Browse entries in the PDBbind-CN Database
HEADER RNA BINDING PROTEIN/RNA 05-MAR-09 3GIB TITLE CRYSTAL STRUCTURE OF THE COMPLEX OF THE E. COLI HFQ WITH POLY(A) COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN HFQ; COMPND 3 CHAIN: A, B, C; COMPND 4 FRAGMENT: N-TERMINAL FRAGMENT (2-69); COMPND 5 SYNONYM: HOST FACTOR-I PROTEIN, HF-I, HF-1; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: 5'-R(P*AP*AP*AP*AP*AP*AP*AP*AP*A)-3'; COMPND 9 CHAIN: H; COMPND 10 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 83333; SOURCE 4 STRAIN: K-12; SOURCE 5 GENE: B4172, HFQ, JW4130; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21 NULL HFQ; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PTYB11; SOURCE 11 MOL_ID: 2; SOURCE 12 SYNTHETIC: YES KEYWDS RNA BINDING PROTEIN, HFQ-RNA COMPLEX, DEGRADOSOME COMPONENT, DNA- KEYWDS 2 BINDING, RNA-BINDING, STRESS RESPONSE, RNA BINDING PROTEIN-RNA KEYWDS 3 COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR T.M.LINK,P.VALENTIN-HANSEN,R.G.BRENNAN REVDAT 5 04-APR-18 3GIB 1 REMARK REVDAT 4 01-FEB-17 3GIB 1 TITLE REVDAT 3 13-JUL-11 3GIB 1 VERSN REVDAT 2 01-DEC-09 3GIB 1 JRNL REVDAT 1 17-NOV-09 3GIB 0 JRNL AUTH T.M.LINK,P.VALENTIN-HANSEN,R.G.BRENNAN JRNL TITL STRUCTURE OF ESCHERICHIA COLI HFQ BOUND TO POLYRIBOADENYLATE JRNL TITL 2 RNA JRNL REF PROC.NATL.ACAD.SCI.USA V. 106 19292 2009 JRNL REFN ISSN 0027-8424 JRNL PMID 19889981 JRNL DOI 10.1073/PNAS.0908744106 REMARK 2 REMARK 2 RESOLUTION. 2.40 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 REMARK 3 AUTHORS : MURSHUDOV,SKUBAK,LEBEDEV,PANNU,STEINER, REMARK 3 : NICHOLLS,WINN,LONG,VAGIN REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.40 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 44.50 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 3 NUMBER OF REFLECTIONS : 9680 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) : 0.225 REMARK 3 R VALUE (WORKING SET) : 0.223 REMARK 3 FREE R VALUE : 0.259 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.800 REMARK 3 FREE R VALUE TEST SET COUNT : 467 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.40 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.46 REMARK 3 REFLECTION IN BIN (WORKING SET) : 680 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.72 REMARK 3 BIN R VALUE (WORKING SET) : 0.2960 REMARK 3 BIN FREE R VALUE SET COUNT : 33 REMARK 3 BIN FREE R VALUE : 0.3290 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1519 REMARK 3 NUCLEIC ACID ATOMS : 199 REMARK 3 HETEROGEN ATOMS : 39 REMARK 3 SOLVENT ATOMS : 9 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 61.56 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -4.32000 REMARK 3 B22 (A**2) : 0.33000 REMARK 3 B33 (A**2) : 3.99000 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 OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.481 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.275 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.240 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 10.383 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.947 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.940 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1785 ; 0.010 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2470 ; 1.223 ; 2.133 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 188 ; 7.247 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 66 ;29.865 ;23.939 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 278 ;17.312 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 11 ;11.845 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 300 ; 0.074 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1243 ; 0.003 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 643 ; 0.204 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1168 ; 0.308 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 69 ; 0.124 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 36 ; 0.226 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 8 ; 0.221 ; 0.200 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 984 ; 2.503 ; 2.000 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1580 ; 4.187 ; 3.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 951 ; 2.229 ; 2.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 890 ; 3.495 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 3GIB COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 17-MAR-09. REMARK 100 THE DEPOSITION ID IS D_1000051895. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 01-JAN-08 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 9.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 8.3.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.02 REMARK 200 MONOCHROMATOR : GRAPHITE REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM REMARK 200 DATA SCALING SOFTWARE : SCALA 3.2.25 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 9714 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.400 REMARK 200 RESOLUTION RANGE LOW (A) : 89.087 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 6.800 REMARK 200 R MERGE (I) : 0.05100 REMARK 200 R SYM (I) : 0.05100 REMARK 200
FOR THE DATA SET : 8.1420 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.40 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.53 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.8 REMARK 200 DATA REDUNDANCY IN SHELL : 7.10 REMARK 200 R MERGE FOR SHELL (I) : 0.44600 REMARK 200 R SYM FOR SHELL (I) : 0.44600 REMARK 200
FOR SHELL : 1.700 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 45.01 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.24 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 40% MPD, 0.1 M CHES 9.5, HANGING DROP, REMARK 280 TEMPERATURE 298K, PH 9.5 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 2 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+1/2,-Z REMARK 290 4555 X+1/2,-Y+1/2,-Z 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 33.26700 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 44.48000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 33.26700 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 44.48000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL 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: OCTAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: OCTAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 8270 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 18260 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -71.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C, H REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 2 -1.000000 0.000000 0.000000 66.53400 REMARK 350 BIOMT2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 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 ALA A 2 REMARK 465 LYS A 3 REMARK 465 GLY A 4 REMARK 465 GLN A 5 REMARK 465 ALA B 2 REMARK 465 LYS B 3 REMARK 465 SER B 69 REMARK 465 ALA C 2 REMARK 465 LYS C 3 REMARK 465 GLY C 4 REMARK 465 GLN C 5 REMARK 465 VAL C 68 REMARK 465 SER C 69 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 ARG B 66 CG CD NE CZ NH1 NH2 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 NE2 GLN C 41 C2' NHE A 71 2655 1.77 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS 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,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) 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 RES CSSEQI ATM2 DEVIATION REMARK 500 A H 1 P A H 1 OP3 -0.122 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 ARG A 16 -70.15 -77.55 REMARK 500 ASN A 48 -127.67 -142.40 REMARK 500 GLN B 5 -19.58 -172.90 REMARK 500 ASN B 48 -120.41 -134.04 REMARK 500 PRO B 67 48.53 -72.35 REMARK 500 GLU C 18 1.48 -67.58 REMARK 500 ASP C 40 -156.59 -136.73 REMARK 500 ASN C 48 -110.79 -151.50 REMARK 500 REMARK 500 REMARK: NULL REMARK 615 REMARK 615 ZERO OCCUPANCY ATOM REMARK 615 THE FOLLOWING RESIDUES HAVE ATOMS MODELED WITH ZERO REMARK 615 OCCUPANCY. THE LOCATION AND PROPERTIES OF THESE ATOMS REMARK 615 MAY NOT BE RELIABLE. