 ANGSTROMS
REMARK 525 HOH F 537 DISTANCE = 17.96 ANGSTROMS
DBREF1 6WPY A 1 487 UNP A0A415J7C9_BACLI
DBREF2 6WPY A A0A415J7C9 1 487
DBREF1 6WPY B 1 487 UNP A0A415J7C9_BACLI
DBREF2 6WPY B A0A415J7C9 1 487
DBREF1 6WPY C 1 487 UNP A0A415J7C9_BACLI
DBREF2 6WPY C A0A415J7C9 1 487
DBREF1 6WPY D 1 487 UNP A0A415J7C9_BACLI
DBREF2 6WPY D A0A415J7C9 1 487
DBREF1 6WPY E 1 487 UNP A0A415J7C9_BACLI
DBREF2 6WPY E A0A415J7C9 1 487
DBREF1 6WPY F 1 487 UNP A0A415J7C9_BACLI
DBREF2 6WPY F A0A415J7C9 1 487
SEQRES 1 A 487 MET LYS LYS LEU VAL LEU LEU MET LEU VAL LEU LEU LEU
SEQRES 2 A 487 VAL TYR PRO HIS VAL SER LYS ALA GLY GLY PHE LYS GLY
SEQRES 3 A 487 GLY GLY GLY ASN PRO GLY TYR TRP PHE ALA GLY ASP PRO
SEQRES 4 A 487 VAL GLU HIS PRO ASP PRO ALA LYS PRO PRO ILE VAL PHE
SEQRES 5 A 487 VAL HIS GLY LEU ASN GLY SER SER SER ALA TRP PHE ASP
SEQRES 6 A 487 GLU ASN ASP MET ALA GLU GLN ALA TRP LYS ASN GLY TYR
SEQRES 7 A 487 ASP ALA ALA PHE ILE ASP LEU HIS PRO ASP LYS ASP MET
SEQRES 8 A 487 GLN ASP ASN GLY ALA MET LEU ALA ALA LYS LEU ARG GLU
SEQRES 9 A 487 ILE TYR GLN TYR PHE GLY ARG LYS VAL ILE LEU VAL SER
SEQRES 10 A 487 TYR SER LYS GLY GLY ILE ASP SER GLN SER ALA LEU ILE
SEQRES 11 A 487 HIS HIS ASN ALA TYR HIS TYR VAL GLU ARG VAL ILE THR
SEQRES 12 A 487 LEU GLY THR PRO HIS HIS GLY SER GLN LEU ALA ASP LEU
SEQRES 13 A 487 ALA TYR SER ASN TRP ALA GLY TRP LEU ALA ASP ILE LEU
SEQRES 14 A 487 GLY GLN LYS ASN ASP ALA VAL TYR SER LEU GLN THR GLY
SEQRES 15 A 487 PHE MET LYS SER PHE ARG ASP GLN THR ASP ASN HIS PRO
SEQRES 16 A 487 ASN ARG LEU LYS THR LYS TYR PHE THR LEU ALA GLY ASN
SEQRES 17 A 487 LYS ILE GLY GLY PHE GLY SER ALA LEU PHE PHE GLY GLY
SEQRES 18 A 487 VAL TYR LEU ASN MET PHE GLY GLU ASN ASP GLY ALA VAL
SEQRES 19 A 487 THR GLU LYS ASN ALA ARG LEU PRO TYR ALA THR ASN LEU
SEQRES 20 A 487 ASP THR GLY LYS TRP ASP HIS PHE SER ILE ILE LYS GLY
SEQRES 21 A 487 ASN LEU THR PHE PRO VAL PHE MET PRO LEU LEU THR ILE
SEQRES 22 A 487 GLN ALA ASN ALA ASN GLU THR ALA ALA THR LYS GLU ASN
SEQRES 23 A 487 LEU SER TYR PRO PHE ILE ARG GLY GLY GLU ASN HIS GLY
SEQRES 24 A 487 LEU ARG GLU GLU GLU PHE ALA VAL GLU LYS GLY VAL LYS
SEQRES 25 A 487 GLU ILE THR VAL HIS TRP LEU SER ASN HIS SER SER GLY
SEQRES 26 A 487 ASN ILE LYS LEU THR ASP PRO ARG GLY LYS PRO PHE LYS
SEQRES 27 A 487 ASP PHE SER ILE ALA LYS THR ALA ASP VAL PHE GLU GLY
SEQRES 28 A 487 GLY PHE VAL HIS SER ALA ALA ILE LYS ASN PRO ALA ALA
SEQRES 29 A 487 GLY THR TRP LYS ILE ALA SER SER VAL LYS GLN LYS GLU
SEQRES 30 A 487 ALA PHE LEU PHE ILE VAL THR PHE ASP SER PRO LEU ASN
SEQRES 31 A 487 GLN GLN ILE LYS ASN ALA VAL THR ARG GLU SER SER ASN
SEQRES 32 A 487 LEU ALA ASN VAL LYS ALA SER VAL ARG SER ILE ARG TYR
SEQRES 33 A 487 GLU ASN GLY LYS GLN ALA GLU LYS LYS SER LEU LYS PRO
