longtext: 8pba-pdb

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HEADER    HYDROLASE                               08-JUN-23   8PBA
TITLE     CRYO-EM STRUCTURE OF CAENORHABDITIS ELEGANS DPF-3 (APO)
COMPND    MOL_ID: 1;
COMPND   2 MOLECULE: DIPEPTIDYL PEPTIDASE FOUR (IV) FAMILY;
COMPND   3 CHAIN: A, B;
COMPND   4 ENGINEERED: YES
SOURCE    MOL_ID: 1;
SOURCE   2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS;
SOURCE   3 ORGANISM_TAXID: 6239;
SOURCE   4 GENE: DPF-3, CELE_K02F2.1, K02F2.1;
SOURCE   5 EXPRESSION_SYSTEM: TRICHOPLUSIA NI;
SOURCE   6 EXPRESSION_SYSTEM_TAXID: 7111
KEYWDS    DIPEPTIDYLPEPTIDASE, HYDROLASE
EXPDTA    ELECTRON MICROSCOPY
AUTHOR    R.K.GUDIPATI,S.CAVADINI,G.KEMPF,H.GROSSHANS
REVDAT   1   26-JUN-24 8PBA    0
JRNL        AUTH   R.K.GUDIPATI,S.CAVADINI,G.KEMPF,H.GROSSHANS
JRNL        TITL   CRYO-EM STRUCTURE OF CAENORHABDITIS ELEGANS DPF-3 (APO)
JRNL        REF    TO BE PUBLISHED
JRNL        REFN
REMARK   2
REMARK   2 RESOLUTION.    2.64 ANGSTROMS.
REMARK   3
REMARK   3 REFINEMENT.
REMARK   3   SOFTWARE PACKAGES      : RELION, GCTF, CRYOSPARC, RELION, COOT,
REMARK   3                            ISOLDE, ROSETTAEM, CRYOSPARC, RELION
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          : FLEXIBLE FIT
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)  : 2.640
REMARK   3   NUMBER OF PARTICLES               : 223429
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 8PBA COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 08-JUN-23.
REMARK 100 THE DEPOSITION ID IS D_1292126219.
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                 : HOMODIMERIC COMPLEX OF DPF-3
REMARK 245   SAMPLE CONCENTRATION (MG ML-1) : NULL
REMARK 245   SAMPLE SUPPORT DETAILS         : NULL
REMARK 245   SAMPLE VITRIFICATION DETAILS   : NULL
REMARK 245   SAMPLE BUFFER                  : NULL
REMARK 245   PH                             : 7.50
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                  : FEI TITAN KRIOS
REMARK 245   DETECTOR TYPE                     : FEI FALCON IV (4K X 4K)
REMARK 245   MINIMUM DEFOCUS (NM)              : 800.00
REMARK 245   MAXIMUM DEFOCUS (NM)              : 2500.00
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)  : 5000.00
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: DIMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, 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 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     MET A     2
REMARK 465     PHE A     3
REMARK 465     ASN A     4
REMARK 465     PHE A     5
REMARK 465     TYR A     6
REMARK 465     GLN A     7
REMARK 465     PHE A     8
REMARK 465     LEU A     9
REMARK 465     TYR A    10
REMARK 465     ASN A    11
REMARK 465     LEU A    12
REMARK 465     GLN A    13
REMARK 465     ASN A    14
REMARK 465     VAL A    15
REMARK 465     SER A    16
REMARK 465     PRO A    17
REMARK 465     PHE A    18
REMARK 465     ILE A    19
REMARK 465     ASP A    20
REMARK 465     PHE A    21
REMARK 465     SER A    22
REMARK 465     VAL A    23
REMARK 465     LEU A    24
REMARK 465     LYS A    25
REMARK 465     GLN A    26
REMARK 465     LEU A    27
REMARK 465     THR A    28
REMARK 465     HIS A    29
REMARK 465     THR A    30
REMARK 465     LYS A    31
REMARK 465     MET A    32
REMARK 465     ARG A    33
REMARK 465     TYR A   128
REMARK 465     ASN A   129
REMARK 465     VAL A   130
REMARK 465     ASP A   131
REMARK 465     SER A   132
REMARK 465     TYR A   133
REMARK 465     ILE A   134
REMARK 465     ARG A   135
REMARK 465     LYS A   136
REMARK 465     THR A   137
REMARK 465     PRO A   138
REMARK 465     PRO A   139
REMARK 465     SER A   140
REMARK 465     ALA A   141
REMARK 465     GLU A   142
REMARK 465     PHE A   143
REMARK 465     THR A   144
REMARK 465     LEU A   145
REMARK 465     GLN A   146
REMARK 465     CYS A   147
REMARK 465     GLU A   148
REMARK 465     ARG A   149
REMARK 465     GLN A   150
REMARK 465     ARG A   151
REMARK 465     SER A   152
REMARK 465     GLN A   153
REMARK 465     VAL A   154
REMARK 465     VAL A   155
REMARK 465     THR A   156
REMARK 465     GLY A   157
REMARK 465     ILE A   158
REMARK 465     SER A   159
REMARK 465     ASP A   160
REMARK 465     TYR A   161
REMARK 465     GLU A   162
REMARK 465     ILE A   163
REMARK 465     ARG A   164
REMARK 465     ASN A   165
REMARK 465     GLY A   166
REMARK 465     LYS A   167
REMARK 465     MET A   168
REMARK 465     ILE A   169
REMARK 465     LEU A   170
REMARK 465     MET A   171
REMARK 465     ALA A   172
REMARK 465     GLY A   173
REMARK 465     ASP A   174
REMARK 465     GLN A   175
REMARK 465     LEU A   176
REMARK 465     PHE A   177
REMARK 465     ARG A   178