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 615 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 615 M RES C SSEQI REMARK 615 NHE A 70 REMARK 615 NHE A 71 REMARK 615 NHE C 70 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NHE A 70 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NHE A 71 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NHE C 70 DBREF 3GIB A 2 69 UNP P0A6X3 HFQ_ECOLI 2 69 DBREF 3GIB B 2 69 UNP P0A6X3 HFQ_ECOLI 2 69 DBREF 3GIB C 2 69 UNP P0A6X3 HFQ_ECOLI 2 69 DBREF 3GIB H 1 9 PDB 3GIB 3GIB 1 9 SEQRES 1 A 68 ALA LYS GLY GLN SER LEU GLN ASP PRO PHE LEU ASN ALA SEQRES 2 A 68 LEU ARG ARG GLU ARG VAL PRO VAL SER ILE TYR LEU VAL SEQRES 3 A 68 ASN GLY ILE LYS LEU GLN GLY GLN ILE GLU SER PHE ASP SEQRES 4 A 68 GLN PHE VAL ILE LEU LEU LYS ASN THR VAL SER GLN MET SEQRES 5 A 68 VAL TYR LYS HIS ALA ILE SER THR VAL VAL PRO SER ARG SEQRES 6 A 68 PRO VAL SER SEQRES 1 B 68 ALA LYS GLY GLN SER LEU GLN ASP PRO PHE LEU ASN ALA SEQRES 2 B 68 LEU ARG ARG GLU ARG VAL PRO VAL SER ILE TYR LEU VAL SEQRES 3 B 68 ASN GLY ILE LYS LEU GLN GLY GLN ILE GLU SER PHE ASP SEQRES 4 B 68 GLN PHE VAL ILE LEU LEU LYS ASN THR VAL SER GLN MET SEQRES 5 B 68 VAL TYR LYS HIS ALA ILE SER THR VAL VAL PRO SER ARG SEQRES 6 B 68 PRO VAL SER SEQRES 1 C 68 ALA LYS GLY GLN SER LEU GLN ASP PRO PHE LEU ASN ALA SEQRES 2 C 68 LEU ARG ARG GLU ARG VAL PRO VAL SER ILE TYR LEU VAL SEQRES 3 C 68 ASN GLY ILE LYS LEU GLN GLY GLN ILE GLU SER PHE ASP SEQRES 4 C 68 GLN PHE VAL ILE LEU LEU LYS ASN THR VAL SER GLN MET SEQRES 5 C 68 VAL TYR LYS HIS ALA ILE SER THR VAL VAL PRO SER ARG SEQRES 6 C 68 PRO VAL SER SEQRES 1 H 9 A A A A A A A A A HET NHE A 70 13 HET NHE A 71 13 HET NHE C 70 13 HETNAM NHE 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID HETSYN NHE N-CYCLOHEXYLTAURINE; CHES FORMUL 5 NHE 3(C8 H17 N O3 S) FORMUL 8 HOH *9(H2 O) HELIX 1 1 LEU A 7 GLU A 18 1 12 HELIX 2 2 LEU B 7 GLU B 18 1 12 HELIX 3 3 LEU C 7 GLU C 18 1 12 SHEET 1 A15 SER A 51 TYR A 55 0 SHEET 2 A15 VAL A 43 LYS A 47 -1 N ILE A 44 O VAL A 54 SHEET 3 A15 LYS A 31 PHE A 39 -1 N GLN A 35 O LYS A 47 SHEET 4 A15 PRO A 21 LEU A 26 -1 N VAL A 22 O GLY A 34 SHEET 5 A15 ILE A 59 PRO A 64 -1 O VAL A 63 N SER A 23 SHEET 6 A15 SER B 51 TYR B 55 -1 O MET B 53 N VAL A 62 SHEET 7 A15 VAL B 43 LYS B 47 -1 N ILE B 44 O VAL B 54 SHEET 8 A15 LYS B 31 PHE B 39 -1 N SER B 38 O LEU B 45 SHEET 9 A15 VAL B 22 LEU B 26 -1 N ILE B 24 O LEU B 32 SHEET 10 A15 ILE B 59 PRO B 64 -1 O VAL B 63 N SER B 23 SHEET 11 A15 SER C 51 TYR C 55 -1 O TYR C 55 N SER B 60 SHEET 12 A15 VAL C 43 LYS C 47 -1 N ILE C 44 O VAL C 54 SHEET 13 A15 LYS C 31 PHE C 39 -1 N GLN C 35 O LYS C 47 SHEET 14 A15 PRO C 21 LEU C 26 -1 N ILE C 24 O LEU C 32 SHEET 15 A15 ILE C 59 PRO C 64 -1 O VAL C 63 N SER C 23 SITE 1 AC1 1 HIS B 57 SITE 1 AC2 2 HIS A 57 LYS C 56 SITE 1 AC3 1 HIS C 57 CRYST1 66.534 88.960 39.635 90.00 90.00 90.00 P 21 21 2 12 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 0.015030 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011241 0.000000 0.00000 SCALE3 0.000000 0.000000 0.025230 0.00000 ATOM 1 N SER A 6 24.471 -15.969 6.179 1.00 68.32 N ATOM 2 CA SER A 6 25.288 -15.880 4.926 1.00 68.94 C ATOM 3 C SER A 6 24.940 -16.987 3.938 1.00 67.64 C ATOM 4 O SER A 6 24.393 -18.030 4.309 1.00 68.42 O ATOM 5 CB SER A 6 26.801 -15.871 5.213 1.00 69.47 C ATOM 6 OG SER A 6 27.550 -16.011 4.011 1.00 68.32 O ATOM 7 N LEU A 7 25.276 -16.740 2.675 1.00 64.43 N ATOM 8 CA LEU A 7 24.888 -17.606 1.574 1.00 60.92 C ATOM 9 C LEU A 7 26.072 -17.786 0.622 1.00 57.08 C ATOM 10 O LEU A 7 26.146 -18.760 -0.122 1.00 54.09 O ATOM 11 CB LEU A 7 23.684 -16.990 0.860 1.00 60.79 C ATOM 12 CG LEU A 7 23.330 -17.314 -0.591 1.00 62.28 C ATOM 13 CD1 LEU A 7 22.767 -18.738 -0.751 1.00 63.45 C ATOM 14 CD2 LEU A 7 22.335 -16.293 -1.081 1.00 62.13 C ATOM 15 N GLN A 8 27.004 -16.844 0.677 1.00 55.05 N ATOM 16 CA GLN A 8 28.176 -16.859 -0.181 1.00 54.03 C ATOM 17 C GLN A 8 29.153 -17.995 0.139 1.00 52.59 C ATOM 18 O GLN A 8 29.583 -18.703 -0.768 1.00 52.26 O ATOM 19 CB GLN A 8 28.902 -15.513 -0.121 1.00 51.99 C ATOM 20 CG GLN A 8 29.658 -15.209 -1.393 1.00 47.95 C ATOM 21 CD GLN A 8 30.557 -13.996 -1.277 1.00 46.12 C ATOM 22 OE1 GLN A 8 31.534 -13.860 -2.033 1.00 43.90 O ATOM 23 NE2 GLN A 8 30.247 -13.112 -0.331 1.00 39.31 N ATOM 24 N ASP A 9 29.509 -18.152 1.415 1.00 55.20 N ATOM 25 CA ASP A 9 30.468 -19.179 1.823 1.00 57.89 C ATOM 26 C ASP A 9 29.937 -20.569 1.491 1.00 58.84 C ATOM 27 O ASP A 9 30.565 -21.271 0.693 1.00 59.23 O ATOM 28 CB ASP A 9 30.837 -19.077 3.307 1.00 61.57 C ATOM 29 CG ASP A 9 31.385 -17.715 3.688 1.00 64.93 C ATOM 30 OD1 ASP A 9 31.284 -17.379 4.888 1.00 66.87 O ATOM 31 OD2 ASP A 9 31.908 -16.985 2.805 1.00 64.98 O ATOM 32 N PRO A 10 28.759 -20.945 2.051 1.00 57.92 N ATOM 33 CA PRO A 10 28.158 -22.249 1.781 1.00 56.82 C ATOM 34 C PRO A 10 28.070 -22.576 0.300 1.00 59.38 C ATOM 35 O PRO A 10 28.173 -23.742 -0.071 1.00 59.94 O ATOM 36 CB PRO A 10 26.750 -22.104 2.361 1.00 57.87 C ATOM 37 CG PRO A 10 26.915 -21.141 3.482 1.00 57.78 C ATOM 38 CD PRO A 10 27.923 -20.154 2.983 1.00 58.31 C ATOM 39 N PHE A 11 27.888 -21.552 -0.536 1.00 58.80 N ATOM 40 CA PHE A 11 27.702 -21.744 -1.970 1.00 54.83 C ATOM 41 C PHE A 11 29.024 -22.062 -2.644 1.00 55.90 C ATOM 42 O PHE A 11 29.084 -22.960 -3.494 1.00 56.11 O ATOM 43 CB PHE A 11 27.055 -20.500 -2.602 1.00 49.92 C ATOM 44 CG PHE A 11 26.923 -20.561 -4.110 1.00 46.66 C ATOM 45 CD1 PHE A 11 27.902 -20.022 -4.931 1.00 44.72 C ATOM 46 CD2 PHE A 11 25.803 -21.127 -4.703 1.00 47.26 C ATOM 47 CE1 PHE A 11 27.781 -20.061 -6.333 1.00 45.19 C ATOM 48 CE2 PHE A 11 25.663 -21.166 -6.107 1.00 48.28 C ATOM 49 CZ PHE A 11 26.653 -20.628 -6.921 1.00 47.35 C ATOM 50 N LEU A 12 30.070 -21.304 -2.293 1.00 56.50 N ATOM 51 CA LEU A 12 31.392 -21.478 -2.911 1.00 53.99 C ATOM 52 C LEU A 12 32.081 -22.737 -2.348 1.00 53.74 C ATOM 53 O LEU A 12 32.758 -23.461 -3.080 1.00 51.67 O ATOM 54 CB LEU A 12 32.267 -20.219 -2.748 1.00 53.17 C ATOM 55 CG LEU A 12 31.884 -18.904 -3.458 1.00 50.65 C ATOM 56 CD1 LEU A 12 32.491 -17.679 -2.775 1.00 47.13 C ATOM 57 CD2 LEU A 12 32.246 -18.931 -4.925 1.00 50.98 C ATOM 58 N ASN A 13 31.873 -23.000 -1.058 1.00 55.37 N ATOM 59 CA ASN A 13 32.300 -24.251 -0.419 1.00 61.30 C ATOM 60 C ASN A 13 31.830 -25.549 -1.082 1.00 64.67 C ATOM 61 O ASN A 13 32.581 -26.525 -1.122 1.00 67.70 O ATOM 62 CB ASN A 13 31.887 -24.277 1.044 1.00 61.72 C ATOM 63 CG ASN A 13 33.058 -24.162 1.985 1.00 63.93 C ATOM 64 OD1 ASN A 13 34.199 -24.480 1.632 1.00 64.65 O ATOM 65 ND2 ASN A 13 32.781 -23.723 3.207 1.00 63.50 N ATOM 66 N ALA A 14 30.601 -25.559 -1.591 1.00 64.34 N ATOM 67 CA ALA A 14 30.026 -26.754 -2.188 1.00 67.83 C ATOM 68 C ALA A 14 30.538 -26.942 -3.606 1.00 69.15 C ATOM 69 O ALA A 14 30.726 -28.075 -4.072 1.00 71.04 O ATOM 70 CB ALA A 14 28.490 -26.698 -2.163 1.00 66.40 C ATOM 71 N LEU A 15 30.758 -25.828 -4.298 1.00 68.79 N ATOM 72 CA LEU A 15 31.401 -25.864 -5.606 1.00 68.05 C ATOM 73 C LEU A 15 32.868 -26.288 -5.458 1.00 66.92 C ATOM 74 O LEU A 15 33.467 -26.806 -6.403 1.00 68.69 O ATOM 75 CB LEU A 15 31.320 -24.497 -6.288 1.00 69.19 C ATOM 76 CG LEU A 15 29.968 -23.932 -6.737 1.00 70.17 C ATOM 77 CD1 LEU A 15 30.194 -22.591 -7.418 1.00 67.48 C ATOM 78 CD2 LEU A 15 29.198 -24.890 -7.667 1.00 68.81 C ATOM 79 N ARG A 16 33.430 -26.047 -4.272 1.00 64.23 N ATOM 80 CA ARG A 16 34.792 -26.447 -3.943 1.00 63.69 C ATOM 81 C ARG A 16 34.858 -27.959 -3.625 1.00 66.53 C ATOM 82 O ARG A 16 35.396 -28.742 -4.420 1.00 63.92 O ATOM 83 CB ARG A 16 35.335 -25.600 -2.782 1.00 61.15 C ATOM 84 CG ARG A 16 36.821 -25.782 -2.543 