SEQRES 34 A 487 ALA SER ILE ASN ALA LEU GLN ASN SER LEU SER PHE LYS
SEQRES 35 A 487 LYS ALA GLY MET TYR SER VAL THR ILE ASP LEU SER GLY
SEQRES 36 A 487 LYS THR ALA ASP ASN SER PRO PHE ASN ARG THR ILE ILE
SEQRES 37 A 487 ARG SER ILE TYR VAL ASN ASP LYS GLY GLU LYS PHE GLU
SEQRES 38 A 487 ASN SER PRO LEU SER ASP
SEQRES 1 B 487 MET LYS LYS LEU VAL LEU LEU MET LEU VAL LEU LEU LEU
SEQRES 2 B 487 VAL TYR PRO HIS VAL SER LYS ALA GLY GLY PHE LYS GLY
SEQRES 3 B 487 GLY GLY GLY ASN PRO GLY TYR TRP PHE ALA GLY ASP PRO
SEQRES 4 B 487 VAL GLU HIS PRO ASP PRO ALA LYS PRO PRO ILE VAL PHE
SEQRES 5 B 487 VAL HIS GLY LEU ASN GLY SER SER SER ALA TRP PHE ASP
SEQRES 6 B 487 GLU ASN ASP MET ALA GLU GLN ALA TRP LYS ASN GLY TYR
SEQRES 7 B 487 ASP ALA ALA PHE ILE ASP LEU HIS PRO ASP LYS ASP MET
SEQRES 8 B 487 GLN ASP ASN GLY ALA MET LEU ALA ALA LYS LEU ARG GLU
SEQRES 9 B 487 ILE TYR GLN TYR PHE GLY ARG LYS VAL ILE LEU VAL SER
SEQRES 10 B 487 TYR SER LYS GLY GLY ILE ASP SER GLN SER ALA LEU ILE
SEQRES 11 B 487 HIS HIS ASN ALA TYR HIS TYR VAL GLU ARG VAL ILE THR
SEQRES 12 B 487 LEU GLY THR PRO HIS HIS GLY SER GLN LEU ALA ASP LEU
SEQRES 13 B 487 ALA TYR SER ASN TRP ALA GLY TRP LEU ALA ASP ILE LEU
SEQRES 14 B 487 GLY GLN LYS ASN ASP ALA VAL TYR SER LEU GLN THR GLY
SEQRES 15 B 487 PHE MET LYS SER PHE ARG ASP GLN THR ASP ASN HIS PRO
SEQRES 16 B 487 ASN ARG LEU LYS THR LYS TYR PHE THR LEU ALA GLY ASN
SEQRES 17 B 487 LYS ILE GLY GLY PHE GLY SER ALA LEU PHE PHE GLY GLY
SEQRES 18 B 487 VAL TYR LEU ASN MET PHE GLY GLU ASN ASP GLY ALA VAL
SEQRES 19 B 487 THR GLU LYS ASN ALA ARG LEU PRO TYR ALA THR ASN LEU
SEQRES 20 B 487 ASP THR GLY LYS TRP ASP HIS PHE SER ILE ILE LYS GLY
SEQRES 21 B 487 ASN LEU THR PHE PRO VAL PHE MET PRO LEU LEU THR ILE
SEQRES 22 B 487 GLN ALA ASN ALA ASN GLU THR ALA ALA THR LYS GLU ASN
SEQRES 23 B 487 LEU SER TYR PRO PHE ILE ARG GLY GLY GLU ASN HIS GLY
SEQRES 24 B 487 LEU ARG GLU GLU GLU PHE ALA VAL GLU LYS GLY VAL LYS
SEQRES 25 B 487 GLU ILE THR VAL HIS TRP LEU SER ASN HIS SER SER GLY
SEQRES 26 B 487 ASN ILE LYS LEU THR ASP PRO ARG GLY LYS PRO PHE LYS
SEQRES 27 B 487 ASP PHE SER ILE ALA LYS THR ALA ASP VAL PHE GLU GLY
SEQRES 28 B 487 GLY PHE VAL HIS SER ALA ALA ILE LYS ASN PRO ALA ALA
SEQRES 29 B 487 GLY THR TRP LYS ILE ALA SER SER VAL LYS GLN LYS GLU
SEQRES 30 B 487 ALA PHE LEU PHE ILE VAL THR PHE ASP SER PRO LEU ASN
SEQRES 31 B 487 GLN GLN ILE LYS ASN ALA VAL THR ARG GLU SER SER ASN
SEQRES 32 B 487 LEU ALA ASN VAL LYS ALA SER VAL ARG SER ILE ARG TYR
SEQRES 33 B 487 GLU ASN GLY LYS GLN ALA GLU LYS LYS SER LEU LYS PRO
SEQRES 34 B 487 ALA SER ILE ASN ALA LEU GLN ASN SER LEU SER PHE LYS
SEQRES 35 B 487 LYS ALA GLY MET TYR SER VAL THR ILE ASP LEU SER GLY
SEQRES 36 B 487 LYS THR ALA ASP ASN SER PRO PHE ASN ARG THR ILE ILE