REMARK 465     TYR A   179
REMARK 465     ASN A   180
REMARK 465     PRO A   181
REMARK 465     LEU A   182
REMARK 465     ASN A   183
REMARK 465     GLU A   184
REMARK 465     ALA A   185
REMARK 465     LEU A   186
REMARK 465     ALA A   187
REMARK 465     ALA A   188
REMARK 465     ILE A   189
REMARK 465     PRO A   190
REMARK 465     ILE A   191
REMARK 465     ALA A   192
REMARK 465     VAL A   193
REMARK 465     PRO A   194
REMARK 465     ASP A   195
REMARK 465     ASP A   196
REMARK 465     GLN A   197
REMARK 465     SER A   198
REMARK 465     SER A   199
REMARK 465     THR A   200
REMARK 465     GLU A   201
REMARK 465     PRO A   202
REMARK 465     MET A   203
REMARK 465     ASP A   204
REMARK 465     ILE A   205
REMARK 465     SER A   206
REMARK 465     GLU A   207
REMARK 465     GLY A   208
REMARK 465     SER A   209
REMARK 465     ILE A   210
REMARK 465     THR A   211
REMARK 465     SER A   212
REMARK 465     GLY A   213
REMARK 465     THR A   214
REMARK 465     LYS A   215
REMARK 465     GLY A   216
REMARK 465     SER A   217
REMARK 465     GLY A   218
REMARK 465     SER A   219
REMARK 465     GLU A   220
REMARK 465     ALA A   221
REMARK 465     PRO A   222
REMARK 465     GLN A   223
REMARK 465     SER A   224
REMARK 465     SER A   225
REMARK 465     THR A   226
REMARK 465     VAL A   227
REMARK 465     PRO A   228
REMARK 465     PRO A   229
REMARK 465     VAL A   230
REMARK 465     THR A   231
REMARK 465     ARG A   232
REMARK 465     ILE A   233
REMARK 465     PRO A   234
REMARK 465     ILE A   235
REMARK 465     LYS A   236
REMARK 465     LYS A   237
REMARK 465     PRO A   238
REMARK 465     THR A   239
REMARK 465     THR A   240
REMARK 465     SER A   241
REMARK 465     THR A   242
REMARK 465     GLU A   243
REMARK 465     LYS A   244
REMARK 465     PRO A   245
REMARK 465     ALA A   246
REMARK 465     THR A   247
REMARK 465     ALA A   248
REMARK 465     PRO A   249
REMARK 465     PRO A   250
REMARK 465     THR A   251
REMARK 465     ASN A   252
REMARK 465     ASN A   253
REMARK 465     PHE A   254
REMARK 465     VAL A   255
REMARK 465     SER A   256
REMARK 465     GLY A   435
REMARK 465     SER A   436
REMARK 465     ILE A   437
REMARK 465     LYS A   438
REMARK 465     GLU A   439
REMARK 465     ASP A   440
REMARK 465     ASN A   441
REMARK 465     LEU A   442
REMARK 465     GLN A   443
REMARK 465     LEU A   444
REMARK 465     SER A   445
REMARK 465     THR A   446
REMARK 465     ASP A   447
REMARK 465     LEU A   448
REMARK 465     ASN A   449
REMARK 465     MET A   450
REMARK 465     GLY A   451
REMARK 465     VAL A   452
REMARK 465     TRP A   453
REMARK 465     ASP A   454
REMARK 465     ASP A   455
REMARK 465     LYS A   456
REMARK 465     SER A   457
REMARK 465     HIS A   458
REMARK 465     GLU A   459
REMARK 465     GLU A   460
REMARK 465     THR A   461
REMARK 465     MET A   462
REMARK 465     GLU A   463
REMARK 465     LYS A   464
REMARK 465     PHE A   919
REMARK 465     GLY A   920
REMARK 465     PRO A   921
REMARK 465     THR A   922
REMARK 465     THR A   923
REMARK 465     ALA A   924
REMARK 465     ALA A   925
REMARK 465     PRO A   926
REMARK 465     ARG A   927
REMARK 465     GLN A   928
REMARK 465     GLY A   929
REMARK 465     PRO A   930
REMARK 465     LEU A   931
REMARK 465     TRP A   932
REMARK 465     SER A   933
REMARK 465     HIS A   934
REMARK 465     PRO A   935
REMARK 465     GLN A   936
REMARK 465     PHE A   937
REMARK 465     GLU A   938
REMARK 465     LYS A   939
REMARK 465     MET B     1
REMARK 465     MET B     2
REMARK 465     PHE B     3
REMARK 465     ASN B     4
REMARK 465     PHE B     5
REMARK 465     TYR B     6
REMARK 465     GLN B     7
REMARK 465     PHE B     8
REMARK 465     LEU B     9
REMARK 465     TYR B    10
REMARK 465     ASN B    11
REMARK 465     LEU B    12
REMARK 465     GLN B    13
REMARK 465     ASN B    14
REMARK 465     VAL B    15
REMARK 465     SER B    16
REMARK 465     PRO B    17
REMARK 465     PHE B    18
REMARK 465     ILE B    19
REMARK 465     ASP B    20
REMARK 465     PHE B    21
REMARK 465     SER B    22
REMARK 465     VAL B    23
REMARK 465     LEU B    24
REMARK 465     LYS B    25
REMARK 465     GLN B    26
REMARK 465     LEU B    27
REMARK 465     THR B    28
REMARK 465     HIS B    29
REMARK 465     THR B    30
REMARK 465     LYS B    31
REMARK 465     MET B    32
REMARK 465     ARG B    33
REMARK 465     TYR B   128
REMARK 465     ASN B   129
REMARK 465     VAL B   130
REMARK 465     ASP B   131
REMARK 465     SER B   132
REMARK 465     TYR B   133
REMARK 465     ILE B   134
REMARK 465     ARG B   135
REMARK 465     LYS B   136
REMARK 465     THR B   137
REMARK 465     PRO B   138