1.00 60.17 C ATOM 85 CD ARG A 16 37.369 -25.022 -1.336 1.00 59.80 C ATOM 86 NE ARG A 16 36.766 -25.381 -0.051 1.00 61.68 N ATOM 87 CZ ARG A 16 36.922 -26.541 0.590 1.00 63.21 C ATOM 88 NH1 ARG A 16 37.653 -27.528 0.066 1.00 62.62 N ATOM 89 NH2 ARG A 16 36.319 -26.722 1.761 1.00 61.36 N ATOM 90 N ARG A 17 34.284 -28.351 -2.480 1.00 70.12 N ATOM 91 CA ARG A 17 34.243 -29.750 -2.016 1.00 71.38 C ATOM 92 C ARG A 17 33.899 -30.736 -3.119 1.00 73.13 C ATOM 93 O ARG A 17 34.488 -31.817 -3.209 1.00 77.97 O ATOM 94 CB ARG A 17 33.261 -29.918 -0.858 1.00 70.85 C ATOM 95 CG ARG A 17 33.787 -29.451 0.482 1.00 72.35 C ATOM 96 CD ARG A 17 32.670 -29.396 1.509 1.00 75.13 C ATOM 97 NE ARG A 17 33.137 -28.952 2.825 1.00 79.60 N ATOM 98 CZ ARG A 17 32.340 -28.576 3.829 1.00 84.37 C ATOM 99 NH1 ARG A 17 31.011 -28.574 3.683 1.00 85.51 N ATOM 100 NH2 ARG A 17 32.871 -28.188 4.988 1.00 84.77 N ATOM 101 N GLU A 18 32.964 -30.354 -3.971 1.00 71.81 N ATOM 102 CA GLU A 18 32.473 -31.255 -4.996 1.00 73.57 C ATOM 103 C GLU A 18 33.189 -31.079 -6.333 1.00 74.74 C ATOM 104 O GLU A 18 32.841 -31.729 -7.328 1.00 73.11 O ATOM 105 CB GLU A 18 30.956 -31.103 -5.120 1.00 74.79 C ATOM 106 CG GLU A 18 30.252 -31.461 -3.808 1.00 75.65 C ATOM 107 CD GLU A 18 28.829 -30.958 -3.718 1.00 76.09 C ATOM 108 OE1 GLU A 18 28.069 -31.126 -4.705 1.00 75.23 O ATOM 109 OE2 GLU A 18 28.478 -30.408 -2.644 1.00 75.40 O ATOM 110 N ARG A 19 34.187 -30.191 -6.334 1.00 76.50 N ATOM 111 CA ARG A 19 35.091 -29.965 -7.468 1.00 77.52 C ATOM 112 C ARG A 19 34.368 -29.715 -8.794 1.00 76.82 C ATOM 113 O ARG A 19 34.764 -30.217 -9.848 1.00 77.74 O ATOM 114 CB ARG A 19 36.120 -31.099 -7.555 1.00 81.17 C ATOM 115 CG ARG A 19 36.952 -31.229 -6.272 1.00 85.09 C ATOM 116 CD ARG A 19 37.615 -32.586 -6.123 1.00 90.10 C ATOM 117 NE ARG A 19 38.638 -32.804 -7.145 1.00 95.18 N ATOM 118 CZ ARG A 19 38.478 -33.576 -8.221 1.00 97.90 C ATOM 119 NH1 ARG A 19 37.332 -34.228 -8.420 1.00 98.41 N ATOM 120 NH2 ARG A 19 39.471 -33.703 -9.099 1.00 97.96 N ATOM 121 N VAL A 20 33.312 -28.911 -8.721 1.00 75.78 N ATOM 122 CA VAL A 20 32.476 -28.596 -9.872 1.00 75.01 C ATOM 123 C VAL A 20 33.156 -27.525 -10.736 1.00 76.80 C ATOM 124 O VAL A 20 33.666 -26.532 -10.208 1.00 77.33 O ATOM 125 CB VAL A 20 31.076 -28.076 -9.426 1.00 73.66 C ATOM 126 CG1 VAL A 20 30.048 -28.284 -10.522 1.00 73.39 C ATOM 127 CG2 VAL A 20 30.618 -28.756 -8.141 1.00 72.73 C ATOM 128 N PRO A 21 33.193 -27.739 -12.064 1.00 77.98 N ATOM 129 CA PRO A 21 33.606 -26.677 -12.986 1.00 77.60 C ATOM 130 C PRO A 21 32.696 -25.457 -12.869 1.00 76.65 C ATOM 131 O PRO A 21 31.469 -25.590 -12.889 1.00 78.28 O ATOM 132 CB PRO A 21 33.433 -27.312 -14.376 1.00 78.02 C ATOM 133 CG PRO A 21 33.403 -28.773 -14.151 1.00 77.91 C ATOM 134 CD PRO A 21 32.879 -28.999 -12.766 1.00 78.33 C ATOM 135 N VAL A 22 33.295 -24.278 -12.745 1.00 74.47 N ATOM 136 CA VAL A 22 32.527 -23.036 -12.690 1.00 70.39 C ATOM 137 C VAL A 22 32.947 -22.068 -13.780 1.00 67.58 C ATOM 138 O VAL A 22 34.104 -22.054 -14.205 1.00 67.46 O ATOM 139 CB VAL A 22 32.637 -22.331 -11.315 1.00 69.48 C ATOM 140 CG1 VAL A 22 32.212 -23.263 -10.200 1.00 68.16 C ATOM 141 CG2 VAL A 22 34.052 -21.820 -11.073 1.00 70.19 C ATOM 142 N SER A 23 31.977 -21.297 -14.255 1.00 64.02 N ATOM 143 CA SER A 23 32.248 -20.064 -14.962 1.00 62.36 C ATOM 144 C SER A 23 32.178 -18.913 -13.960 1.00 61.16 C ATOM 145 O SER A 23 31.222 -18.797 -13.184 1.00 59.02 O ATOM 146 CB SER A 23 31.250 -19.840 -16.086 1.00 61.56 C ATOM 147 OG SER A 23 31.300 -20.904 -17.005 1.00 64.31 O ATOM 148 N ILE A 24 33.223 -18.095 -13.961 1.00 59.41 N ATOM 149 CA ILE A 24 33.229 -16.836 -13.240 1.00 56.36 C ATOM 150 C ILE A 24 33.176 -15.724 -14.278 1.00 55.99 C ATOM 151 O ILE A 24 34.118 -15.528 -15.025 1.00 58.71 O ATOM 152 CB ILE A 24 34.466 -16.707 -12.328 1.00 54.48 C ATOM 153 CG1 ILE A 24 34.417 -17.791 -11.243 1.00 54.25 C ATOM 154 CG2 ILE A 24 34.546 -15.305 -11.716 1.00 53.16 C ATOM 155 CD1 ILE A 24 35.480 -17.694 -10.154 1.00 52.92 C ATOM 156 N TYR A 25 32.054 -15.025 -14.359 1.00 55.51 N ATOM 157 CA TYR A 25 31.970 -13.888 -15.265 1.00 54.21 C ATOM 158 C TYR A 25 32.395 -12.641 -14.517 1.00 50.36 C ATOM 159 O TYR A 25 32.008 -12.433 -13.371 1.00 50.17 O ATOM 160 CB TYR A 25 30.564 -13.736 -15.836 1.00 57.50 C ATOM 161 CG TYR A 25 30.156 -14.837 -16.793 1.00 59.11 C ATOM 162 CD1 TYR A 25 30.147 -14.609 -18.169 1.00 61.36 C ATOM 163 CD2 TYR A 25 29.773 -16.103 -16.331 1.00 58.23 C ATOM 164 CE1 TYR A 25 29.767 -15.596 -19.065 1.00 60.67 C ATOM 165 CE2 TYR A 25 29.387 -17.106 -17.220 1.00 58.31 C ATOM 166 CZ TYR A 25 29.385 -16.840 -18.592 1.00 61.08 C ATOM 167 OH TYR A 25 29.012 -17.808 -19.512 1.00 61.61 O ATOM 168 N LEU A 26 33.228 -11.839 -15.165 1.00 49.06 N ATOM 169 CA LEU A 26 33.756 -10.633 -14.572 1.00 47.71 C ATOM 170 C LEU A 26 32.893 -9.475 -14.996 1.00 46.64 C ATOM 171 O LEU A 26 32.170 -9.563 -15.974 1.00 49.82 O ATOM 172 CB LEU A 26 35.199 -10.389 -15.021 1.00 48.09 C ATOM 173 CG LEU A 26 36.275 -11.447 -14.768 1.00 47.24 C ATOM 174 CD1 LEU A 26 37.511 -11.021 -15.501 1.00 46.94 C ATOM 175 CD2 LEU A 26 36.592 -11.642 -13.286 1.00 44.71 C ATOM 176 N VAL A 27 33.010 -8.369 -14.281 1.00 47.69 N ATOM 177 CA VAL A 27 32.195 -7.181 -14.536 1.00 46.02 C ATOM 178 C VAL A 27 32.371 -6.616 -15.947 1.00 48.26 C ATOM 179 O VAL A 27 31.518 -5.872 -16.433 1.00 52.42 O ATOM 180 CB VAL A 27 32.427 -6.109 -13.451 1.00 44.19 C ATOM 181 CG1 VAL A 27 31.837 -6.570 -12.137 1.00 38.23 C ATOM 182 CG2 VAL A 27 33.936 -5.815 -13.282 1.00 47.06 C ATOM 183 N ASN A 28 33.461 -6.995 -16.609 1.00 51.90 N ATOM 184 CA ASN A 28 33.748 -6.557 -17.980 1.00 52.20 C ATOM 185 C ASN A 28 33.318 -7.581 -19.033 1.00 55.36 C ATOM 186 O ASN A 28 33.472 -7.341 -20.224 1.00 57.99 O ATOM 187 CB ASN A 28 35.238 -6.205 -18.148 1.00 51.58 C ATOM 188 CG ASN A 28 36.163 -7.359 -17.793 1.00 51.40 C ATOM 189 OD1 ASN A 28 35.819 -8.518 -17.969 1.00 52.63 O ATOM 190 ND2 ASN A 28 37.335 -7.042 -17.274 1.00 51.77 N ATOM 191 N GLY A 29 32.788 -8.721 -18.592 1.00 56.82 N ATOM 192 CA GLY A 29 32.237 -9.719 -19.503 1.00 58.68 C ATOM 193 C GLY A 29 33.080 -10.964 -19.714 1.00 61.15 C ATOM 194 O GLY A 29 32.563 -12.003 -20.129 1.00 61.97 O ATOM 195 N ILE A 30 34.374 -10.861 -19.426 1.00 62.68 N ATOM 196 CA ILE A 30 35.300 -11.979 -19.557 1.00 63.23 C ATOM 197 C ILE A 30 34.809 -13.171 -18.744 1.00 64.50 C ATOM 198 O ILE A 30 34.591 -13.060 -17.539 1.00 64.92 O ATOM 199 CB ILE A 30 36.745 -11.578 -19.105 1.00 63.98 C ATOM 200 CG1 ILE A 30 37.313 -10.401 -19.937 1.00 63.12 C ATOM 201 CG2 ILE A 30 37.682 -12.787 -19.084 1.00 61.71 C ATOM 202 CD1 ILE A 30 36.888 -10.347 -21.402 1.00 62.99 C ATOM 203 N LYS A 31 34.607 -14.300 -19.416 1.00 67.20 N ATOM 204 CA LYS A 31 34.272 -15.545 -18.733 1.00 68.89 C ATOM 205 C LYS A 31 35.539 -16.289 -18.354 1.00 68.30 C ATOM 206 O LYS A 31 36.457 -16.391 -19.153 1.00 71.59 O ATOM 207 CB LYS A 31 33.369 -16.441 -19.587 1.00 70.82 C ATOM 208 CG LYS A 31 33.374 -17.900 -19.131 1.00 73.15 C ATOM 209 CD LYS A 31 32.096 -18.632 -19.449 1.00 75.93 C ATOM 210 CE LYS A 31 32.018 -19.077 -20.898 1.00 76.89 C ATOM 211 NZ LYS A 31 30.798 -19.913 -21.096 1.00 78.52 N ATOM 212 N LEU A 32 35.578 -16.810 -17.134 1.00 67.55 N ATOM 213 CA LEU A 32 36.712 -17.573 -16.667 1.00 66.66 C ATOM 214 C LEU A 32 36.286 -18.998 -16.278 1.00 68.30 C ATOM 215 O LEU A 32 35.428 -19.186 -15.405 1.00 66.77 O ATOM 216 CB LEU A 32 37.391 -16.852 -15.493 1.00 65.77 C ATOM 217 CG LEU A 32 38.072 -15.482 -15.661 1.00 66.14 C ATOM 218 CD1 LEU A 32 38.752 -15.080 -14.354 1.00 64.67 C ATOM 219 CD2 LEU A 32 39.091 -15.441 -16.810 1.00 65.43 C ATOM 220 N GLN A 33 36.883 -19.992 -16.943 1.00 69.08 N ATOM 221 CA GLN A 33 36.623 -21.413 -16.664 1.00 68.27 C ATOM 222 C GLN A 33 37.647 -21.952 -15.681 1.00 66.02 C ATOM 223 O GLN