SEQRES 37 B 487 ARG SER ILE TYR VAL ASN ASP LYS GLY GLU LYS PHE GLU
SEQRES 38 B 487 ASN SER PRO LEU SER ASP
SEQRES 1 C 487 MET LYS LYS LEU VAL LEU LEU MET LEU VAL LEU LEU LEU
SEQRES 2 C 487 VAL TYR PRO HIS VAL SER LYS ALA GLY GLY PHE LYS GLY
SEQRES 3 C 487 GLY GLY GLY ASN PRO GLY TYR TRP PHE ALA GLY ASP PRO
SEQRES 4 C 487 VAL GLU HIS PRO ASP PRO ALA LYS PRO PRO ILE VAL PHE
SEQRES 5 C 487 VAL HIS GLY LEU ASN GLY SER SER SER ALA TRP PHE ASP
SEQRES 6 C 487 GLU ASN ASP MET ALA GLU GLN ALA TRP LYS ASN GLY TYR
SEQRES 7 C 487 ASP ALA ALA PHE ILE ASP LEU HIS PRO ASP LYS ASP MET
SEQRES 8 C 487 GLN ASP ASN GLY ALA MET LEU ALA ALA LYS LEU ARG GLU
SEQRES 9 C 487 ILE TYR GLN TYR PHE GLY ARG LYS VAL ILE LEU VAL SER
SEQRES 10 C 487 TYR SER LYS GLY GLY ILE ASP SER GLN SER ALA LEU ILE
SEQRES 11 C 487 HIS HIS ASN ALA TYR HIS TYR VAL GLU ARG VAL ILE THR
SEQRES 12 C 487 LEU GLY THR PRO HIS HIS GLY SER GLN LEU ALA ASP LEU
SEQRES 13 C 487 ALA TYR SER ASN TRP ALA GLY TRP LEU ALA ASP ILE LEU
SEQRES 14 C 487 GLY GLN LYS ASN ASP ALA VAL TYR SER LEU GLN THR GLY
SEQRES 15 C 487 PHE MET LYS SER PHE ARG ASP GLN THR ASP ASN HIS PRO
SEQRES 16 C 487 ASN ARG LEU LYS THR LYS TYR PHE THR LEU ALA GLY ASN
SEQRES 17 C 487 LYS ILE GLY GLY PHE GLY SER ALA LEU PHE PHE GLY GLY
SEQRES 18 C 487 VAL TYR LEU ASN MET PHE GLY GLU ASN ASP GLY ALA VAL
SEQRES 19 C 487 THR GLU LYS ASN ALA ARG LEU PRO TYR ALA THR ASN LEU
SEQRES 20 C 487 ASP THR GLY LYS TRP ASP HIS PHE SER ILE ILE LYS GLY
SEQRES 21 C 487 ASN LEU THR PHE PRO VAL PHE MET PRO LEU LEU THR ILE
SEQRES 22 C 487 GLN ALA ASN ALA ASN GLU THR ALA ALA THR LYS GLU ASN
SEQRES 23 C 487 LEU SER TYR PRO PHE ILE ARG GLY GLY GLU ASN HIS GLY
SEQRES 24 C 487 LEU ARG GLU GLU GLU PHE ALA VAL GLU LYS GLY VAL LYS
SEQRES 25 C 487 GLU ILE THR VAL HIS TRP LEU SER ASN HIS SER SER GLY
SEQRES 26 C 487 ASN ILE LYS LEU THR ASP PRO ARG GLY LYS PRO PHE LYS
SEQRES 27 C 487 ASP PHE SER ILE ALA LYS THR ALA ASP VAL PHE GLU GLY
SEQRES 28 C 487 GLY PHE VAL HIS SER ALA ALA ILE LYS ASN PRO ALA ALA
SEQRES 29 C 487 GLY THR TRP LYS ILE ALA SER SER VAL LYS GLN LYS GLU
SEQRES 30 C 487 ALA PHE LEU PHE ILE VAL THR PHE ASP SER PRO LEU ASN
SEQRES 31 C 487 GLN GLN ILE LYS ASN ALA VAL THR ARG GLU SER SER ASN
SEQRES 32 C 487 LEU ALA ASN VAL LYS ALA SER VAL ARG SER ILE ARG TYR
SEQRES 33 C 487 GLU ASN GLY LYS GLN ALA GLU LYS LYS SER LEU LYS PRO
SEQRES 34 C 487 ALA SER ILE ASN ALA LEU GLN ASN SER LEU SER PHE LYS
SEQRES 35 C 487 LYS ALA GLY MET TYR SER VAL THR ILE ASP LEU SER GLY
SEQRES 36 C 487 LYS THR ALA ASP ASN SER PRO PHE ASN ARG THR ILE ILE
SEQRES 37 C 487 ARG SER ILE TYR VAL ASN ASP LYS GLY GLU LYS PHE GLU
SEQRES 38 C 487 ASN SER PRO LEU SER ASP
SEQRES 1 D 487 MET LYS LYS LEU VAL LEU LEU MET LEU VAL LEU LEU LEU