REMARK 465     PRO B   139
REMARK 465     SER B   140
REMARK 465     ALA B   141
REMARK 465     GLU B   142
REMARK 465     PHE B   143
REMARK 465     THR B   144
REMARK 465     LEU B   145
REMARK 465     GLN B   146
REMARK 465     CYS B   147
REMARK 465     GLU B   148
REMARK 465     ARG B   149
REMARK 465     GLN B   150
REMARK 465     ARG B   151
REMARK 465     SER B   152
REMARK 465     GLN B   153
REMARK 465     VAL B   154
REMARK 465     VAL B   155
REMARK 465     THR B   156
REMARK 465     GLY B   157
REMARK 465     ILE B   158
REMARK 465     SER B   159
REMARK 465     ASP B   160
REMARK 465     TYR B   161
REMARK 465     GLU B   162
REMARK 465     ILE B   163
REMARK 465     ARG B   164
REMARK 465     ASN B   165
REMARK 465     GLY B   166
REMARK 465     LYS B   167
REMARK 465     MET B   168
REMARK 465     ILE B   169
REMARK 465     LEU B   170
REMARK 465     MET B   171
REMARK 465     ALA B   172
REMARK 465     GLY B   173
REMARK 465     ASP B   174
REMARK 465     GLN B   175
REMARK 465     LEU B   176
REMARK 465     PHE B   177
REMARK 465     ARG B   178
REMARK 465     TYR B   179
REMARK 465     ASN B   180
REMARK 465     PRO B   181
REMARK 465     LEU B   182
REMARK 465     ASN B   183
REMARK 465     GLU B   184
REMARK 465     ALA B   185
REMARK 465     LEU B   186
REMARK 465     ALA B   187
REMARK 465     ALA B   188
REMARK 465     ILE B   189
REMARK 465     PRO B   190
REMARK 465     ILE B   191
REMARK 465     ALA B   192
REMARK 465     VAL B   193
REMARK 465     PRO B   194
REMARK 465     ASP B   195
REMARK 465     ASP B   196
REMARK 465     GLN B   197
REMARK 465     SER B   198
REMARK 465     SER B   199
REMARK 465     THR B   200
REMARK 465     GLU B   201
REMARK 465     PRO B   202
REMARK 465     MET B   203
REMARK 465     ASP B   204
REMARK 465     ILE B   205
REMARK 465     SER B   206
REMARK 465     GLU B   207
REMARK 465     GLY B   208
REMARK 465     SER B   209
REMARK 465     ILE B   210
REMARK 465     THR B   211
REMARK 465     SER B   212
REMARK 465     GLY B   213
REMARK 465     THR B   214
REMARK 465     LYS B   215
REMARK 465     GLY B   216
REMARK 465     SER B   217
REMARK 465     GLY B   218
REMARK 465     SER B   219
REMARK 465     GLU B   220
REMARK 465     ALA B   221
REMARK 465     PRO B   222
REMARK 465     GLN B   223
REMARK 465     SER B   224
REMARK 465     SER B   225
REMARK 465     THR B   226
REMARK 465     VAL B   227
REMARK 465     PRO B   228
REMARK 465     PRO B   229
REMARK 465     VAL B   230
REMARK 465     THR B   231
REMARK 465     ARG B   232
REMARK 465     ILE B   233
REMARK 465     PRO B   234
REMARK 465     ILE B   235
REMARK 465     LYS B   236
REMARK 465     LYS B   237
REMARK 465     PRO B   238
REMARK 465     THR B   239
REMARK 465     THR B   240
REMARK 465     SER B   241
REMARK 465     THR B   242
REMARK 465     GLU B   243
REMARK 465     LYS B   244
REMARK 465     PRO B   245
REMARK 465     ALA B   246
REMARK 465     THR B   247
REMARK 465     ALA B   248
REMARK 465     PRO B   249
REMARK 465     PRO B   250
REMARK 465     THR B   251
REMARK 465     ASN B   252
REMARK 465     ASN B   253
REMARK 465     PHE B   254
REMARK 465     VAL B   255
REMARK 465     SER B   256
REMARK 465     GLY B   435
REMARK 465     SER B   436
REMARK 465     ILE B   437
REMARK 465     LYS B   438
REMARK 465     GLU B   439
REMARK 465     ASP B   440
REMARK 465     ASN B   441
REMARK 465     LEU B   442
REMARK 465     GLN B   443
REMARK 465     LEU B   444
REMARK 465     SER B   445
REMARK 465     THR B   446
REMARK 465     ASP B   447
REMARK 465     LEU B   448
REMARK 465     ASN B   449
REMARK 465     MET B   450
REMARK 465     GLY B   451
REMARK 465     VAL B   452
REMARK 465     TRP B   453
REMARK 465     ASP B   454
REMARK 465     ASP B   455
REMARK 465     LYS B   456
REMARK 465     SER B   457
REMARK 465     HIS B   458
REMARK 465     GLU B   459
REMARK 465     GLU B   460
REMARK 465     THR B   461
REMARK 465     MET B   462
REMARK 465     GLU B   463
REMARK 465     LYS B   464
REMARK 465     PHE B   919
REMARK 465     GLY B   920
REMARK 465     PRO B   921
REMARK 465     THR B   922
REMARK 465     THR B   923
REMARK 465     ALA B   924
REMARK 465     ALA B   925
REMARK 465     PRO B   926
REMARK 465     ARG B   927
REMARK 465     GLN B   928
REMARK 465     GLY B   929
REMARK 465     PRO B   930
REMARK 465     LEU B   931
REMARK 465     TRP B   932
REMARK 465     SER B   933
REMARK 465     HIS B   934
REMARK 465     PRO B   935
REMARK 465     GLN B   936
REMARK 465     PHE B   937
REMARK 465     GLU B   938
REMARK 465     LYS B   939
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT
REMARK 500
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.
REMARK 500