A 33 38.821 -21.599 -15.739 1.00 68.01 O ATOM 224 CB GLN A 33 36.676 -22.240 -17.948 1.00 72.30 C ATOM 225 CG GLN A 33 35.554 -21.968 -18.944 1.00 77.75 C ATOM 226 CD GLN A 33 34.334 -22.873 -18.759 1.00 82.22 C ATOM 227 OE1 GLN A 33 34.340 -23.828 -17.961 1.00 82.31 O ATOM 228 NE2 GLN A 33 33.276 -22.574 -19.513 1.00 83.35 N ATOM 229 N GLY A 34 37.207 -22.818 -14.781 1.00 63.93 N ATOM 230 CA GLY A 34 38.100 -23.390 -13.784 1.00 62.15 C ATOM 231 C GLY A 34 37.295 -24.007 -12.672 1.00 61.78 C ATOM 232 O GLY A 34 36.084 -24.138 -12.799 1.00 62.03 O ATOM 233 N GLN A 35 37.976 -24.377 -11.590 1.00 62.89 N ATOM 234 CA GLN A 35 37.354 -24.948 -10.395 1.00 67.38 C ATOM 235 C GLN A 35 37.802 -24.139 -9.193 1.00 66.28 C ATOM 236 O GLN A 35 38.943 -23.675 -9.151 1.00 67.18 O ATOM 237 CB GLN A 35 37.781 -26.413 -10.183 1.00 69.77 C ATOM 238 CG GLN A 35 37.250 -27.434 -11.211 1.00 72.66 C ATOM 239 CD GLN A 35 37.714 -28.871 -10.918 1.00 72.99 C ATOM 240 OE1 GLN A 35 38.245 -29.162 -9.840 1.00 75.04 O ATOM 241 NE2 GLN A 35 37.508 -29.770 -11.879 1.00 73.45 N ATOM 242 N ILE A 36 36.922 -23.986 -8.207 1.00 64.09 N ATOM 243 CA ILE A 36 37.251 -23.204 -7.018 1.00 62.49 C ATOM 244 C ILE A 36 38.165 -24.031 -6.151 1.00 64.49 C ATOM 245 O ILE A 36 37.781 -25.088 -5.655 1.00 69.01 O ATOM 246 CB ILE A 36 35.989 -22.727 -6.235 1.00 59.49 C ATOM 247 CG1 ILE A 36 35.232 -21.712 -7.076 1.00 60.02 C ATOM 248 CG2 ILE A 36 36.366 -22.097 -4.899 1.00 53.73 C ATOM 249 CD1 ILE A 36 33.766 -21.833 -6.970 1.00 63.37 C ATOM 250 N GLU A 37 39.391 -23.554 -6.000 1.00 65.59 N ATOM 251 CA GLU A 37 40.374 -24.237 -5.190 1.00 66.33 C ATOM 252 C GLU A 37 40.223 -23.749 -3.769 1.00 64.06 C ATOM 253 O GLU A 37 40.396 -24.508 -2.820 1.00 66.55 O ATOM 254 CB GLU A 37 41.785 -23.945 -5.715 1.00 71.68 C ATOM 255 CG GLU A 37 42.911 -24.644 -4.955 1.00 77.45 C ATOM 256 CD GLU A 37 42.882 -26.161 -5.115 1.00 81.44 C ATOM 257 OE1 GLU A 37 43.140 -26.862 -4.108 1.00 83.67 O ATOM 258 OE2 GLU A 37 42.603 -26.649 -6.242 1.00 82.21 O ATOM 259 N SER A 38 39.896 -22.468 -3.633 1.00 60.07 N ATOM 260 CA SER A 38 39.868 -21.812 -2.339 1.00 51.92 C ATOM 261 C SER A 38 39.203 -20.437 -2.448 1.00 49.42 C ATOM 262 O SER A 38 38.897 -19.970 -3.551 1.00 47.32 O ATOM 263 CB SER A 38 41.286 -21.677 -1.807 1.00 52.78 C ATOM 264 OG SER A 38 41.257 -21.467 -0.412 1.00 56.98 O ATOM 265 N PHE A 39 38.961 -19.802 -1.306 1.00 44.09 N ATOM 266 CA PHE A 39 38.376 -18.478 -1.294 1.00 46.54 C ATOM 267 C PHE A 39 38.562 -17.903 0.083 1.00 47.29 C ATOM 268 O PHE A 39 38.799 -18.651 1.031 1.00 47.60 O ATOM 269 CB PHE A 39 36.869 -18.479 -1.709 1.00 49.75 C ATOM 270 CG PHE A 39 35.968 -19.289 -0.805 1.00 47.81 C ATOM 271 CD1 PHE A 39 35.385 -18.714 0.319 1.00 49.84 C ATOM 272 CD2 PHE A 39 35.696 -20.632 -1.089 1.00 49.98 C ATOM 273 CE1 PHE A 39 34.533 -19.468 1.163 1.00 51.22 C ATOM 274 CE2 PHE A 39 34.865 -21.394 -0.250 1.00 49.35 C ATOM 275 CZ PHE A 39 34.284 -20.811 0.875 1.00 49.04 C ATOM 276 N ASP A 40 38.495 -16.580 0.185 1.00 45.12 N ATOM 277 CA ASP A 40 38.306 -15.931 1.472 1.00 49.07 C ATOM 278 C ASP A 40 37.277 -14.799 1.288 1.00 48.35 C ATOM 279 O ASP A 40 36.532 -14.803 0.307 1.00 48.26 O ATOM 280 CB ASP A 40 39.630 -15.435 2.066 1.00 54.41 C ATOM 281 CG ASP A 40 40.393 -14.505 1.138 1.00 58.15 C ATOM 282 OD1 ASP A 40 39.895 -14.162 0.040 1.00 62.61 O ATOM 283 OD2 ASP A 40 41.519 -14.124 1.506 1.00 60.50 O ATOM 284 N GLN A 41 37.247 -13.851 2.217 1.00 47.86 N ATOM 285 CA GLN A 41 36.337 -12.724 2.151 1.00 53.60 C ATOM 286 C GLN A 41 36.379 -11.949 0.826 1.00 55.46 C ATOM 287 O GLN A 41 35.335 -11.540 0.324 1.00 57.39 O ATOM 288 CB GLN A 41 36.612 -11.774 3.308 1.00 58.64 C ATOM 289 CG GLN A 41 35.587 -10.657 3.451 1.00 65.14 C ATOM 290 CD GLN A 41 35.777 -9.843 4.716 1.00 69.17 C ATOM 291 OE1 GLN A 41 34.869 -9.130 5.143 1.00 71.67 O ATOM 292 NE2 GLN A 41 36.956 -9.953 5.332 1.00 70.21 N ATOM 293 N PHE A 42 37.570 -11.768 0.253 1.00 53.85 N ATOM 294 CA PHE A 42 37.732 -10.851 -0.872 1.00 49.64 C ATOM 295 C PHE A 42 38.188 -11.466 -2.186 1.00 47.38 C ATOM 296 O PHE A 42 38.008 -10.862 -3.242 1.00 45.93 O ATOM 297 CB PHE A 42 38.632 -9.690 -0.469 1.00 53.86 C ATOM 298 CG PHE A 42 38.017 -8.777 0.558 1.00 55.85 C ATOM 299 CD1 PHE A 42 36.896 -7.998 0.239 1.00 57.01 C ATOM 300 CD2 PHE A 42 38.553 -8.687 1.833 1.00 57.22 C ATOM 301 CE1 PHE A 42 36.322 -7.149 1.175 1.00 58.34 C ATOM 302 CE2 PHE A 42 37.983 -7.832 2.788 1.00 59.61 C ATOM 303 CZ PHE A 42 36.864 -7.064 2.456 1.00 57.96 C ATOM 304 N VAL A 43 38.755 -12.667 -2.134 1.00 46.36 N ATOM 305 CA VAL A 43 39.281 -13.294 -3.342 1.00 45.07 C ATOM 306 C VAL A 43 38.883 -14.752 -3.484 1.00 47.42 C ATOM 307 O VAL A 43 38.628 -15.444 -2.502 1.00 47.27 O ATOM 308 CB VAL A 43 40.837 -13.178 -3.439 1.00 45.09 C ATOM 309 CG1 VAL A 43 41.304 -11.761 -3.096 1.00 44.10 C ATOM 310 CG2 VAL A 43 41.512 -14.177 -2.530 1.00 40.85 C ATOM 311 N ILE A 44 38.837 -15.200 -4.732 1.00 49.69 N ATOM 312 CA ILE A 44 38.691 -16.597 -5.058 1.00 52.38 C ATOM 313 C ILE A 44 39.932 -17.071 -5.837 1.00 55.09 C ATOM 314 O ILE A 44 40.430 -16.370 -6.723 1.00 52.13 O ATOM 315 CB ILE A 44 37.392 -16.861 -5.878 1.00 52.64 C ATOM 316 CG1 ILE A 44 36.151 -16.501 -5.049 1.00 51.00 C ATOM 317 CG2 ILE A 44 37.328 -18.331 -6.349 1.00 50.46 C ATOM 318 CD1 ILE A 44 34.909 -16.192 -5.873 1.00 47.91 C ATOM 319 N LEU A 45 40.410 -18.268 -5.493 1.00 59.22 N ATOM 320 CA LEU A 45 41.452 -18.965 -6.248 1.00 60.37 C ATOM 321 C LEU A 45 40.833 -19.915 -7.272 1.00 57.17 C ATOM 322 O LEU A 45 40.244 -20.922 -6.916 1.00 60.57 O ATOM 323 CB LEU A 45 42.386 -19.717 -5.290 1.00 61.92 C ATOM 324 CG LEU A 45 43.727 -20.230 -5.819 1.00 65.11 C ATOM 325 CD1 LEU A 45 44.637 -19.084 -6.227 1.00 65.64 C ATOM 326 CD2 LEU A 45 44.416 -21.080 -4.760 1.00 65.46 C ATOM 327 N LEU A 46 40.972 -19.572 -8.543 1.00 56.63 N ATOM 328 CA LEU A 46 40.424 -20.335 -9.651 1.00 59.85 C ATOM 329 C LEU A 46 41.487 -21.250 -10.319 1.00 65.84 C ATOM 330 O LEU A 46 42.488 -20.769 -10.865 1.00 64.22 O ATOM 331 CB LEU A 46 39.830 -19.362 -10.670 1.00 57.01 C ATOM 332 CG LEU A 46 39.067 -19.945 -11.850 1.00 57.62 C ATOM 333 CD1 LEU A 46 37.700 -20.484 -11.411 1.00 57.32 C ATOM 334 CD2 LEU A 46 38.934 -18.902 -12.937 1.00 55.98 C ATOM 335 N LYS A 47 41.245 -22.565 -10.277 1.00 70.69 N ATOM 336 CA LYS A 47 42.205 -23.569 -10.735 1.00 73.23 C ATOM 337 C LYS A 47 41.898 -24.050 -12.148 1.00 74.91 C ATOM 338 O LYS A 47 40.829 -24.591 -12.419 1.00 75.82 O ATOM 339 CB LYS A 47 42.233 -24.762 -9.775 1.00 77.20 C ATOM 340 CG LYS A 47 43.515 -25.601 -9.826 1.00 82.11 C ATOM 341 CD LYS A 47 44.550 -25.127 -8.789 1.00 85.56 C ATOM 342 CE LYS A 47 45.994 -25.500 -9.180 1.00 87.47 C ATOM 343 NZ LYS A 47 46.231 -26.977 -9.288 1.00 88.44 N ATOM 344 N ASN A 48 42.843 -23.822 -13.049 1.00 76.20 N ATOM 345 CA ASN A 48 42.816 -24.402 -14.379 1.00 80.43 C ATOM 346 C ASN A 48 44.283 -24.738 -14.703 1.00 81.93 C ATOM 347 O ASN A 48 44.952 -25.398 -13.895 1.00 80.73 O ATOM 348 CB ASN A 48 42.197 -23.408 -15.370 1.00 82.70 C ATOM 349 CG ASN A 48 41.444 -24.089 -16.521 1.00 85.48 C ATOM 350 OD1 ASN A 48 40.875 -25.171 -16.365 1.00 86.57 O ATOM 351 ND2 ASN A 48 41.424 -23.432 -17.682 1.00 85.75 N ATOM 352 N THR A 49 44.791 -24.283 -15.848 1.00 83.63 N ATOM 353 CA THR A 49 46.227 -24.368 -16.152 1.00 85.44 C ATOM 354 C THR A 49 47.069 -23.912 -14.955 1.00 85.84 C ATOM 355 O THR A 49 48.057 -24.561 -14.597 1.00 86.27 O ATOM 356 CB THR A 49 46.576 -23.564 -17.431 1.00 86.86 C ATOM 357 OG1 THR A 49 46.374 -24.396 -18.581 1.00 88.17 O ATOM 358 CG2 THR A 49 48.022 -23.068 -17.424 1.00 87.03 C ATOM 359 N VAL A 50 46.659 -22.804 -14.334 1.00 86.50 N ATOM 360 CA VAL A 50 47.270 -22.335 -13.086 1.00 84.49 C ATOM 361 C VAL A 50 46.226 -21.875 -12.053 1.00 80.76 C ATOM 362 O VAL A 50 45.071 -21.613 -12.384 1.00 79.94 O ATOM 363 CB VAL A 50 48.333 -21.222 -13.347 1.00 86.22 C ATOM 364 CG1 VAL A 50 47.660 -19.888 -13.701 1.00 87.55 C ATOM 365 CG2 VAL A 50 49.280 -21.067 -12.147 1.00 86.30 C ATOM 366 N SER A 51 46.668 -21.802 -10.804 1.00 77.66 N ATOM 367 CA SER A 51 45.918 -21.269 -9.692 1.00 75.33 C ATOM 368 C SER A 51 46.029 -19.725 -9.648 1.00 73.97 C ATOM 369 O SER A 51 46.949 -19.180 -9.026 1.00 76.00 O ATOM 370 CB SER A 51 46.505 -21.859 -8.410 1.00 78.02 C ATOM 371 OG SER A 51 45.506 -22.340 -7.529 1.00 82.73 O ATOM 372 N GLN A 52 45.107 -19.024 -10.308 1.00 68.02 N ATOM 373 CA GLN A 52 45.077 -17.556 -10.264 1.00 62.74 C ATOM 374 C GLN A 52 44.149 -17.031 -9.176 1.00 61.61 C ATOM 375 O GLN A 52 43.203 -17.701 -8.770 1.00 62.72 O ATOM 376 CB GLN A 52 44.626 -16.980 -11.604 1.00 62.13 C ATOM 377 CG GLN A 52 43.130 -17.103 -11.855 1.00 59.65 C ATOM 378 CD GLN A 52 42.761 -16.741 -13.258 1.00 60.58 C ATOM 379 OE1 GLN A 52 42.697 -15.538 -13.570 1.00 61.98 O ATOM 380 NE2 GLN A 52 42.536 -17.661 -14.063 1.00 62.37 N ATOM 381 N MET A 53 44.410 -15.808 -8.731 1.00 58.55 N ATOM 382 CA MET A 53 43.578 -15.155 -7.735 1.00 53.86 C ATOM 383 C MET A 53 42.633 -14.116 -8.364 1.00 52.73 C ATOM 384 O MET A 53 43.091 -13.128 -8.936 1.00 55.60 O ATOM 385 CB MET A 53 44.462 -14.495 -6.702 1.00 51.03 C ATOM 386 CG MET A 53 43.700 -13.931 -5.569 1.00 51.19 C ATOM 387 SD MET A 53 44.784 -13.025 -4.513 1.00 55.03 S ATOM 388 CE MET A 53 45.372 -11.764 -5.632 1.00 55.71 C ATOM 389 N VAL A 54 41.327 -14.359 -8.263 1.00 49.32 N ATOM 390 CA VAL A 54 40.298 -13.433 -8.766 1.00 46.86 C ATOM 391 C VAL A 54 39.758 -12.609 -7.600 1.00 44.54 C ATOM 392 O VAL A 54 39.391 -13.169 -6.555 1.00 44.52 O ATOM 393 CB VAL A 54 39.135 -14.183 -9.480 1.00 48.41 C ATOM 394 CG1 VAL A 54 38.276 -13.229 -10.314 1.00 45.24 C ATOM 395 CG2 VAL A 54 39.683 -15.309 -10.371 1.00 47.47 C ATOM 396 N TYR A 55 39.751 -11.283 -7.751 1.00 40.97 N ATOM 397 CA TYR A 55 39.120 -10.402 -6.758 1.00 38.86 C ATOM 398 C TYR A 55 37.604 -10.469 -6.913 1.00 35.79 C ATOM 399 O TYR A 55 37.102 -10.402 -8.023 1.00 34.91 O ATOM 400 CB TYR A 55 39.615 -8.950 -6.887 1.00 37.26 C ATOM 401 CG TYR A 55 40.950 -8.725 -6.221 1.00 36.26 C ATOM 402 CD1 TYR A 55 41.032 -8.513 -4.851 1.00 36.20 C ATOM 403 CD2 TYR A 55 42.142 -8.786 -6.958 1.00 33.91 C ATOM 404 CE1 TYR A 55 42.275 -8.325 -4.224 1.00 35.88 C ATOM 405 CE2 TYR A 55 43.377 -8.606 -6.356 1.00 34.31 C ATOM 406 CZ TYR A 55 43.441 -8.375 -4.983 1.00 38.25 C ATOM 407 OH TYR A 55 44.672 -8.196 -4.364 1.00 38.41 O ATOM 408 N LYS A 56 36.888 -10.627 -5.803 1.00 38.65 N ATOM 409 CA LYS A 56 35.409 -10.691 -5.827 1.00 40.52 C ATOM 410 C LYS A 56 34.751 -9.422 -6.385 1.00 41.95 C ATOM 411 O LYS A 56 33.764 -9.518 -7.094 1.00 41.39 O ATOM 412 CB LYS A 56 34.863 -10.994 -4.434 1.00 39.76 C ATOM 413 CG LYS A 56 35.041 -12.439 -4.011 1.00 40.96 C ATOM 414 CD LYS A 56 34.545 -12.649 -2.608 1.00 43.82 C ATOM 415 CE LYS A 56 34.710 -14.099 -2.191 1.00 47.05 C ATOM 416 NZ LYS A 56 34.111 -14.345 -0.857 1.00 46.95 N ATOM 417 N HIS A 57 35.320 -8.245 -6.081 1.00 43.24 N ATOM 418 CA HIS A 57 34.779 -6.958 -6.565 1.00 40.16 C ATOM 419 C HIS A 57 34.771 -6.860 -8.083 1.00 41.60 C ATOM 420 O HIS A 57 34.125 -5.976 -8.647 1.00 45.73 O ATOM 421 CB HIS A 57 35.535 -5.762 -5.950 1.00 38.99 C ATOM 422 CG HIS A 57 36.995 -5.706 -6.294 1.00 35.88 C ATOM 423 ND1 HIS A 57 37.990 -5.791 -5.338 1.00 34.96 N ATOM 424 CD2 HIS A 57 37.628 -5.577 -7.486 1.00 33.20 C ATOM 425 CE1 HIS A 57 39.170 -5.710 -5.926 1.00 34.40 C ATOM 426 NE2 HIS A 57 38.979 -5.595 -7.232 1.00 34.35 N ATOM 427 N ALA A 58 35.485 -7.769 -8.747 1.00 41.86 N ATOM 428 CA ALA A 58 35.588 -7.764 -10.214 1.00 40.80 C ATOM 429 C ALA A 58 34.683 -8.827 -10.831 1.00 40.05 C ATOM 430 O ALA A 58 34.506 -8.884 -12.047 1.00 42.60 O ATOM 431 CB ALA A 58 37.045 -7.967 -10.650 1.00 37.34 C ATOM 432 N ILE A 59 34.117 -9.661 -9.973 1.00 38.83 N ATOM 433 CA ILE A 59 33.183 -10.709 -10.374 1.00 43.33 C ATOM 434 C ILE A 59 31.720 -10.216 -10.459 1.00 41.18 C ATOM 435 O ILE A 59 31.213 -9.586 -9.529 1.00 40.70 O ATOM 436 CB ILE A 59 33.279 -11.919 -9.403 1.00 42.13 C ATOM 437 CG1 ILE A 59 34.675 -12.551 -9.490 1.00 42.99 C ATOM 438 CG2 ILE A 59 32.221 -12.939 -9.725 1.00 41.22 C ATOM 439 CD1 ILE A 59 34.981 -13.589 -8.397 1.00 41.66 C ATOM 440 N SER A 60 31.056 -10.494 -11.575 1.00 42.08 N ATOM 441 CA SER A 60 29.598 -10.294 -11.648 1.00 45.26 C ATOM 442 C SER A 60 28.800 -11.546 -11.245 1.00 45.79 C ATOM 443 O SER A 60 27.875 -11.434 -10.447 1.00 46.31 O ATOM 444 CB SER A 60 29.146 -9.737 -13.003 1.00 47.10 C ATOM 445 OG SER A 60 29.327 -10.668 -14.051 1.00 50.32 O ATOM 446 N THR A 61 29.179 -12.725 -11.758 1.00 45.93 N ATOM 447 CA THR A 61 28.500 -13.991 -11.410 1.00 49.07 C ATOM 448 C THR A 61 29.425 -15.210 -11.310 1.00 51.91 C ATOM 449 O THR A 61 30.437 -15.313 -12.018 1.00 51.95 O ATOM 450 CB THR A 61 27.345 -14.360 -12.399 1.00 47.42 C ATOM 451 OG1 THR A 61 27.878 -14.540 -13.718 1.00 49.44 O ATOM 452 CG2 THR A 61 26.246 -13.269 -12.448 1.00 45.89 C ATOM 453 N VAL A 62 29.063 -16.122 -10.408 1.00 52.66 N ATOM 454 CA VAL A 62 29.623 -17.465 -10.370 1.00 53.16 C ATOM 455 C VAL A 62 28.555 -18.498 -10.774 1.00 56.66 C ATOM 456 O VAL A 62 27.640 -18.798 -9.997 1.00 54.67 O ATOM 457 CB VAL A 62 30.182 -17.813 -8.989 1.00 51.83 C ATOM 458 CG1 VAL A 62 30.848 -19.193 -9.039 1.00 51.51 C ATOM 459 CG2 VAL A 62 31.161 -16.739 -8.533 1.00 50.64 C ATOM 460 N VAL A 63 28.712 -19.039 -11.983 1.00 59.31 N ATOM 461 CA VAL A 63 27.756 -19.955 -12.618 1.00 62.43 C ATOM 462 C VAL A 63 28.269 -21.403 -12.689 1.00 65.28 C ATOM 463 O VAL A 63 29.246 -21.675 -13.383 1.00 63.54 O ATOM 464 CB VAL A 63 27.468 -19.519 -14.087 1.00 61.84 C ATOM 465 CG1 VAL A 63 26.236 -20.253 -14.651 1.00 59.60 C ATOM 466 CG2 VAL A 63 27.335 -17.995 -14.205 1.00 60.62 C ATOM 467 N PRO A 64 27.596 -22.344 -12.000 1.00 69.80 N ATOM 468 CA PRO A 64 27.906 -23.772 -12.200 1.00 73.50 C ATOM 469 C PRO A 64 27.668 -24.244 -13.643 1.00 77.90 C ATOM 470 O PRO A 64 26.682 -23.853 -14.274 1.00 78.52 O ATOM 471 CB PRO A 64 26.942 -24.478 -11.245 1.00 73.25 C ATOM 472 CG PRO A 64 26.560 -23.434 -10.235 1.00 72.76 C ATOM 473 CD PRO A 64 26.537 -22.148 -10.997 1.00 70.64 C ATOM 474 N SER A 65 28.585 -25.061 -14.160 1.00 84.87 N ATOM 475 CA SER A 65 28.467 -25.648 -15.508 1.00 91.21 C ATOM 476 C SER A 65 27.382 -26.734 -15.558 1.00 94.54 C ATOM 477 O SER A 65 26.717 -26.931 -16.581 1.00 93.71 O ATOM 478 CB SER A 65 29.809 -26.244 -15.936 1.00 91.89 C ATOM 479 OG SER A 65 30.227 -27.229 -15.001 1.00 93.01 O ATOM 480 N ARG A 66 27.237 -27.435 -14.435 1.00 99.71 N ATOM 481 CA ARG A 66 26.185 -28.420 -14.211 1.00104.67 C ATOM 482 C ARG A 66 25.543 -28.154 -12.840 1.00109.43 C ATOM 483 O ARG A 66 26.226 -27.669 -11.934 1.00110.16 O ATOM 484 CB ARG A 66 26.756 -29.845 -14.287 1.00104.29 C ATOM 485 CG ARG A 66 28.028 -30.108 -13.463 1.00103.68 C ATOM 486 CD ARG A 66 28.434 -31.573 -13.570 1.00103.42 C ATOM 487 NE ARG A 66 29.811 -31.840 -13.153 1.00102.17 N ATOM 488 CZ ARG A 66 30.186 -32.135 -11.908 1.00101.59 C ATOM 489 NH1 ARG A 66 29.293 -32.181 -10.925 1.00100.90 N ATOM 490 NH2 ARG A 66 31.463 -32.377 -11.640 1.00100.35 N ATOM 491 N PRO A 67 24.233 -28.455 -12.681 1.00114.10 N ATOM 492 CA PRO A 67 23.570 -28.201 -11.387 1.00116.91 C ATOM 493 C PRO A 67 24.184 -28.975 -10.206 1.00119.38 C ATOM 494 O PRO A 67 24.716 -30.074 -10.394 1.00119.10 O ATOM 495 CB PRO A 67 22.118 -28.642 -11.639 1.00116.69 C ATOM 496 CG PRO A 67 21.954 -28.597 -13.132 1.00115.73 C ATOM 497 CD PRO A 67 23.290 -29.015 -13.671 1.00115.00 C ATOM 498 N VAL A 68 24.112 -28.384 -9.011 1.00122.41 N ATOM 499 CA VAL A 68 24.683 -28.970 -7.789 1.00125.18 C ATOM 500 C VAL A 68 23.755 -30.068 -7.249 1.00126.65 C ATOM 501 O VAL A 68 