SEQRES 2 D 487 VAL TYR PRO HIS VAL SER LYS ALA GLY GLY PHE LYS GLY
SEQRES 3 D 487 GLY GLY GLY ASN PRO GLY TYR TRP PHE ALA GLY ASP PRO
SEQRES 4 D 487 VAL GLU HIS PRO ASP PRO ALA LYS PRO PRO ILE VAL PHE
SEQRES 5 D 487 VAL HIS GLY LEU ASN GLY SER SER SER ALA TRP PHE ASP
SEQRES 6 D 487 GLU ASN ASP MET ALA GLU GLN ALA TRP LYS ASN GLY TYR
SEQRES 7 D 487 ASP ALA ALA PHE ILE ASP LEU HIS PRO ASP LYS ASP MET
SEQRES 8 D 487 GLN ASP ASN GLY ALA MET LEU ALA ALA LYS LEU ARG GLU
SEQRES 9 D 487 ILE TYR GLN TYR PHE GLY ARG LYS VAL ILE LEU VAL SER
SEQRES 10 D 487 TYR SER LYS GLY GLY ILE ASP SER GLN SER ALA LEU ILE
SEQRES 11 D 487 HIS HIS ASN ALA TYR HIS TYR VAL GLU ARG VAL ILE THR
SEQRES 12 D 487 LEU GLY THR PRO HIS HIS GLY SER GLN LEU ALA ASP LEU
SEQRES 13 D 487 ALA TYR SER ASN TRP ALA GLY TRP LEU ALA ASP ILE LEU
SEQRES 14 D 487 GLY GLN LYS ASN ASP ALA VAL TYR SER LEU GLN THR GLY
SEQRES 15 D 487 PHE MET LYS SER PHE ARG ASP GLN THR ASP ASN HIS PRO
SEQRES 16 D 487 ASN ARG LEU LYS THR LYS TYR PHE THR LEU ALA GLY ASN
SEQRES 17 D 487 LYS ILE GLY GLY PHE GLY SER ALA LEU PHE PHE GLY GLY
SEQRES 18 D 487 VAL TYR LEU ASN MET PHE GLY GLU ASN ASP GLY ALA VAL
SEQRES 19 D 487 THR GLU LYS ASN ALA ARG LEU PRO TYR ALA THR ASN LEU
SEQRES 20 D 487 ASP THR GLY LYS TRP ASP HIS PHE SER ILE ILE LYS GLY
SEQRES 21 D 487 ASN LEU THR PHE PRO VAL PHE MET PRO LEU LEU THR ILE
SEQRES 22 D 487 GLN ALA ASN ALA ASN GLU THR ALA ALA THR LYS GLU ASN
SEQRES 23 D 487 LEU SER TYR PRO PHE ILE ARG GLY GLY GLU ASN HIS GLY
SEQRES 24 D 487 LEU ARG GLU GLU GLU PHE ALA VAL GLU LYS GLY VAL LYS
SEQRES 25 D 487 GLU ILE THR VAL HIS TRP LEU SER ASN HIS SER SER GLY
SEQRES 26 D 487 ASN ILE LYS LEU THR ASP PRO ARG GLY LYS PRO PHE LYS
SEQRES 27 D 487 ASP PHE SER ILE ALA LYS THR ALA ASP VAL PHE GLU GLY
SEQRES 28 D 487 GLY PHE VAL HIS SER ALA ALA ILE LYS ASN PRO ALA ALA
SEQRES 29 D 487 GLY THR TRP LYS ILE ALA SER SER VAL LYS GLN LYS GLU
SEQRES 30 D 487 ALA PHE LEU PHE ILE VAL THR PHE ASP SER PRO LEU ASN
SEQRES 31 D 487 GLN GLN ILE LYS ASN ALA VAL THR ARG GLU SER SER ASN
SEQRES 32 D 487 LEU ALA ASN VAL LYS ALA SER VAL ARG SER ILE ARG TYR
SEQRES 33 D 487 GLU ASN GLY LYS GLN ALA GLU LYS LYS SER LEU LYS PRO
SEQRES 34 D 487 ALA SER ILE ASN ALA LEU GLN ASN SER LEU SER PHE LYS
SEQRES 35 D 487 LYS ALA GLY MET TYR SER VAL THR ILE ASP LEU SER GLY
SEQRES 36 D 487 LYS THR ALA ASP ASN SER PRO PHE ASN ARG THR ILE ILE
SEQRES 37 D 487 ARG SER ILE TYR VAL ASN ASP LYS GLY GLU LYS PHE GLU
SEQRES 38 D 487 ASN SER PRO LEU SER ASP
SEQRES 1 E 487 MET LYS LYS LEU VAL LEU LEU MET LEU VAL LEU LEU LEU
SEQRES 2 E 487 VAL TYR PRO HIS VAL SER LYS ALA GLY GLY PHE LYS GLY
SEQRES 3 E 487 GLY GLY GLY ASN PRO GLY TYR TRP PHE ALA GLY ASP PRO
SEQRES 4 E 487 VAL GLU HIS PRO ASP PRO ALA LYS PRO PRO ILE VAL PHE