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI           DISTANCE
REMARK 500   HG1  THR B    91     H    ASN B    92              1.28
REMARK 500   HG1  THR A    91     H    ASN A    92              1.28
REMARK 500   HG1  THR A   673     H    LEU A   675              1.29
REMARK 500
REMARK 500 REMARK: NULL
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    TYR A 643   CB  -  CG  -  CD1 ANGL. DEV. =  -4.3 DEGREES
REMARK 500    TYR B 643   CB  -  CG  -  CD1 ANGL. DEV. =  -4.3 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    LEU A 429      154.96     63.40
REMARK 500    TYR A 483      -69.32   -125.99
REMARK 500    TYR A 700      -72.93   -121.57
REMARK 500    LYS A 748       19.63     58.32
REMARK 500    SER A 784     -115.97     63.41
REMARK 500    ARG A 892     -137.88    -98.30
REMARK 500    TYR B 483      -68.01   -124.74
REMARK 500    TYR B 700      -72.90   -121.59
REMARK 500    LYS B 748       19.60     58.35
REMARK 500    SER B 784     -116.04     63.44
REMARK 500    ARG B 892     -137.89    -98.26
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: EMD-17582   RELATED DB: EMDB
REMARK 900 CRYO-EM STRUCTURE OF CAENORHABDITIS ELEGANS DPF-3 (APO)
DBREF  8PBA A    1   931  UNP    Q965K3   Q965K3_CAEEL     1    927
DBREF  8PBA B    1   931  UNP    Q965K3   Q965K3_CAEEL     1    927
SEQADV 8PBA SER A  217  UNP  Q965K3    CYS   213 CONFLICT
SEQADV 8PBA GLY A  218  UNP  Q965K3    SER   214 CONFLICT
SEQADV 8PBA SER A  219  UNP  Q965K3    ASN   215 CONFLICT
SEQADV 8PBA TRP A  932  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA SER A  933  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA HIS A  934  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA PRO A  935  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA GLN A  936  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA PHE A  937  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA GLU A  938  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA LYS A  939  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA SER B  217  UNP  Q965K3    CYS   213 CONFLICT
SEQADV 8PBA GLY B  218  UNP  Q965K3    SER   214 CONFLICT
SEQADV 8PBA SER B  219  UNP  Q965K3    ASN   215 CONFLICT
SEQADV 8PBA TRP B  932  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA SER B  933  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA HIS B  934  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA PRO B  935  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA GLN B  936  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA PHE B  937  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA GLU B  938  UNP  Q965K3              EXPRESSION TAG
SEQADV 8PBA LYS B  939  UNP  Q965K3              EXPRESSION TAG
SEQRES   1 A  935  MET MET PHE ASN PHE TYR GLN PHE LEU TYR ASN LEU GLN
SEQRES   2 A  935  ASN VAL SER PRO PHE ILE ASP PHE SER VAL LEU LYS GLN
SEQRES   3 A  935  LEU THR HIS THR LYS MET ARG GLU ASN GLU PRO ALA ARG
SEQRES   4 A  935  PHE GLU THR ARG SER PHE SER GLN LEU ILE ASP HIS ALA
SEQRES   5 A  935  ARG SER TRP LYS THR GLU VAL ARG GLY MET THR THR GLN
SEQRES   6 A  935  GLY PHE THR LYS ILE SER LEU MET ARG ALA GLU LYS ASP
SEQRES   7 A  935  ARG LEU ASN MET TYR ALA ILE SER SER VAL PRO GLY THR
SEQRES   8 A  935  ASN THR GLN SER ILE PHE SER VAL THR ILE PRO LEU GLU
SEQRES   9 A  935  LEU VAL GLU LYS ALA GLN VAL ALA ASP ARG LYS PHE GLU
SEQRES  10 A  935  LEU LYS LEU LYS SER GLY TYR ASN VAL ASP SER TYR ILE
SEQRES  11 A  935  ARG LYS THR PRO PRO SER ALA GLU PHE THR LEU GLN CYS
SEQRES  12 A  935  GLU ARG GLN ARG SER GLN VAL VAL THR GLY ILE SER ASP
SEQRES  13 A  935  TYR GLU ILE ARG ASN GLY LYS MET ILE LEU MET ALA GLY
SEQRES  14 A  935  ASP GLN LEU PHE ARG TYR ASN PRO LEU ASN GLU ALA LEU
SEQRES  15 A  935  ALA ALA ILE PRO ILE ALA VAL PRO ASP ASP GLN SER SER
SEQRES  16 A  935  THR GLU PRO MET ASP ILE SER GLU GLY SER ILE THR SER
SEQRES  17 A  935  GLY THR LYS GLY SER GLY SER GLU ALA PRO GLN SER SER
SEQRES  18 A  935  THR VAL PRO PRO VAL THR ARG ILE PRO ILE LYS LYS PRO
SEQRES  19 A  935  THR THR SER THR GLU LYS PRO ALA THR ALA PRO PRO THR
SEQRES  20 A  935  ASN ASN PHE VAL SER SER ALA LYS VAL CYS PRO ALA ASP
SEQRES  21 A  935  SER SER LEU LEU ALA TYR VAL LEU ASN LYS GLN VAL TYR
SEQRES  22 A  935  ILE GLU LYS ASN GLY LYS ILE ILE HIS ARG THR SER SER
SEQRES  23 A  935  ASN SER LYS HIS ILE THR ASN GLY VAL PRO SER TYR ILE
SEQRES  24 A  935  VAL GLN GLU GLU LEU GLU ARG PHE GLU GLY ILE TRP TRP
SEQRES  25 A  935  SER GLU SER LYS THR ARG LEU LEU TYR GLU HIS VAL ASN
SEQRES  26 A  935  GLU GLU LYS VAL ALA GLU SER GLN PHE GLY VAL ASN GLY
SEQRES  27 A  935  ASP PRO PRO VAL ALA PRO MET LYS TYR PRO ARG ALA GLY
SEQRES  28 A  935  THR LYS ASN ALA TYR SER THR LEU ARG MET VAL ILE LEU