22.708 -29.770 -6.662 1.00126.55 O ATOM 502 CB VAL A 68 24.939 -27.895 -6.682 1.00125.44 C ATOM 503 CG1 VAL A 68 26.041 -28.349 -5.732 1.00125.32 C ATOM 504 CG2 VAL A 68 25.306 -26.545 -7.291 1.00126.21 C ATOM 505 N SER A 69 24.158 -31.327 -7.449 1.00128.02 N ATOM 506 CA SER A 69 23.333 -32.525 -7.172 1.00128.56 C ATOM 507 C SER A 69 21.945 -32.486 -7.834 1.00129.07 C ATOM 508 O SER A 69 21.759 -32.993 -8.942 1.00129.26 O ATOM 509 CB SER A 69 23.215 -32.810 -5.667 1.00128.17 C ATOM 510 OG SER A 69 24.487 -33.008 -5.076 1.00127.84 O ATOM 511 OXT SER A 69 20.974 -31.954 -7.290 1.00129.17 O TER 512 SER A 69 ATOM 513 N GLY B 4 19.353 0.944 5.045 1.00 95.51 N ATOM 514 CA GLY B 4 20.488 -0.028 4.937 1.00 96.32 C ATOM 515 C GLY B 4 20.038 -1.434 4.580 1.00 95.85 C ATOM 516 O GLY B 4 20.859 -2.309 4.279 1.00 94.97 O ATOM 517 N GLN B 5 18.720 -1.634 4.601 1.00 94.44 N ATOM 518 CA GLN B 5 18.100 -2.950 4.458 1.00 92.15 C ATOM 519 C GLN B 5 16.581 -2.805 4.350 1.00 87.22 C ATOM 520 O GLN B 5 15.900 -3.705 3.867 1.00 85.85 O ATOM 521 CB GLN B 5 18.444 -3.829 5.675 1.00 94.08 C ATOM 522 CG GLN B 5 18.144 -3.164 7.045 1.00 95.09 C ATOM 523 CD GLN B 5 18.664 -3.951 8.242 1.00 95.53 C ATOM 524 OE1 GLN B 5 19.712 -4.604 8.174 1.00 97.18 O ATOM 525 NE2 GLN B 5 17.933 -3.880 9.354 1.00 95.62 N ATOM 526 N SER B 6 16.072 -1.657 4.797 1.00 83.27 N ATOM 527 CA SER B 6 14.642 -1.458 5.044 1.00 79.80 C ATOM 528 C SER B 6 13.799 -1.331 3.775 1.00 76.91 C ATOM 529 O SER B 6 12.566 -1.353 3.843 1.00 78.15 O ATOM 530 CB SER B 6 14.417 -0.246 5.963 1.00 80.56 C ATOM 531 OG SER B 6 14.357 0.968 5.231 1.00 80.07 O ATOM 532 N LEU B 7 14.464 -1.181 2.632 1.00 71.71 N ATOM 533 CA LEU B 7 13.796 -1.182 1.341 1.00 65.69 C ATOM 534 C LEU B 7 14.261 -2.402 0.552 1.00 62.00 C ATOM 535 O LEU B 7 13.458 -3.069 -0.099 1.00 62.20 O ATOM 536 CB LEU B 7 14.096 0.104 0.565 1.00 67.60 C ATOM 537 CG LEU B 7 13.077 0.744 -0.400 1.00 70.28 C ATOM 538 CD1 LEU B 7 13.786 1.442 -1.565 1.00 68.70 C ATOM 539 CD2 LEU B 7 12.017 -0.228 -0.950 1.00 70.84 C ATOM 540 N GLN B 8 15.556 -2.702 0.627 1.00 57.32 N ATOM 541 CA GLN B 8 16.139 -3.813 -0.135 1.00 53.95 C ATOM 542 C GLN B 8 15.620 -5.204 0.265 1.00 53.36 C ATOM 543 O GLN B 8 15.265 -6.013 -0.596 1.00 52.34 O ATOM 544 CB GLN B 8 17.679 -3.796 -0.096 1.00 49.72 C ATOM 545 CG GLN B 8 18.274 -4.526 -1.279 1.00 45.66 C ATOM 546 CD GLN B 8 19.785 -4.641 -1.247 1.00 46.89 C ATOM 547 OE1 GLN B 8 20.465 -3.959 -0.481 1.00 44.22 O ATOM 548 NE2 GLN B 8 20.320 -5.507 -2.094 1.00 39.08 N ATOM 549 N ASP B 9 15.599 -5.493 1.557 1.00 53.94 N ATOM 550 CA ASP B 9 15.180 -6.817 1.998 1.00 60.18 C ATOM 551 C ASP B 9 13.694 -7.141 1.736 1.00 60.73 C ATOM 552 O ASP B 9 13.408 -8.197 1.166 1.00 64.70 O ATOM 553 CB ASP B 9 15.613 -7.085 3.439 1.00 64.15 C ATOM 554 CG ASP B 9 17.130 -7.203 3.579 1.00 66.32 C ATOM 555 OD1 ASP B 9 17.825 -7.401 2.553 1.00 66.26 O ATOM 556 OD2 ASP B 9 17.623 -7.098 4.721 1.00 68.04 O ATOM 557 N PRO B 10 12.757 -6.240 2.122 1.00 59.56 N ATOM 558 CA PRO B 10 11.344 -6.352 1.702 1.00 57.82 C ATOM 559 C PRO B 10 11.164 -6.505 0.204 1.00 56.34 C ATOM 560 O PRO B 10 10.418 -7.372 -0.246 1.00 57.27 O ATOM 561 CB PRO B 10 10.736 -5.019 2.148 1.00 59.59 C ATOM 562 CG PRO B 10 11.552 -4.623 3.329 1.00 61.32 C ATOM 563 CD PRO B 10 12.956 -5.092 3.032 1.00 60.81 C ATOM 564 N PHE B 11 11.840 -5.669 -0.575 1.00 55.23 N ATOM 565 CA PHE B 11 11.732 -5.776 -2.018 1.00 49.89 C ATOM 566 C PHE B 11 12.100 -7.174 -2.493 1.00 50.16 C ATOM 567 O PHE B 11 11.325 -7.802 -3.209 1.00 51.88 O ATOM 568 CB PHE B 11 12.605 -4.750 -2.718 1.00 47.06 C ATOM 569 CG PHE B 11 12.394 -4.697 -4.202 1.00 45.25 C ATOM 570 CD1 PHE B 11 13.227 -5.383 -5.059 1.00 43.75 C ATOM 571 CD2 PHE B 11 11.351 -3.964 -4.739 1.00 46.45 C ATOM 572 CE1 PHE B 11 13.028 -5.336 -6.430 1.00 43.84 C ATOM 573 CE2 PHE B 11 11.146 -3.914 -6.116 1.00 44.79 C ATOM 574 CZ PHE B 11 11.990 -4.604 -6.956 1.00 43.93 C ATOM 575 N LEU B 12 13.277 -7.654 -2.094 1.00 49.55 N ATOM 576 CA LEU B 12 13.804 -8.922 -2.605 1.00 48.30 C ATOM 577 C LEU B 12 13.085 -10.140 -2.017 1.00 47.32 C ATOM 578 O LEU B 12 12.827 -11.098 -2.731 1.00 44.49 O ATOM 579 CB LEU B 12 15.325 -9.016 -2.394 1.00 46.29 C ATOM 580 CG LEU B 12 16.256 -8.097 -3.194 1.00 43.45 C ATOM 581 CD1 LEU B 12 17.625 -8.085 -2.578 1.00 40.71 C ATOM 582 CD2 LEU B 12 16.349 -8.508 -4.664 1.00 41.95 C ATOM 583 N ASN B 13 12.767 -10.098 -0.724 1.00 49.72 N ATOM 584 CA ASN B 13 11.948 -11.145 -0.106 1.00 55.97 C ATOM 585 C ASN B 13 10.545 -11.337 -0.707 1.00 58.67 C ATOM 586 O ASN B 13 10.045 -12.470 -0.745 1.00 58.98 O ATOM 587 CB ASN B 13 11.842 -10.954 1.409 1.00 59.79 C ATOM 588 CG ASN B 13 12.647 -11.987 2.182 1.00 64.20 C ATOM 589 OD1 ASN B 13 12.788 -13.145 1.750 1.00 66.47 O ATOM 590 ND2 ASN B 13 13.183 -11.578 3.331 1.00 64.13 N ATOM 591 N ALA B 14 9.923 -10.244 -1.168 1.00 56.20 N ATOM 592 CA ALA B 14 8.604 -10.307 -1.815 1.00 55.98 C ATOM 593 C ALA B 14 8.702 -11.072 -3.121 1.00 57.88 C ATOM 594 O ALA B 14 7.869 -11.939 -3.418 1.00 57.36 O ATOM 595 CB ALA B 14 8.032 -8.906 -2.055 1.00 49.29 C ATOM 596 N LEU B 15 9.739 -10.746 -3.889 1.00 58.52 N ATOM 597 CA LEU B 15 10.022 -11.409 -5.156 1.00 57.90 C ATOM 598 C LEU B 15 10.417 -12.879 -4.960 1.00 59.13 C ATOM 599 O LEU B 15 10.115 -13.716 -5.807 1.00 62.06 O ATOM 600 CB LEU B 15 11.123 -10.662 -5.910 1.00 56.74 C ATOM 601 CG LEU B 15 10.931 -9.213 -6.370 1.00 56.67 C ATOM 602 CD1 LEU B 15 12.226 -8.724 -7.038 1.00 54.05 C ATOM 603 CD2 LEU B 15 9.746 -9.067 -7.330 1.00 54.60 C ATOM 604 N ARG B 16 11.091 -13.182 -3.849 1.00 60.00 N ATOM 605 CA ARG B 16 11.448 -14.560 -3.499 1.00 61.98 C ATOM 606 C ARG B 16 10.236 -15.404 -3.058 1.00 63.80 C ATOM 607 O ARG B 16 9.966 -16.471 -3.632 1.00 61.48 O ATOM 608 CB ARG B 16 12.515 -14.572 -2.406 1.00 62.11 C ATOM 609 CG ARG B 16 13.068 -15.950 -2.083 1.00 61.48 C ATOM 610 CD ARG B 16 13.987 -15.888 -0.900 1.00 64.59 C ATOM 611 NE ARG B 16 13.240 -15.595 0.312 1.00 69.47 N ATOM 612 CZ ARG B 16 12.920 -16.503 1.227 1.00 72.10 C ATOM 613 NH1 ARG B 16 13.306 -17.768 1.078 1.00 74.05 N ATOM 614 NH2 ARG B 16 12.225 -16.142 2.298 1.00 72.26 N ATOM 615 N ARG B 17 9.527 -14.921 -2.036 1.00 66.41 N ATOM 616 CA ARG B 17 8.348 -15.606 -1.484 1.00 69.37 C ATOM 617 C ARG B 17 7.237 -15.833 -2.511 1.00 68.94 C ATOM 618 O ARG B 17 6.554 -16.862 -2.463 1.00 71.37 O ATOM 619 CB ARG B 17 7.800 -14.858 -0.265 1.00 69.42 C ATOM 620 CG ARG B 17 8.695 -14.949 0.977 1.00 72.46 C ATOM 621 CD ARG B 17 8.078 -14.195 2.146 1.00 75.03 C ATOM 622 NE ARG B 17 8.950 -14.163 3.326 1.00 81.35 N ATOM 623 CZ ARG B 17 8.613 -13.636 4.509 1.00 84.33 C ATOM 624 NH1 ARG B 17 7.413 -13.087 4.692 1.00 85.82 N ATOM 625 NH2 ARG B 17 9.481 -13.652 5.518 1.00 85.01 N ATOM 626 N GLU B 18 7.081 -14.894 -3.445 1.00 67.51 N ATOM 627 CA GLU B 18 6.029 -14.960 -4.471 1.00 66.49 C ATOM 628 C GLU B 18 6.494 -15.504 -5.818 1.00 65.61 C ATOM 629 O GLU B 18 5.692 -15.616 -6.744 1.00 63.64 O ATOM 630 CB GLU B 18 5.356 -13.589 -4.656 1.00 69.64 C ATOM 631 CG GLU B 18 4.547 -13.120 -3.441 1.00 72.77 C ATOM 632 CD GLU B 18 3.530 -14.164 -2.984 1.00 76.31 C ATOM 633 OE1 GLU B 18 2.672 -14.551 -3.818 1.00 77.39 O ATOM 634 OE2 GLU B 18 3.601 -14.602 -1.806 1.00 75.24 O ATOM 635 N ARG B 19 7.788 -15.816 -5.927 1.00 66.27 N ATOM 636 CA ARG B 19 8.362 -16.493 -7.103 1.00 67.15 C ATOM 637 C ARG B 19 8.159 -15.739 -8.429 1.00 65.80 C ATOM 638 O ARG B 19 7.926 -16.343 -9.484 1.00 66.78 O ATOM 639 CB ARG B 19 7.880 -17.954 -7.178 1.00 68.63 C ATOM 640 CG ARG B 19 8.578 -18.871 -6.165 1.00 70.72 C ATOM 641 CD ARG B 19 7.872 -20.212 -6.005 1.00 73.70 C ATOM 642 NE ARG B 19 8.809 -21.341 -5.952 1.00 78.00 N ATOM 643 CZ ARG B 19 9.320 -21.875 -4.839 1.00 79.19 C ATOM 644 NH1 ARG B 19 9.000 -21.396 -3.637 1.00 79.45 N ATOM 645 NH2 ARG B 19 