SEQRES 5 E 487 VAL HIS GLY LEU ASN GLY SER SER SER ALA TRP PHE ASP
SEQRES 6 E 487 GLU ASN ASP MET ALA GLU GLN ALA TRP LYS ASN GLY TYR
SEQRES 7 E 487 ASP ALA ALA PHE ILE ASP LEU HIS PRO ASP LYS ASP MET
SEQRES 8 E 487 GLN ASP ASN GLY ALA MET LEU ALA ALA LYS LEU ARG GLU
SEQRES 9 E 487 ILE TYR GLN TYR PHE GLY ARG LYS VAL ILE LEU VAL SER
SEQRES 10 E 487 TYR SER LYS GLY GLY ILE ASP SER GLN SER ALA LEU ILE
SEQRES 11 E 487 HIS HIS ASN ALA TYR HIS TYR VAL GLU ARG VAL ILE THR
SEQRES 12 E 487 LEU GLY THR PRO HIS HIS GLY SER GLN LEU ALA ASP LEU
SEQRES 13 E 487 ALA TYR SER ASN TRP ALA GLY TRP LEU ALA ASP ILE LEU
SEQRES 14 E 487 GLY GLN LYS ASN ASP ALA VAL TYR SER LEU GLN THR GLY
SEQRES 15 E 487 PHE MET LYS SER PHE ARG ASP GLN THR ASP ASN HIS PRO
SEQRES 16 E 487 ASN ARG LEU LYS THR LYS TYR PHE THR LEU ALA GLY ASN
SEQRES 17 E 487 LYS ILE GLY GLY PHE GLY SER ALA LEU PHE PHE GLY GLY
SEQRES 18 E 487 VAL TYR LEU ASN MET PHE GLY GLU ASN ASP GLY ALA VAL
SEQRES 19 E 487 THR GLU LYS ASN ALA ARG LEU PRO TYR ALA THR ASN LEU
SEQRES 20 E 487 ASP THR GLY LYS TRP ASP HIS PHE SER ILE ILE LYS GLY
SEQRES 21 E 487 ASN LEU THR PHE PRO VAL PHE MET PRO LEU LEU THR ILE
SEQRES 22 E 487 GLN ALA ASN ALA ASN GLU THR ALA ALA THR LYS GLU ASN
SEQRES 23 E 487 LEU SER TYR PRO PHE ILE ARG GLY GLY GLU ASN HIS GLY
SEQRES 24 E 487 LEU ARG GLU GLU GLU PHE ALA VAL GLU LYS GLY VAL LYS
SEQRES 25 E 487 GLU ILE THR VAL HIS TRP LEU SER ASN HIS SER SER GLY
SEQRES 26 E 487 ASN ILE LYS LEU THR ASP PRO ARG GLY LYS PRO PHE LYS
SEQRES 27 E 487 ASP PHE SER ILE ALA LYS THR ALA ASP VAL PHE GLU GLY
SEQRES 28 E 487 GLY PHE VAL HIS SER ALA ALA ILE LYS ASN PRO ALA ALA
SEQRES 29 E 487 GLY THR TRP LYS ILE ALA SER SER VAL LYS GLN LYS GLU
SEQRES 30 E 487 ALA PHE LEU PHE ILE VAL THR PHE ASP SER PRO LEU ASN
SEQRES 31 E 487 GLN GLN ILE LYS ASN ALA VAL THR ARG GLU SER SER ASN
SEQRES 32 E 487 LEU ALA ASN VAL LYS ALA SER VAL ARG SER ILE ARG TYR
SEQRES 33 E 487 GLU ASN GLY LYS GLN ALA GLU LYS LYS SER LEU LYS PRO
SEQRES 34 E 487 ALA SER ILE ASN ALA LEU GLN ASN SER LEU SER PHE LYS
SEQRES 35 E 487 LYS ALA GLY MET TYR SER VAL THR ILE ASP LEU SER GLY
SEQRES 36 E 487 LYS THR ALA ASP ASN SER PRO PHE ASN ARG THR ILE ILE
SEQRES 37 E 487 ARG SER ILE TYR VAL ASN ASP LYS GLY GLU LYS PHE GLU
SEQRES 38 E 487 ASN SER PRO LEU SER ASP
SEQRES 1 F 487 MET LYS LYS LEU VAL LEU LEU MET LEU VAL LEU LEU LEU
SEQRES 2 F 487 VAL TYR PRO HIS VAL SER LYS ALA GLY GLY PHE LYS GLY
SEQRES 3 F 487 GLY GLY GLY ASN PRO GLY TYR TRP PHE ALA GLY ASP PRO
SEQRES 4 F 487 VAL GLU HIS PRO ASP PRO ALA LYS PRO PRO ILE VAL PHE
SEQRES 5 F 487 VAL HIS GLY LEU ASN GLY SER SER SER ALA TRP PHE ASP
SEQRES 6 F 487 GLU ASN ASP MET ALA GLU GLN ALA TRP LYS ASN GLY TYR
SEQRES 7 F 487 ASP ALA ALA PHE ILE ASP LEU HIS PRO ASP LYS ASP MET