SEQRES  29 A  935  GLU ASN GLY LYS ALA TYR ASP VAL PRO LEU LYS ASP GLU
SEQRES  30 A  935  VAL ILE TYR LYS HIS CYS PRO PHE TYR GLU TYR ILE THR
SEQRES  31 A  935  ARG ALA GLY PHE PHE SER ASP GLY THR THR VAL TRP VAL
SEQRES  32 A  935  GLN VAL MET SER ARG ASP GLN ALA GLN CYS SER LEU LEU
SEQRES  33 A  935  LEU ILE PRO TYR THR ASP PHE LEU LEU PRO GLU GLU LEU
SEQRES  34 A  935  GLY GLY SER ILE LYS GLU ASP ASN LEU GLN LEU SER THR
SEQRES  35 A  935  ASP LEU ASN MET GLY VAL TRP ASP ASP LYS SER HIS GLU
SEQRES  36 A  935  GLU THR MET GLU LYS PRO PRO ARG GLY LYS LEU ARG GLY
SEQRES  37 A  935  THR VAL GLN ILE HIS LYS ALA ARG ASN ASP TYR TRP ILE
SEQRES  38 A  935  ASN THR HIS ASN ALA ILE TYR PRO LEU LYS ILE THR ASP
SEQRES  39 A  935  GLU GLU HIS PRO MET TYR GLU PHE ILE TYR CYS LEU GLU
SEQRES  40 A  935  LYS PRO ASN GLY SER CYS LEU ALA LEU ILE SER ALA GLU
SEQRES  41 A  935  LEU ASP GLN ASN GLY TYR CYS ARG HIS THR GLU GLU LYS
SEQRES  42 A  935  LEU LEU MET ALA GLU ASN PHE SER ILE ASN LYS SER MET
SEQRES  43 A  935  GLY ILE VAL VAL ASP GLU VAL ARG GLU LEU VAL TYR TYR
SEQRES  44 A  935  VAL ALA ASN GLU SER HIS PRO THR GLU TRP ASN ILE CYS
SEQRES  45 A  935  VAL SER HIS TYR ARG THR GLY GLN HIS ALA GLN LEU THR
SEQRES  46 A  935  GLU SER GLY ILE CYS PHE LYS SER GLU ARG ALA ASN GLY
SEQRES  47 A  935  LYS LEU ALA LEU ASP LEU ASP HIS GLY PHE ALA CYS TYR
SEQRES  48 A  935  MET THR SER VAL GLY SER PRO ALA GLU CYS ARG PHE TYR
SEQRES  49 A  935  SER PHE ARG TRP LYS GLU ASN GLU VAL LEU PRO SER THR
SEQRES  50 A  935  VAL TYR ALA ALA ASN ILE THR VAL SER GLY HIS PRO GLY
SEQRES  51 A  935  GLN PRO ASP LEU HIS PHE ASP SER PRO GLU MET ILE GLU
SEQRES  52 A  935  PHE GLN SER LYS LYS THR GLY LEU MET HIS TYR ALA MET
SEQRES  53 A  935  ILE LEU ARG PRO SER ASN PHE ASP PRO TYR LYS LYS TYR
SEQRES  54 A  935  PRO VAL PHE HIS TYR VAL TYR GLY GLY PRO GLY ILE GLN
SEQRES  55 A  935  ILE VAL HIS ASN ASP PHE SER TRP ILE GLN TYR ILE ARG
SEQRES  56 A  935  PHE CYS ARG LEU GLY TYR VAL VAL VAL PHE ILE ASP ASN
SEQRES  57 A  935  ARG GLY SER ALA HIS ARG GLY ILE GLU PHE GLU ARG HIS
SEQRES  58 A  935  ILE HIS LYS LYS MET GLY THR VAL GLU VAL GLU ASP GLN
SEQRES  59 A  935  VAL GLU GLY LEU GLN MET LEU ALA GLU ARG THR GLY GLY
SEQRES  60 A  935  PHE MET ASP MET SER ARG VAL VAL VAL HIS GLY TRP SER
SEQRES  61 A  935  TYR GLY GLY TYR MET ALA LEU GLN MET ILE ALA LYS HIS
SEQRES  62 A  935  PRO ASN ILE TYR ARG ALA ALA ILE ALA GLY GLY ALA VAL
SEQRES  63 A  935  SER ASP TRP ARG LEU TYR ASP THR ALA TYR THR GLU ARG
SEQRES  64 A  935  TYR MET GLY TYR PRO LEU GLU GLU HIS VAL TYR GLY ALA
SEQRES  65 A  935  SER SER ILE THR GLY LEU VAL GLU LYS LEU PRO ASP GLU
SEQRES  66 A  935  PRO ASN ARG LEU MET LEU VAL HIS GLY LEU MET ASP GLU
SEQRES  67 A  935  ASN VAL HIS PHE ALA HIS LEU THR HIS LEU VAL ASP GLU
SEQRES  68 A  935  CYS ILE LYS LYS GLY LYS TRP HIS GLU LEU VAL ILE PHE
SEQRES  69 A  935  PRO ASN GLU ARG HIS GLY VAL ARG ASN ASN ASP ALA SER
SEQRES  70 A  935  ILE TYR LEU ASP ALA ARG MET MET TYR PHE ALA GLN GLN
SEQRES  71 A  935  ALA ILE GLN GLY PHE GLY PRO THR THR ALA ALA PRO ARG
SEQRES  72 A  935  GLN GLY PRO LEU TRP SER HIS PRO GLN PHE GLU LYS
SEQRES   1 B  935  MET MET PHE ASN PHE TYR GLN PHE LEU TYR ASN LEU GLN
SEQRES   2 B  935  ASN VAL SER PRO PHE ILE ASP PHE SER VAL LEU LYS GLN
SEQRES   3 B  935  LEU THR HIS THR LYS MET ARG GLU ASN GLU PRO ALA ARG
SEQRES   4 B  935  PHE GLU THR ARG SER PHE SER GLN LEU ILE ASP HIS ALA
SEQRES   5 B  935  ARG SER TRP LYS THR GLU VAL ARG GLY MET THR THR GLN
SEQRES   6 B  935  GLY PHE THR LYS ILE SER LEU MET ARG ALA GLU LYS ASP
SEQRES   7 B  935  ARG LEU ASN MET TYR ALA ILE SER SER VAL PRO GLY THR
SEQRES   8 B  935  ASN THR GLN SER ILE PHE SER VAL THR ILE PRO LEU GLU
SEQRES   9 B  935  LEU VAL GLU LYS ALA GLN VAL ALA ASP ARG LYS PHE GLU
SEQRES  10 B  935  LEU LYS LEU LYS SER GLY TYR ASN VAL ASP SER TYR ILE
SEQRES  11 B  935  ARG LYS THR PRO PRO SER ALA GLU PHE THR LEU GLN CYS
SEQRES  12 B  935  GLU ARG GLN ARG SER GLN VAL VAL THR GLY ILE SER ASP
SEQRES  13 B  935  TYR GLU ILE ARG ASN GLY LYS MET ILE LEU MET ALA GLY
SEQRES  14 B  935  ASP GLN LEU PHE ARG TYR ASN PRO LEU ASN GLU ALA LEU
SEQRES  15 B  935  ALA ALA ILE PRO ILE ALA VAL PRO ASP ASP GLN SER SER
SEQRES  16 B  935  THR GLU PRO MET ASP ILE SER GLU GLY SER ILE THR SER
SEQRES  17 B  935  GLY THR LYS GLY SER GLY SER GLU ALA PRO GLN SER SER
SEQRES  18 B  935  THR VAL PRO PRO VAL THR ARG ILE PRO ILE LYS LYS PRO
SEQRES  19 B  935  THR THR SER THR GLU LYS PRO ALA THR ALA PRO PRO THR
SEQRES  20 B  935  ASN ASN PHE VAL SER SER ALA LYS VAL CYS PRO ALA ASP
SEQRES  21 B  935  SER SER LEU LEU ALA TYR VAL LEU ASN LYS GLN VAL TYR
SEQRES  22 B  935  ILE GLU LYS ASN GLY LYS ILE ILE HIS ARG THR SER SER