10.166 -22.896 -4.935 1.00 78.11 N ATOM 646 N VAL B 20 8.282 -14.415 -8.354 1.00 64.72 N ATOM 647 CA VAL B 20 8.167 -13.515 -9.502 1.00 62.05 C ATOM 648 C VAL B 20 9.422 -13.607 -10.389 1.00 61.60 C ATOM 649 O VAL B 20 10.550 -13.488 -9.889 1.00 62.88 O ATOM 650 CB VAL B 20 8.000 -12.034 -9.024 1.00 62.05 C ATOM 651 CG1 VAL B 20 7.570 -11.121 -10.160 1.00 62.38 C ATOM 652 CG2 VAL B 20 7.023 -11.928 -7.865 1.00 62.08 C ATOM 653 N PRO B 21 9.238 -13.852 -11.703 1.00 60.84 N ATOM 654 CA PRO B 21 10.337 -13.741 -12.654 1.00 59.34 C ATOM 655 C PRO B 21 10.939 -12.332 -12.660 1.00 61.18 C ATOM 656 O PRO B 21 10.218 -11.330 -12.768 1.00 60.76 O ATOM 657 CB PRO B 21 9.665 -14.032 -13.998 1.00 60.25 C ATOM 658 CG PRO B 21 8.505 -14.880 -13.645 1.00 60.77 C ATOM 659 CD PRO B 21 8.000 -14.291 -12.369 1.00 60.84 C ATOM 660 N VAL B 22 12.257 -12.264 -12.526 1.00 60.11 N ATOM 661 CA VAL B 22 12.943 -10.990 -12.514 1.00 56.98 C ATOM 662 C VAL B 22 13.877 -10.852 -13.712 1.00 56.15 C ATOM 663 O VAL B 22 14.391 -11.848 -14.227 1.00 55.98 O ATOM 664 CB VAL B 22 13.727 -10.792 -11.188 1.00 56.50 C ATOM 665 CG1 VAL B 22 12.793 -10.868 -10.017 1.00 55.75 C ATOM 666 CG2 VAL B 22 14.830 -11.826 -11.035 1.00 53.53 C ATOM 667 N SER B 23 14.045 -9.617 -14.179 1.00 53.10 N ATOM 668 CA SER B 23 15.238 -9.243 -14.918 1.00 52.85 C ATOM 669 C SER B 23 16.200 -8.564 -13.925 1.00 52.80 C ATOM 670 O SER B 23 15.805 -7.662 -13.177 1.00 47.44 O ATOM 671 CB SER B 23 14.933 -8.297 -16.078 1.00 51.78 C ATOM 672 OG SER B 23 14.066 -8.877 -17.020 1.00 53.88 O ATOM 673 N ILE B 24 17.444 -9.041 -13.897 1.00 51.00 N ATOM 674 CA ILE B 24 18.513 -8.369 -13.180 1.00 48.62 C ATOM 675 C ILE B 24 19.464 -7.830 -14.231 1.00 46.44 C ATOM 676 O ILE B 24 20.130 -8.601 -14.902 1.00 44.75 O ATOM 677 CB ILE B 24 19.287 -9.327 -12.236 1.00 46.17 C ATOM 678 CG1 ILE B 24 18.372 -9.892 -11.157 1.00 44.60 C ATOM 679 CG2 ILE B 24 20.447 -8.596 -11.581 1.00 45.16 C ATOM 680 CD1 ILE B 24 18.986 -10.951 -10.306 1.00 44.07 C ATOM 681 N TYR B 25 19.525 -6.515 -14.387 1.00 46.40 N ATOM 682 CA TYR B 25 20.500 -5.931 -15.310 1.00 49.62 C ATOM 683 C TYR B 25 21.819 -5.697 -14.584 1.00 46.56 C ATOM 684 O TYR B 25 21.827 -5.202 -13.458 1.00 45.36 O ATOM 685 CB TYR B 25 19.991 -4.611 -15.893 1.00 54.84 C ATOM 686 CG TYR B 25 18.720 -4.731 -16.699 1.00 56.71 C ATOM 687 CD1 TYR B 25 18.764 -4.734 -18.087 1.00 57.73 C ATOM 688 CD2 TYR B 25 17.465 -4.842 -16.067 1.00 56.86 C ATOM 689 CE1 TYR B 25 17.603 -4.830 -18.839 1.00 59.90 C ATOM 690 CE2 TYR B 25 16.297 -4.945 -16.801 1.00 57.69 C ATOM 691 CZ TYR B 25 16.372 -4.940 -18.194 1.00 59.75 C ATOM 692 OH TYR B 25 15.227 -5.040 -18.951 1.00 58.99 O ATOM 693 N LEU B 26 22.925 -6.061 -15.222 1.00 45.28 N ATOM 694 CA LEU B 26 24.255 -5.884 -14.626 1.00 44.86 C ATOM 695 C LEU B 26 24.829 -4.543 -15.010 1.00 43.11 C ATOM 696 O LEU B 26 24.399 -3.951 -15.992 1.00 46.97 O ATOM 697 CB LEU B 26 25.207 -7.016 -15.033 1.00 44.33 C ATOM 698 CG LEU B 26 24.793 -8.452 -14.675 1.00 43.42 C ATOM 699 CD1 LEU B 26 25.832 -9.420 -15.204 1.00 45.93 C ATOM 700 CD2 LEU B 26 24.553 -8.703 -13.189 1.00 40.80 C ATOM 701 N VAL B 27 25.802 -4.056 -14.245 1.00 46.01 N ATOM 702 CA VAL B 27 26.440 -2.755 -14.537 1.00 44.51 C ATOM 703 C VAL B 27 27.026 -2.650 -15.955 1.00 45.95 C ATOM 704 O VAL B 27 27.257 -1.564 -16.452 1.00 48.02 O ATOM 705 CB VAL B 27 27.525 -2.399 -13.505 1.00 44.07 C ATOM 706 CG1 VAL B 27 26.913 -2.084 -12.151 1.00 40.67 C ATOM 707 CG2 VAL B 27 28.539 -3.531 -13.392 1.00 47.20 C ATOM 708 N ASN B 28 27.272 -3.786 -16.598 1.00 51.31 N ATOM 709 CA ASN B 28 27.784 -3.818 -17.975 1.00 51.73 C ATOM 710 C ASN B 28 26.670 -3.901 -19.044 1.00 53.17 C ATOM 711 O ASN B 28 26.948 -3.931 -20.247 1.00 54.93 O ATOM 712 CB ASN B 28 28.755 -4.981 -18.134 1.00 50.74 C ATOM 713 CG ASN B 28 28.109 -6.303 -17.830 1.00 53.06 C ATOM 714 OD1 ASN B 28 26.890 -6.414 -17.859 1.00 54.12 O ATOM 715 ND2 ASN B 28 28.915 -7.316 -17.531 1.00 53.42 N ATOM 716 N GLY B 29 25.418 -3.949 -18.598 1.00 52.38 N ATOM 717 CA GLY B 29 24.282 -3.980 -19.501 1.00 53.06 C ATOM 718 C GLY B 29 23.673 -5.349 -19.758 1.00 53.28 C ATOM 719 O GLY B 29 22.585 -5.437 -20.328 1.00 55.94 O ATOM 720 N ILE B 30 24.364 -6.413 -19.357 1.00 53.35 N ATOM 721 CA ILE B 30 23.844 -7.781 -19.503 1.00 54.40 C ATOM 722 C ILE B 30 22.519 -7.925 -18.733 1.00 54.66 C ATOM 723 O ILE B 30 22.366 -7.388 -17.636 1.00 53.99 O ATOM 724 CB ILE B 30 24.899 -8.853 -19.049 1.00 55.13 C ATOM 725 CG1 ILE B 30 26.237 -8.717 -19.822 1.00 57.32 C ATOM 726 CG2 ILE B 30 24.335 -10.276 -19.088 1.00 53.40 C ATOM 727 CD1 ILE B 30 26.149 -8.628 -21.346 1.00 59.05 C ATOM 728 N LYS B 31 21.551 -8.607 -19.332 1.00 56.17 N ATOM 729 CA LYS B 31 20.269 -8.851 -18.683 1.00 57.07 C ATOM 730 C LYS B 31 20.239 -10.295 -18.250 1.00 57.17 C ATOM 731 O LYS B 31 20.438 -11.193 -19.064 1.00 60.16 O ATOM 732 CB LYS B 31 19.114 -8.574 -19.638 1.00 60.02 C ATOM 733 CG LYS B 31 17.735 -8.560 -18.991 1.00 64.76 C ATOM 734 CD LYS B 31 16.615 -8.778 -20.018 1.00 67.50 C ATOM 735 CE LYS B 31 16.405 -7.545 -20.883 1.00 71.87 C ATOM 736 NZ LYS B 31 15.040 -7.474 -21.477 1.00 73.88 N ATOM 737 N LEU B 32 20.033 -10.524 -16.961 1.00 53.41 N ATOM 738 CA LEU B 32 19.869 -11.875 -16.473 1.00 52.75 C ATOM 739 C LEU B 32 18.412 -12.093 -16.073 1.00 52.76 C ATOM 740 O LEU B 32 17.729 -11.159 -15.647 1.00 52.67 O ATOM 741 CB LEU B 32 20.848 -12.197 -15.339 1.00 50.62 C ATOM 742 CG LEU B 32 22.360 -12.083 -15.626 1.00 51.45 C ATOM 743 CD1 LEU B 32 23.186 -12.365 -14.376 1.00 47.59 C ATOM 744 CD2 LEU B 32 22.822 -12.964 -16.779 1.00 48.64 C ATOM 745 N GLN B 33 17.928 -13.321 -16.245 1.00 54.82 N ATOM 746 CA GLN B 33 16.518 -13.629 -15.997 1.00 53.83 C ATOM 747 C GLN B 33 16.400 -14.925 -15.249 1.00 52.82 C ATOM 748 O GLN B 33 17.147 -15.874 -15.504 1.00 54.87 O ATOM 749 CB GLN B 33 15.737 -13.708 -17.301 1.00 55.30 C ATOM 750 CG GLN B 33 15.718 -12.418 -18.089 1.00 59.74 C ATOM 751 CD GLN B 33 14.832 -12.492 -19.310 1.00 65.72 C ATOM 752 OE1 GLN B 33 13.860 -13.254 -19.348 1.00 67.13 O ATOM 753 NE2 GLN B 33 15.155 -11.692 -20.318 1.00 68.06 N ATOM 754 N GLY B 34 15.461 -14.958 -14.314 1.00 50.39 N ATOM 755 CA GLY B 34 15.246 -16.134 -13.495 1.00 49.87 C ATOM 756 C GLY B 34 14.381 -15.743 -12.322 1.00 51.47 C ATOM 757 O GLY B 34 13.555 -14.838 -12.431 1.00 50.57 O ATOM 758 N GLN B 35 14.568 -16.434 -11.203 1.00 51.39 N ATOM 759 CA GLN B 35 13.864 -16.117 -9.992 1.00 54.66 C ATOM 760 C GLN B 35 14.834 -16.099 -8.828 1.00 55.23 C ATOM 761 O GLN B 35 15.841 -16.808 -8.826 1.00 54.68 O ATOM 762 CB GLN B 35 12.756 -17.140 -9.735 1.00 62.34 C ATOM 763 CG GLN B 35 11.614 -17.076 -10.754 1.00 68.98 C ATOM 764 CD GLN B 35 10.786 -18.352 -10.796 1.00 74.44 C ATOM 765 OE1 GLN B 35 9.628 -18.331 -11.221 1.00 76.89 O ATOM 766 NE2 GLN B 35 11.373 -19.468 -10.350 1.00 75.91 N ATOM 767 N ILE B 36 14.511 -15.277 -7.839 1.00 54.36 N ATOM 768 CA ILE B 36 15.336 -15.097 -6.667 1.00 54.38 C ATOM 769 C ILE B 36 15.136 -16.294 -5.758 1.00 56.54 C ATOM 770 O ILE B 36 14.119 -16.404 -5.070 1.00 58.74 O ATOM 771 CB ILE B 36 15.029 -13.731 -5.975 1.00 52.00 C ATOM 772 CG1 ILE B 36 15.520 -12.602 -6.873 1.00 53.17 C ATOM 773 CG2 ILE B 36 15.687 -13.624 -4.607 1.00 50.09 C ATOM 774 CD1 ILE B 36 14.792 -11.306 -6.714 1.00 54.80 C ATOM 775 N GLU B 37 16.108 -17.207 -5.803 1.00 58.19 N ATOM 776 CA GLU B 37 16.143 -18.379 -4.935 1.00 58.68 C ATOM 777 C GLU B 37 16.376 -17.973 -3.490 1.00 56.96 C ATOM 778 O GLU B 37 15.666 -18.423 -2.597 1.00 56.91 O ATOM 779 CB GLU B 37 17.248 -19.337 -5.378 1.00 65.70 C ATOM 780 CG GLU B 37 16.775 -20.566 -6.127 1.00 73.43 C ATOM 781 CD GLU B 37 17.717 -21.752 -5.942 1.00 77.51 C ATOM 782 OE1 GLU B 37 18.223 -21.952 -4.807 1.00 79.00 O ATOM 783 OE2 GLU B 37 17.946 -22.488 -6.932 1.00 79.91 O ATOM 784 N SER B 