SEQRES 8 F 487 GLN ASP ASN GLY ALA MET LEU ALA ALA LYS LEU ARG GLU
SEQRES 9 F 487 ILE TYR GLN TYR PHE GLY ARG LYS VAL ILE LEU VAL SER
SEQRES 10 F 487 TYR SER LYS GLY GLY ILE ASP SER GLN SER ALA LEU ILE
SEQRES 11 F 487 HIS HIS ASN ALA TYR HIS TYR VAL GLU ARG VAL ILE THR
SEQRES 12 F 487 LEU GLY THR PRO HIS HIS GLY SER GLN LEU ALA ASP LEU
SEQRES 13 F 487 ALA TYR SER ASN TRP ALA GLY TRP LEU ALA ASP ILE LEU
SEQRES 14 F 487 GLY GLN LYS ASN ASP ALA VAL TYR SER LEU GLN THR GLY
SEQRES 15 F 487 PHE MET LYS SER PHE ARG ASP GLN THR ASP ASN HIS PRO
SEQRES 16 F 487 ASN ARG LEU LYS THR LYS TYR PHE THR LEU ALA GLY ASN
SEQRES 17 F 487 LYS ILE GLY GLY PHE GLY SER ALA LEU PHE PHE GLY GLY
SEQRES 18 F 487 VAL TYR LEU ASN MET PHE GLY GLU ASN ASP GLY ALA VAL
SEQRES 19 F 487 THR GLU LYS ASN ALA ARG LEU PRO TYR ALA THR ASN LEU
SEQRES 20 F 487 ASP THR GLY LYS TRP ASP HIS PHE SER ILE ILE LYS GLY
SEQRES 21 F 487 ASN LEU THR PHE PRO VAL PHE MET PRO LEU LEU THR ILE
SEQRES 22 F 487 GLN ALA ASN ALA ASN GLU THR ALA ALA THR LYS GLU ASN
SEQRES 23 F 487 LEU SER TYR PRO PHE ILE ARG GLY GLY GLU ASN HIS GLY
SEQRES 24 F 487 LEU ARG GLU GLU GLU PHE ALA VAL GLU LYS GLY VAL LYS
SEQRES 25 F 487 GLU ILE THR VAL HIS TRP LEU SER ASN HIS SER SER GLY
SEQRES 26 F 487 ASN ILE LYS LEU THR ASP PRO ARG GLY LYS PRO PHE LYS
SEQRES 27 F 487 ASP PHE SER ILE ALA LYS THR ALA ASP VAL PHE GLU GLY
SEQRES 28 F 487 GLY PHE VAL HIS SER ALA ALA ILE LYS ASN PRO ALA ALA
SEQRES 29 F 487 GLY THR TRP LYS ILE ALA SER SER VAL LYS GLN LYS GLU
SEQRES 30 F 487 ALA PHE LEU PHE ILE VAL THR PHE ASP SER PRO LEU ASN
SEQRES 31 F 487 GLN GLN ILE LYS ASN ALA VAL THR ARG GLU SER SER ASN
SEQRES 32 F 487 LEU ALA ASN VAL LYS ALA SER VAL ARG SER ILE ARG TYR
SEQRES 33 F 487 GLU ASN GLY LYS GLN ALA GLU LYS LYS SER LEU LYS PRO
SEQRES 34 F 487 ALA SER ILE ASN ALA LEU GLN ASN SER LEU SER PHE LYS
SEQRES 35 F 487 LYS ALA GLY MET TYR SER VAL THR ILE ASP LEU SER GLY
SEQRES 36 F 487 LYS THR ALA ASP ASN SER PRO PHE ASN ARG THR ILE ILE
SEQRES 37 F 487 ARG SER ILE TYR VAL ASN ASP LYS GLY GLU LYS PHE GLU
SEQRES 38 F 487 ASN SER PRO LEU SER ASP
FORMUL 7 HOH *279(H2 O)
HELIX 1 AA1 SER A 59 PHE A 64 5 6
HELIX 2 AA2 ASP A 68 ASN A 76 1 9
HELIX 3 AA3 ASP A 90 GLY A 110 1 21
HELIX 4 AA4 LYS A 120 HIS A 132 1 13
HELIX 5 AA5 ASN A 133 HIS A 136 5 4
HELIX 6 AA6 SER A 151 TYR A 158 1 8
HELIX 7 AA7 TRP A 164 GLY A 170 1 7
HELIX 8 AA8 ASN A 173 SER A 178 1 6
HELIX 9 AA9 GLN A 180 ASP A 192 1 13
HELIX 10 AB1 HIS A 194 THR A 200 5 7
HELIX 11 AB2 SER A 215 ASN A 225 1 11
HELIX 12 AB3 GLU A 236 ARG A 240 5 5
HELIX 13 AB4 PHE A 255 ILE A 258 5 4
HELIX 14 AB5 LYS A 259 MET A 268 1 10
HELIX 15 AB6 PRO A 269 LEU A 271 5 3
HELIX 16 AB7 SER B 59 PHE B 64 5 6
HELIX 17 AB8 ASP B 68 ASN B 76 1 9