SEQRES  23 B  935  ASN SER LYS HIS ILE THR ASN GLY VAL PRO SER TYR ILE
SEQRES  24 B  935  VAL GLN GLU GLU LEU GLU ARG PHE GLU GLY ILE TRP TRP
SEQRES  25 B  935  SER GLU SER LYS THR ARG LEU LEU TYR GLU HIS VAL ASN
SEQRES  26 B  935  GLU GLU LYS VAL ALA GLU SER GLN PHE GLY VAL ASN GLY
SEQRES  27 B  935  ASP PRO PRO VAL ALA PRO MET LYS TYR PRO ARG ALA GLY
SEQRES  28 B  935  THR LYS ASN ALA TYR SER THR LEU ARG MET VAL ILE LEU
SEQRES  29 B  935  GLU ASN GLY LYS ALA TYR ASP VAL PRO LEU LYS ASP GLU
SEQRES  30 B  935  VAL ILE TYR LYS HIS CYS PRO PHE TYR GLU TYR ILE THR
SEQRES  31 B  935  ARG ALA GLY PHE PHE SER ASP GLY THR THR VAL TRP VAL
SEQRES  32 B  935  GLN VAL MET SER ARG ASP GLN ALA GLN CYS SER LEU LEU
SEQRES  33 B  935  LEU ILE PRO TYR THR ASP PHE LEU LEU PRO GLU GLU LEU
SEQRES  34 B  935  GLY GLY SER ILE LYS GLU ASP ASN LEU GLN LEU SER THR
SEQRES  35 B  935  ASP LEU ASN MET GLY VAL TRP ASP ASP LYS SER HIS GLU
SEQRES  36 B  935  GLU THR MET GLU LYS PRO PRO ARG GLY LYS LEU ARG GLY
SEQRES  37 B  935  THR VAL GLN ILE HIS LYS ALA ARG ASN ASP TYR TRP ILE
SEQRES  38 B  935  ASN THR HIS ASN ALA ILE TYR PRO LEU LYS ILE THR ASP
SEQRES  39 B  935  GLU GLU HIS PRO MET TYR GLU PHE ILE TYR CYS LEU GLU
SEQRES  40 B  935  LYS PRO ASN GLY SER CYS LEU ALA LEU ILE SER ALA GLU
SEQRES  41 B  935  LEU ASP GLN ASN GLY TYR CYS ARG HIS THR GLU GLU LYS
SEQRES  42 B  935  LEU LEU MET ALA GLU ASN PHE SER ILE ASN LYS SER MET
SEQRES  43 B  935  GLY ILE VAL VAL ASP GLU VAL ARG GLU LEU VAL TYR TYR
SEQRES  44 B  935  VAL ALA ASN GLU SER HIS PRO THR GLU TRP ASN ILE CYS
SEQRES  45 B  935  VAL SER HIS TYR ARG THR GLY GLN HIS ALA GLN LEU THR
SEQRES  46 B  935  GLU SER GLY ILE CYS PHE LYS SER GLU ARG ALA ASN GLY
SEQRES  47 B  935  LYS LEU ALA LEU ASP LEU ASP HIS GLY PHE ALA CYS TYR
SEQRES  48 B  935  MET THR SER VAL GLY SER PRO ALA GLU CYS ARG PHE TYR
SEQRES  49 B  935  SER PHE ARG TRP LYS GLU ASN GLU VAL LEU PRO SER THR
SEQRES  50 B  935  VAL TYR ALA ALA ASN ILE THR VAL SER GLY HIS PRO GLY
SEQRES  51 B  935  GLN PRO ASP LEU HIS PHE ASP SER PRO GLU MET ILE GLU
SEQRES  52 B  935  PHE GLN SER LYS LYS THR GLY LEU MET HIS TYR ALA MET
SEQRES  53 B  935  ILE LEU ARG PRO SER ASN PHE ASP PRO TYR LYS LYS TYR
SEQRES  54 B  935  PRO VAL PHE HIS TYR VAL TYR GLY GLY PRO GLY ILE GLN
SEQRES  55 B  935  ILE VAL HIS ASN ASP PHE SER TRP ILE GLN TYR ILE ARG
SEQRES  56 B  935  PHE CYS ARG LEU GLY TYR VAL VAL VAL PHE ILE ASP ASN
SEQRES  57 B  935  ARG GLY SER ALA HIS ARG GLY ILE GLU PHE GLU ARG HIS
SEQRES  58 B  935  ILE HIS LYS LYS MET GLY THR VAL GLU VAL GLU ASP GLN
SEQRES  59 B  935  VAL GLU GLY LEU GLN MET LEU ALA GLU ARG THR GLY GLY
SEQRES  60 B  935  PHE MET ASP MET SER ARG VAL VAL VAL HIS GLY TRP SER
SEQRES  61 B  935  TYR GLY GLY TYR MET ALA LEU GLN MET ILE ALA LYS HIS
SEQRES  62 B  935  PRO ASN ILE TYR ARG ALA ALA ILE ALA GLY GLY ALA VAL
SEQRES  63 B  935  SER ASP TRP ARG LEU TYR ASP THR ALA TYR THR GLU ARG
SEQRES  64 B  935  TYR MET GLY TYR PRO LEU GLU GLU HIS VAL TYR GLY ALA
SEQRES  65 B  935  SER SER ILE THR GLY LEU VAL GLU LYS LEU PRO ASP GLU
SEQRES  66 B  935  PRO ASN ARG LEU MET LEU VAL HIS GLY LEU MET ASP GLU
SEQRES  67 B  935  ASN VAL HIS PHE ALA HIS LEU THR HIS LEU VAL ASP GLU
SEQRES  68 B  935  CYS ILE LYS LYS GLY LYS TRP HIS GLU LEU VAL ILE PHE
SEQRES  69 B  935  PRO ASN GLU ARG HIS GLY VAL ARG ASN ASN ASP ALA SER
SEQRES  70 B  935  ILE TYR LEU ASP ALA ARG MET MET TYR PHE ALA GLN GLN
SEQRES  71 B  935  ALA ILE GLN GLY PHE GLY PRO THR THR ALA ALA PRO ARG
SEQRES  72 B  935  GLN GLY PRO LEU TRP SER HIS PRO GLN PHE GLU LYS
HELIX    1 AA1 SER A   44  ARG A   60  1                                  17
HELIX    2 AA2 GLY A   61  THR A   63  5                                   3
HELIX    3 AA3 PRO A  102  LYS A  108  1                                   7
HELIX    4 AA4 SER A  301  GLU A  307  1                                   7
HELIX    5 AA5 ASP A  380  LYS A  385  1                                   6
HELIX    6 AA6 SER A  400  GLY A  402  5                                   3
HELIX    7 AA7 THR A  425  PHE A  427  5                                   3
HELIX    8 AA8 PHE A  712  GLN A  716  5                                   5
HELIX    9 AA9 TYR A  717  ARG A  722  1                                   6
HELIX   10 AB1 GLY A  739  ARG A  744  1                                   6
HELIX   11 AB2 HIS A  745  HIS A  747  5                                   3
HELIX   12 AB3 VAL A  753  THR A  769  1                                  17
HELIX   13 AB4 SER A  784  HIS A  797  1                                  14
HELIX   14 AB5 ASP A  812  TYR A  816  5                                   5
HELIX   15 AB6 ASP A  817  GLY A  826  1                                  10
HELIX   16 AB7 GLU A  830  SER A  837  1                                   8
HELIX   17 AB8 ILE A  839  LEU A  846  5                                   8
HELIX   18 AB9 HIS A  865  GLY A  880  1                                  16
HELIX   19 AC1 ASN A  897  GLN A  917  1                                  21
HELIX   20 AC2 SER B   44  ARG B   60  1                                  17
HELIX   21 AC3 GLY B   61  THR B   63  5                                   3
HELIX   22 AC4 PRO B  102  GLU B  107  1                                   6
HELIX   23 AC5 SER B  301  GLU B  307  1                                   7
HELIX   24 AC6 ASP B  380  LYS B  385  1                                   6
HELIX   25 AC7 SER B  400  GLY B  402  5                                   3
HELIX   26 AC8 THR B  425  PHE B  427  5                                   3
HELIX   27 AC9 PRO B  430  GLY B  434  5                                   5
HELIX   28 AD1 PHE B  712  GLN B  716  5                                   5
HELIX   29 AD2 TYR B  717  ARG B  722  1                                   6
HELIX   30 AD3 GLY B  739  ARG B  744  1                                   6
HELIX   31 AD4 HIS B  745  HIS B  747  5                                   3
HELIX   32 AD5 VAL B  753  THR B  769  1                                  17
HELIX   33 AD6 SER B  784  HIS B  797  1                                  14
HELIX   34 AD7 ASP B  812  TYR B  816  5                                   5
HELIX   35 AD8 ASP B  817  GLY B  826  1                                  10
HELIX   36 AD9 GLU B  830  SER B  837  1                                   8
HELIX   37 AE1 ILE B  839  LEU B  846  5                                   8
HELIX   38 AE2 HIS B  865  GLY B  880  1                                  16
HELIX   39 AE3 ASN B  897  GLN B  917  1                                  21
SHEET    1 AA1 5 GLU A  36  PRO A  37  0
SHEET    2 AA1 5 LYS A 691  VAL A 699  1  O  LYS A 692   N  GLU A  36
SHEET    3 AA1 5 VAL A 726  ILE A 730  1  O  VAL A 726   N  PHE A 696
SHEET    4 AA1 5 MET A 676  LEU A 682 -1  N  LEU A 682   O  VAL A 727
SHEET    5 AA1 5 GLU A 664  GLN A 669 -1  N  PHE A 668   O  HIS A 677
SHEET    1 AA2 6 GLU A  36  PRO A  37  0
SHEET    2 AA2 6 LYS A 691  VAL A 699  1  O  LYS A 692   N  GLU A  36
SHEET    3 AA2 6 MET A 773  TRP A 783  1  O  VAL A 779   N  HIS A 697
SHEET    4 AA2 6 ALA A 803  GLY A 807  1  O  ILE A 805   N  VAL A 780
SHEET    5 AA2 6 LEU A 853  GLY A 858  1  O  MET A 854   N  ALA A 806
SHEET    6 AA2 6 GLU A 884  PHE A 888  1  O  GLU A 884   N  LEU A 855
SHEET    1 AA3 8 ILE A  70  GLU A  76  0
SHEET    2 AA3 8 ARG A  79  SER A  87 -1  O  TYR A  83   N  SER A  71
SHEET    3 AA3 8 GLN A  94  ILE A 101 -1  O  PHE A  97   N  ALA A  84
SHEET    4 AA3 8 PHE A 116  SER A 122 -1  O  LYS A 121   N  SER A  98
SHEET    5 AA3 8 SER A 640  VAL A 649  1  O  ASN A 646   N  PHE A 116
SHEET    6 AA3 8 SER A 621  ARG A 631 -1  N  PHE A 627   O  ALA A 645
SHEET    7 AA3 8 GLY A 611  SER A 618 -1  N  CYS A 614   O  ARG A 626
SHEET    8 AA3 8 CYS A 594  LYS A 596 -1  N  CYS A 594   O  THR A 617
SHEET    1 AA4 8 ILE A  70  GLU A  76  0
SHEET    2 AA4 8 ARG A  79  SER A  87 -1  O  TYR A  83   N  SER A  71
SHEET    3 AA4 8 GLN A  94  ILE A 101 -1  O  PHE A  97   N  ALA A  84
SHEET    4 AA4 8 PHE A 116  SER A 122 -1  O  LYS A 121   N  SER A  98
SHEET    5 AA4 8 SER A 640  VAL A 649  1  O  ASN A 646   N  PHE A 116
SHEET    6 AA4 8 SER A 621  ARG A 631 -1  N  PHE A 627   O  ALA A 645
SHEET    7 AA4 8 GLY A 611  SER A 618 -1  N  CYS A 614   O  ARG A 626
SHEET    8 AA4 8 ALA A 605  ASP A 607 -1  N  ASP A 607   O  GLY A 611
SHEET    1 AA5 4 ALA A 258  VAL A 260  0
SHEET    2 AA5 4 LEU A 267  LEU A 272 -1  O  ALA A 269   N  LYS A 259
SHEET    3 AA5 4 GLN A 275  LYS A 280 -1  O  TYR A 277   N  TYR A 270
SHEET    4 AA5 4 LYS A 283  ARG A 287 -1  O  LYS A 283   N  LYS A 280
SHEET    1 AA6 3 ILE A 295  ASN A 297  0
SHEET    2 AA6 3 ARG A 322  ASN A 329 -1  O  VAL A 328   N  THR A 296
SHEET    3 AA6 3 ILE A 314  TRP A 316 -1  N  TRP A 315   O  LEU A 324
SHEET    1 AA7 4 ILE A 295  ASN A 297  0
SHEET    2 AA7 4 ARG A 322  ASN A 329 -1  O  VAL A 328   N  THR A 296
SHEET    3 AA7 4 TYR A 360  GLU A 369 -1  O  THR A 362   N  HIS A 327
SHEET    4 AA7 4 LYS A 372  PRO A 377 -1  O  VAL A 376   N  MET A 365
SHEET    1 AA8 2 GLU A 335  SER A 336  0
SHEET    2 AA8 2 MET A 349  LYS A 350 -1  O  MET A 349   N  SER A 336
SHEET    1 AA9 4 TYR A 390  PHE A 398  0
SHEET    2 AA9 4 THR A 404  SER A 411 -1  O  GLN A 408   N  THR A 394
SHEET    3 AA9 4 GLN A 416  PRO A 423 -1  O  ILE A 422   N  VAL A 405
SHEET    4 AA9 4 VAL A 474  ARG A 480 -1  O  ALA A 479   N  CYS A 417