HELIX 18 AB9 ASP B 90 GLY B 110 1 21
HELIX 19 AC1 LYS B 120 HIS B 132 1 13
HELIX 20 AC2 ASN B 133 HIS B 136 5 4
HELIX 21 AC3 SER B 151 TYR B 158 1 8
HELIX 22 AC4 ALA B 162 GLY B 170 1 9
HELIX 23 AC5 ASN B 173 SER B 178 1 6
HELIX 24 AC6 GLN B 180 ASP B 192 1 13
HELIX 25 AC7 HIS B 194 THR B 200 5 7
HELIX 26 AC8 SER B 215 ASN B 225 1 11
HELIX 27 AC9 GLU B 236 ARG B 240 5 5
HELIX 28 AD1 PHE B 255 ILE B 258 5 4
HELIX 29 AD2 LYS B 259 MET B 268 1 10
HELIX 30 AD3 PRO B 269 LEU B 271 5 3
HELIX 31 AD4 SER C 59 PHE C 64 5 6
HELIX 32 AD5 ASP C 68 ASN C 76 1 9
HELIX 33 AD6 ASP C 90 GLY C 110 1 21
HELIX 34 AD7 SER C 119 HIS C 132 1 14
HELIX 35 AD8 ASN C 133 HIS C 136 5 4
HELIX 36 AD9 SER C 151 TRP C 161 1 11
HELIX 37 AE1 TRP C 164 GLY C 170 1 7
HELIX 38 AE2 ASN C 173 SER C 178 1 6
HELIX 39 AE3 GLN C 180 ASN C 193 1 14
HELIX 40 AE4 HIS C 194 THR C 200 5 7
HELIX 41 AE5 SER C 215 ASN C 225 1 11
HELIX 42 AE6 GLU C 236 ARG C 240 5 5
HELIX 43 AE7 PHE C 255 ILE C 258 5 4
HELIX 44 AE8 LYS C 259 MET C 268 1 10
HELIX 45 AE9 PRO C 269 LEU C 271 5 3
HELIX 46 AF1 SER D 59 PHE D 64 5 6
HELIX 47 AF2 ASP D 68 ASN D 76 1 9
HELIX 48 AF3 ASP D 90 GLY D 110 1 21
HELIX 49 AF4 LYS D 120 HIS D 132 1 13
HELIX 50 AF5 ASN D 133 HIS D 136 5 4
HELIX 51 AF6 SER D 151 SER D 159 1 9
HELIX 52 AF7 ALA D 162 TRP D 164 5 3
HELIX 53 AF8 LEU D 165 GLY D 170 1 6
HELIX 54 AF9 ASN D 173 SER D 178 1 6
HELIX 55 AG1 GLN D 180 ASN D 193 1 14
HELIX 56 AG2 HIS D 194 THR D 200 5 7
HELIX 57 AG3 SER D 215 ASN D 225 1 11
HELIX 58 AG4 GLU D 236 ARG D 240 5 5
HELIX 59 AG5 PHE D 255 ILE D 258 5 4
HELIX 60 AG6 LYS D 259 MET D 268 1 10
HELIX 61 AG7 PRO D 269 LEU D 271 5 3
HELIX 62 AG8 SER E 59 PHE E 64 5 6
HELIX 63 AG9 ASP E 68 ASN E 76 1 9
HELIX 64 AH1 ASP E 90 GLY E 110 1 21
HELIX 65 AH2 LYS E 120 HIS E 132 1 13
HELIX 66 AH3 ASN E 133 HIS E 136 5 4
HELIX 67 AH4 SER E 151 TYR E 158 1 8
HELIX 68 AH5 LEU E 165 GLY E 170 1 6
HELIX 69 AH6 ASN E 173 SER E 178 1 6
HELIX 70 AH7 GLN E 180 ASP E 192 1 13
HELIX 71 AH8 HIS E 194 THR E 200 5 7
HELIX 72 AH9 PHE E 218 ASN E 225 1 8
HELIX 73 AI1 GLU E 236 ARG E 240 5 5
HELIX 74 AI2 PHE E 255 ILE E 258 5 4
HELIX 75 AI3 LYS E 259 MET E 268 1 10
HELIX 76 AI4 PRO E 269 LEU E 271 5 3
HELIX 77 AI5 SER F 59 PHE F 64 5 6
HELIX 78 AI6 ASP F 68 ASN F 76 1 9
HELIX 79 AI7 ASP F 90 GLY F 110 1 21
HELIX 80 AI8 LYS F 120 HIS F 132 1 13
HELIX 81 AI9 ASN F 133 HIS F 136 5 4
HELIX 82 AJ1 SER F 151 TRP F 161 1 11
HELIX 83 AJ2 LEU F 165 GLY F 170 1 6
HELIX 84 AJ3 ASN F 173 SER F 178 1 6
HELIX 85 AJ4 GLN F 180 ASN F 193 1 14
HELIX 86 AJ5 HIS F 194 THR F 200 5 7
HELIX 87 AJ6 SER F 215 ASN F 225 1 11
HELIX 88 AJ7 GLU F 236 ARG F 240 5 5
HELIX 89 AJ8 PHE F 255 ILE F 258 5 4
HELIX 90 AJ9 LYS F 259 MET F 268 1 10