SHEET    1 AB1 4 TYR A 492  PRO A 493  0
SHEET    2 AB1 4 TYR A 504  GLU A 511 -1  O  ILE A 507   N  TYR A 492
SHEET    3 AB1 4 SER A 516  LEU A 525 -1  O  ILE A 521   N  PHE A 506
SHEET    4 AB1 4 CYS A 531  THR A 534 -1  O  ARG A 532   N  GLU A 524
SHEET    1 AB2 4 TYR A 492  PRO A 493  0
SHEET    2 AB2 4 TYR A 504  GLU A 511 -1  O  ILE A 507   N  TYR A 492
SHEET    3 AB2 4 SER A 516  LEU A 525 -1  O  ILE A 521   N  PHE A 506
SHEET    4 AB2 4 LYS A 537  LEU A 538 -1  O  LYS A 537   N  LEU A 520
SHEET    1 AB3 4 VAL A 553  VAL A 554  0
SHEET    2 AB3 4 LEU A 560  HIS A 569 -1  O  TYR A 562   N  VAL A 553
SHEET    3 AB3 4 GLU A 572  HIS A 579 -1  O  CYS A 576   N  TYR A 563
SHEET    4 AB3 4 HIS A 585  GLN A 587 -1  O  ALA A 586   N  VAL A 577
SHEET    1 AB4 5 GLU B  36  PRO B  37  0
SHEET    2 AB4 5 LYS B 691  VAL B 699  1  O  LYS B 692   N  GLU B  36
SHEET    3 AB4 5 VAL B 726  ILE B 730  1  O  VAL B 726   N  PHE B 696
SHEET    4 AB4 5 MET B 676  LEU B 682 -1  N  LEU B 682   O  VAL B 727
SHEET    5 AB4 5 GLU B 664  GLN B 669 -1  N  PHE B 668   O  HIS B 677
SHEET    1 AB5 6 GLU B  36  PRO B  37  0
SHEET    2 AB5 6 LYS B 691  VAL B 699  1  O  LYS B 692   N  GLU B  36
SHEET    3 AB5 6 MET B 773  TRP B 783  1  O  VAL B 779   N  HIS B 697
SHEET    4 AB5 6 ALA B 803  GLY B 807  1  O  ILE B 805   N  VAL B 780
SHEET    5 AB5 6 LEU B 853  GLY B 858  1  O  MET B 854   N  ALA B 806
SHEET    6 AB5 6 GLU B 884  PHE B 888  1  O  GLU B 884   N  LEU B 855
SHEET    1 AB6 8 ILE B  70  GLU B  76  0
SHEET    2 AB6 8 ARG B  79  SER B  87 -1  O  TYR B  83   N  SER B  71
SHEET    3 AB6 8 GLN B  94  ILE B 101 -1  O  PHE B  97   N  ALA B  84
SHEET    4 AB6 8 PHE B 116  SER B 122 -1  O  LYS B 121   N  SER B  98
SHEET    5 AB6 8 SER B 640  VAL B 649  1  O  THR B 648   N  LEU B 120
SHEET    6 AB6 8 SER B 621  ARG B 631 -1  N  PHE B 627   O  ALA B 645
SHEET    7 AB6 8 GLY B 611  SER B 618 -1  N  CYS B 614   O  ARG B 626
SHEET    8 AB6 8 CYS B 594  LYS B 596 -1  N  CYS B 594   O  THR B 617
SHEET    1 AB7 8 ILE B  70  GLU B  76  0
SHEET    2 AB7 8 ARG B  79  SER B  87 -1  O  TYR B  83   N  SER B  71
SHEET    3 AB7 8 GLN B  94  ILE B 101 -1  O  PHE B  97   N  ALA B  84
SHEET    4 AB7 8 PHE B 116  SER B 122 -1  O  LYS B 121   N  SER B  98
SHEET    5 AB7 8 SER B 640  VAL B 649  1  O  THR B 648   N  LEU B 120
SHEET    6 AB7 8 SER B 621  ARG B 631 -1  N  PHE B 627   O  ALA B 645
SHEET    7 AB7 8 GLY B 611  SER B 618 -1  N  CYS B 614   O  ARG B 626
SHEET    8 AB7 8 ALA B 605  ASP B 607 -1  N  ASP B 607   O  GLY B 611
SHEET    1 AB8 4 ALA B 258  VAL B 260  0
SHEET    2 AB8 4 LEU B 267  LEU B 272 -1  O  ALA B 269   N  LYS B 259
SHEET    3 AB8 4 GLN B 275  LYS B 280 -1  O  TYR B 277   N  TYR B 270
SHEET    4 AB8 4 LYS B 283  ARG B 287 -1  O  LYS B 283   N  LYS B 280
SHEET    1 AB9 3 ILE B 295  ASN B 297  0
SHEET    2 AB9 3 ARG B 322  ASN B 329 -1  O  VAL B 328   N  THR B 296
SHEET    3 AB9 3 ILE B 314  TRP B 316 -1  N  TRP B 315   O  LEU B 324
SHEET    1 AC1 4 ILE B 295  ASN B 297  0
SHEET    2 AC1 4 ARG B 322  ASN B 329 -1  O  VAL B 328   N  THR B 296
SHEET    3 AC1 4 TYR B 360  GLU B 369 -1  O  THR B 362   N  HIS B 327
SHEET    4 AC1 4 LYS B 372  PRO B 377 -1  O  VAL B 376   N  MET B 365
SHEET    1 AC2 2 GLU B 335  SER B 336  0
SHEET    2 AC2 2 MET B 349  LYS B 350 -1  O  MET B 349   N  SER B 336
SHEET    1 AC3 4 TYR B 390  PHE B 398  0
SHEET    2 AC3 4 THR B 404  SER B 411 -1  O  GLN B 408   N  THR B 394
SHEET    3 AC3 4 GLN B 416  PRO B 423 -1  O  ILE B 422   N  VAL B 405
SHEET    4 AC3 4 VAL B 474  ARG B 480 -1  O  ALA B 479   N  CYS B 417
SHEET    1 AC4 4 TYR B 492  PRO B 493  0
SHEET    2 AC4 4 TYR B 504  GLU B 511 -1  O  ILE B 507   N  TYR B 492
SHEET    3 AC4 4 SER B 516  LEU B 525 -1  O  ILE B 521   N  PHE B 506
SHEET    4 AC4 4 CYS B 531  THR B 534 -1  O  ARG B 532   N  GLU B 524
SHEET    1 AC5 4 TYR B 492  PRO B 493  0
SHEET    2 AC5 4 TYR B 504  GLU B 511 -1  O  ILE B 507   N  TYR B 492
SHEET    3 AC5 4 SER B 516  LEU B 525 -1  O  ILE B 521   N  PHE B 506
SHEET    4 AC5 4 LYS B 537  LEU B 538 -1  O  LYS B 537   N  LEU B 520
SHEET    1 AC6 4 VAL B 553  VAL B 554  0
SHEET    2 AC6 4 LEU B 560  HIS B 569 -1  O  TYR B 562   N  VAL B 553
SHEET    3 AC6 4 GLU B 572  HIS B 579 -1  O  CYS B 576   N  TYR B 563
SHEET    4 AC6 4 HIS B 585  GLN B 587 -1  O  ALA B 586   N  VAL B 577
CISPEP   1 TYR A  827    PRO A  828          0         5.43
CISPEP   2 TYR B  827    PRO B  828          0         5.48
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 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
TER   11483      GLY A 918
TER   22966      GLY B 918
MASTER      591    0    0   39  112    0    0    611632    2    0  144
END