HELIX 91 AK1 PRO F 269 LEU F 271 5 3
SHEET 1 AA1 7 TRP A 34 ALA A 36 0
SHEET 2 AA1 7 ALA A 80 ILE A 83 -1 O PHE A 82 N PHE A 35
SHEET 3 AA1 7 ILE A 50 VAL A 53 1 N PHE A 52 O ALA A 81
SHEET 4 AA1 7 VAL A 113 TYR A 118 1 O ILE A 114 N VAL A 51
SHEET 5 AA1 7 VAL A 138 LEU A 144 1 O ILE A 142 N LEU A 115
SHEET 6 AA1 7 LYS A 201 LEU A 205 1 O PHE A 203 N THR A 143
SHEET 7 AA1 7 THR A 245 ASN A 246 1 O THR A 245 N TYR A 202
SHEET 1 AA2 7 TRP B 34 ALA B 36 0
SHEET 2 AA2 7 ALA B 80 ILE B 83 -1 O PHE B 82 N PHE B 35
SHEET 3 AA2 7 ILE B 50 VAL B 53 1 N PHE B 52 O ALA B 81
SHEET 4 AA2 7 VAL B 113 TYR B 118 1 O ILE B 114 N VAL B 51
SHEET 5 AA2 7 VAL B 138 LEU B 144 1 O ILE B 142 N LEU B 115
SHEET 6 AA2 7 LYS B 201 LEU B 205 1 O PHE B 203 N THR B 143
SHEET 7 AA2 7 THR B 245 ASN B 246 1 O THR B 245 N TYR B 202
SHEET 1 AA3 7 TRP C 34 GLY C 37 0
SHEET 2 AA3 7 ALA C 80 ILE C 83 -1 O PHE C 82 N PHE C 35
SHEET 3 AA3 7 ILE C 50 VAL C 53 1 N ILE C 50 O ALA C 81
SHEET 4 AA3 7 VAL C 113 TYR C 118 1 O ILE C 114 N VAL C 51
SHEET 5 AA3 7 VAL C 138 LEU C 144 1 O ILE C 142 N LEU C 115
SHEET 6 AA3 7 LYS C 201 LEU C 205 1 O PHE C 203 N THR C 143
SHEET 7 AA3 7 THR C 245 ASN C 246 1 O THR C 245 N TYR C 202
SHEET 1 AA4 7 TRP D 34 ALA D 36 0
SHEET 2 AA4 7 ALA D 80 ILE D 83 -1 O PHE D 82 N PHE D 35
SHEET 3 AA4 7 ILE D 50 VAL D 53 1 N PHE D 52 O ALA D 81
SHEET 4 AA4 7 VAL D 113 TYR D 118 1 O ILE D 114 N VAL D 51
SHEET 5 AA4 7 VAL D 138 LEU D 144 1 O ILE D 142 N LEU D 115
SHEET 6 AA4 7 LYS D 201 LEU D 205 1 O PHE D 203 N THR D 143
SHEET 7 AA4 7 THR D 245 ASN D 246 1 O THR D 245 N TYR D 202
SHEET 1 AA5 7 TRP E 34 ALA E 36 0
SHEET 2 AA5 7 ALA E 80 ILE E 83 -1 O PHE E 82 N PHE E 35
SHEET 3 AA5 7 ILE E 50 VAL E 53 1 N PHE E 52 O ALA E 81
SHEET 4 AA5 7 VAL E 113 TYR E 118 1 O ILE E 114 N VAL E 51
SHEET 5 AA5 7 VAL E 138 LEU E 144 1 O ILE E 142 N LEU E 115
SHEET 6 AA5 7 LYS E 201 LEU E 205 1 O PHE E 203 N THR E 143
SHEET 7 AA5 7 THR E 245 ASN E 246 1 O THR E 245 N TYR E 202
SHEET 1 AA6 7 TRP F 34 ALA F 36 0
SHEET 2 AA6 7 ALA F 80 ILE F 83 -1 O PHE F 82 N PHE F 35
SHEET 3 AA6 7 ILE F 50 VAL F 53 1 N PHE F 52 O ALA F 81
SHEET 4 AA6 7 VAL F 113 TYR F 118 1 O ILE F 114 N VAL F 51
SHEET 5 AA6 7 VAL F 138 LEU F 144 1 O ILE F 142 N LEU F 115
SHEET 6 AA6 7 LYS F 201 LEU F 205 1 O PHE F 203 N THR F 143
SHEET 7 AA6 7 THR F 245 ASN F 246 1 O THR F 245 N TYR F 202
CRYST1 102.077 122.518 157.920 90.00 90.00 90.00 P 21 2 21 24
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 0.009797 0.000000 0.000000 0.00000
SCALE2 0.000000 0.008162 0.000000 0.00000
SCALE3 0.000000 0.000000 0.006332 0.00000
TER 1936 ILE A 273
TER 3872 ILE B 273
TER 5808 ILE C 273
TER 7744 ILE D 273
TER 9680 ILE E 273
TER 11616 ILE F 273
MASTER 1844 0 0 91 42 0 0 611859 6 0 228
END |