38 17.401 -17.144 -3.272 1.00 54.96 N ATOM 785 CA SER B 38 17.648 -16.476 -1.989 1.00 52.80 C ATOM 786 C SER B 38 18.690 -15.374 -2.169 1.00 49.76 C ATOM 787 O SER B 38 19.097 -15.085 -3.294 1.00 50.30 O ATOM 788 CB SER B 38 18.056 -17.460 -0.881 1.00 53.91 C ATOM 789 OG SER B 38 19.394 -17.881 -1.036 1.00 56.46 O ATOM 790 N PHE B 39 19.107 -14.766 -1.062 1.00 45.63 N ATOM 791 CA PHE B 39 19.983 -13.608 -1.087 1.00 47.61 C ATOM 792 C PHE B 39 20.559 -13.368 0.301 1.00 49.82 C ATOM 793 O PHE B 39 20.019 -13.859 1.292 1.00 47.78 O ATOM 794 CB PHE B 39 19.237 -12.348 -1.588 1.00 50.45 C ATOM 795 CG PHE B 39 18.100 -11.904 -0.700 1.00 50.83 C ATOM 796 CD1 PHE B 39 18.303 -10.955 0.292 1.00 51.18 C ATOM 797 CD2 PHE B 39 16.811 -12.427 -0.869 1.00 52.17 C ATOM 798 CE1 PHE B 39 17.239 -10.536 1.123 1.00 51.53 C ATOM 799 CE2 PHE B 39 15.753 -12.017 -0.043 1.00 51.30 C ATOM 800 CZ PHE B 39 15.971 -11.072 0.949 1.00 50.46 C ATOM 801 N ASP B 40 21.673 -12.637 0.366 1.00 50.00 N ATOM 802 CA ASP B 40 22.157 -12.083 1.633 1.00 50.78 C ATOM 803 C ASP B 40 22.613 -10.662 1.385 1.00 47.64 C ATOM 804 O ASP B 40 22.271 -10.078 0.365 1.00 47.19 O ATOM 805 CB ASP B 40 23.268 -12.942 2.281 1.00 56.07 C ATOM 806 CG ASP B 40 24.495 -13.127 1.383 1.00 58.91 C ATOM 807 OD1 ASP B 40 24.769 -12.275 0.511 1.00 59.52 O ATOM 808 OD2 ASP B 40 25.197 -14.145 1.557 1.00 62.59 O ATOM 809 N GLN B 41 23.388 -10.119 2.312 1.00 47.03 N ATOM 810 CA GLN B 41 23.913 -8.760 2.214 1.00 49.70 C ATOM 811 C GLN B 41 24.681 -8.482 0.921 1.00 46.98 C ATOM 812 O GLN B 41 24.632 -7.371 0.402 1.00 45.48 O ATOM 813 CB GLN B 41 24.808 -8.500 3.422 1.00 54.17 C ATOM 814 CG GLN B 41 25.455 -7.123 3.504 1.00 57.75 C ATOM 815 CD GLN B 41 26.197 -6.921 4.821 1.00 58.68 C ATOM 816 OE1 GLN B 41 26.327 -7.848 5.632 1.00 60.69 O ATOM 817 NE2 GLN B 41 26.681 -5.704 5.043 1.00 63.11 N ATOM 818 N PHE B 42 25.377 -9.488 0.385 1.00 43.59 N ATOM 819 CA PHE B 42 26.270 -9.236 -0.741 1.00 42.27 C ATOM 820 C PHE B 42 25.933 -9.920 -2.066 1.00 41.55 C ATOM 821 O PHE B 42 26.345 -9.448 -3.116 1.00 38.61 O ATOM 822 CB PHE B 42 27.725 -9.503 -0.337 1.00 47.48 C ATOM 823 CG PHE B 42 28.215 -8.613 0.775 1.00 48.60 C ATOM 824 CD1 PHE B 42 28.380 -7.249 0.571 1.00 48.30 C ATOM 825 CD2 PHE B 42 28.496 -9.140 2.032 1.00 52.59 C ATOM 826 CE1 PHE B 42 28.822 -6.411 1.597 1.00 50.12 C ATOM 827 CE2 PHE B 42 28.947 -8.301 3.072 1.00 54.89 C ATOM 828 CZ PHE B 42 29.113 -6.930 2.842 1.00 50.24 C ATOM 829 N VAL B 43 25.189 -11.022 -2.023 1.00 41.56 N ATOM 830 CA VAL B 43 24.874 -11.767 -3.244 1.00 40.45 C ATOM 831 C VAL B 43 23.389 -12.106 -3.353 1.00 41.35 C ATOM 832 O VAL B 43 22.648 -12.071 -2.369 1.00 38.86 O ATOM 833 CB VAL B 43 25.712 -13.111 -3.362 1.00 41.46 C ATOM 834 CG1 VAL B 43 27.195 -12.869 -3.107 1.00 36.82 C ATOM 835 CG2 VAL B 43 25.177 -14.186 -2.412 1.00 35.81 C ATOM 836 N ILE B 44 22.990 -12.476 -4.564 1.00 43.92 N ATOM 837 CA ILE B 44 21.678 -13.009 -4.856 1.00 44.04 C ATOM 838 C ILE B 44 21.826 -14.302 -5.644 1.00 44.24 C ATOM 839 O ILE B 44 22.536 -14.330 -6.647 1.00 43.30 O ATOM 840 CB ILE B 44 20.862 -12.011 -5.737 1.00 45.56 C ATOM 841 CG1 ILE B 44 20.544 -10.724 -4.974 1.00 44.69 C ATOM 842 CG2 ILE B 44 19.557 -12.665 -6.279 1.00 45.52 C ATOM 843 CD1 ILE B 44 20.071 -9.589 -5.906 1.00 44.97 C ATOM 844 N LEU B 45 21.124 -15.353 -5.219 1.00 49.16 N ATOM 845 CA LEU B 45 20.955 -16.578 -6.029 1.00 48.85 C ATOM 846 C LEU B 45 19.842 -16.438 -7.060 1.00 48.37 C ATOM 847 O LEU B 45 18.674 -16.350 -6.703 1.00 49.36 O ATOM 848 CB LEU B 45 20.653 -17.783 -5.144 1.00 51.80 C ATOM 849 CG LEU B 45 21.804 -18.617 -4.572 1.00 58.77 C ATOM 850 CD1 LEU B 45 22.143 -19.804 -5.482 1.00 55.91 C ATOM 851 CD2 LEU B 45 23.062 -17.772 -4.259 1.00 59.02 C ATOM 852 N LEU B 46 20.229 -16.438 -8.334 1.00 47.17 N ATOM 853 CA LEU B 46 19.319 -16.397 -9.460 1.00 51.93 C ATOM 854 C LEU B 46 19.114 -17.794 -10.111 1.00 58.66 C ATOM 855 O LEU B 46 19.975 -18.275 -10.850 1.00 59.20 O ATOM 856 CB LEU B 46 19.844 -15.411 -10.500 1.00 44.33 C ATOM 857 CG LEU B 46 18.918 -15.146 -11.684 1.00 45.02 C ATOM 858 CD1 LEU B 46 17.653 -14.318 -11.314 1.00 41.86 C ATOM 859 CD2 LEU B 46 19.717 -14.460 -12.743 1.00 45.01 C ATOM 860 N LYS B 47 17.974 -18.430 -9.836 1.00 64.48 N ATOM 861 CA LYS B 47 17.644 -19.720 -10.442 1.00 68.79 C ATOM 862 C LYS B 47 16.978 -19.550 -11.792 1.00 69.35 C ATOM 863 O LYS B 47 15.971 -18.852 -11.920 1.00 70.37 O ATOM 864 CB LYS B 47 16.733 -20.557 -9.542 1.00 70.42 C ATOM 865 CG LYS B 47 16.667 -22.034 -9.957 1.00 74.24 C ATOM 866 CD LYS B 47 15.568 -22.825 -9.237 1.00 74.08 C ATOM 867 CE LYS B 47 14.285 -22.923 -10.074 1.00 77.77 C ATOM 868 NZ LYS B 47 13.462 -21.662 -10.058 1.00 78.20 N ATOM 869 N ASN B 48 17.574 -20.182 -12.796 1.00 70.65 N ATOM 870 CA ASN B 48 16.941 -20.406 -14.079 1.00 74.02 C ATOM 871 C ASN B 48 17.192 -21.872 -14.472 1.00 76.69 C ATOM 872 O ASN B 48 16.803 -22.777 -13.723 1.00 75.20 O ATOM 873 CB ASN B 48 17.467 -19.427 -15.120 1.00 74.87 C ATOM 874 CG ASN B 48 16.508 -19.234 -16.273 1.00 76.28 C ATOM 875 OD1 ASN B 48 15.599 -20.036 -16.485 1.00 76.37 O ATOM 876 ND2 ASN B 48 16.708 -18.163 -17.033 1.00 77.62 N ATOM 877 N THR B 49 17.849 -22.114 -15.611 1.00 78.65 N ATOM 878 CA THR B 49 18.247 -23.479 -15.983 1.00 80.27 C ATOM 879 C THR B 49 19.266 -23.980 -14.964 1.00 79.75 C ATOM 880 O THR B 49 19.222 -25.134 -14.541 1.00 79.81 O ATOM 881 CB THR B 49 18.827 -23.581 -17.424 1.00 82.24 C ATOM 882 OG1 THR B 49 20.143 -23.011 -17.469 1.00 83.71 O ATOM 883 CG2 THR B 49 17.916 -22.886 -18.457 1.00 83.16 C ATOM 884 N VAL B 50 20.179 -23.093 -14.572 1.00 80.22 N ATOM 885 CA VAL B 50 21.049 -23.329 -13.417 1.00 78.44 C ATOM 886 C VAL B 50 20.858 -22.215 -12.399 1.00 75.67 C ATOM 887 O VAL B 50 20.446 -21.104 -12.744 1.00 75.72 O ATOM 888 CB VAL B 50 22.559 -23.422 -13.796 1.00 80.80 C ATOM 889 CG1 VAL B 50 22.874 -24.748 -14.487 1.00 81.25 C ATOM 890 CG2 VAL B 50 23.000 -22.221 -14.658 1.00 82.44 C ATOM 891 N SER B 51 21.164 -22.533 -11.147 1.00 71.58 N ATOM 892 CA SER B 51 21.212 -21.565 -10.068 1.00 68.44 C ATOM 893 C SER B 51 22.631 -20.944 -9.904 1.00 66.41 C ATOM 894 O SER B 51 23.559 -21.609 -9.429 1.00 69.29 O ATOM 895 CB SER B 51 20.749 -22.255 -8.788 1.00 68.97 C ATOM 896 OG SER B 51 20.921 -21.431 -7.658 1.00 72.30 O ATOM 897 N GLN B 52 22.781 -19.677 -10.302 1.00 61.15 N ATOM 898 CA GLN B 52 24.054 -18.936 -10.221 1.00 56.36 C ATOM 899 C GLN B 52 24.056 -17.874 -9.127 1.00 55.76 C ATOM 900 O GLN B 52 23.000 -17.336 -8.765 1.00 56.08 O ATOM 901 CB GLN B 52 24.365 -18.247 -11.556 1.00 56.40 C ATOM 902 CG GLN B 52 23.485 -17.039 -11.862 1.00 55.30 C ATOM 903 CD GLN B 52 23.586 -16.591 -13.299 1.00 57.24 C ATOM 904 OE1 GLN B 52 24.577 -15.991 -13.719 1.00 58.42 O ATOM 905 NE2 GLN B 52 22.555 -16.877 -14.066 1.00 57.45 N ATOM 906 N MET B 53 25.254 -17.544 -8.639 1.00 52.89 N ATOM 907 CA MET B 53 25.440 -16.504 -7.622 1.00 49.33 C ATOM 908 C MET B 53 25.814 -15.145 -8.230 1.00 47.80 C ATOM 909 O MET B 53 26.798 -15.028 -8.956 1.00 49.59 O ATOM 910 CB MET B 53 26.480 -16.935 -6.605 1.00 47.85 C ATOM 911 CG MET B 53 26.521 -16.082 -5.381 1.00 49.82 C ATOM 912 SD MET B 53 27.870 -16.468 -4.265 1.00 51.05 S ATOM 913 CE MET B 53 29.248 -16.645 -5.396 1.00 49.80 C ATOM 914 N VAL B 54 25.010 -14.127 -7.930 1.00 45.28 N ATOM 915 CA VAL B 54 25.184 -12.790 -8.501 1.00 42.32 C ATOM 916 C VAL B 54 25.600 -11.831 -7.390 1.00 39.28 C ATOM 917 O VAL B 54 24.914 -11.708 -6.385 1.00 39.69 O ATOM 918 CB VAL B 54 23.893 -12.274 -9.175 1.00 44.00 C ATOM 919 CG1 VAL B 54 24.177 -11.066 -10.052 1.00 43.47 C ATOM 920 CG2 VAL B 54 23.221 -13.378 -9.989 1.00 43.50 C ATOM 921 N TYR B 55 26.750 -11.186 -7.564 1.00 36.98 N ATOM 922 CA TYR B 55 27.202 -10.141 -6.653 1.00 34.38 C ATOM 923 C TYR B 55 26.409 -8.869 -6.867 1.00 31.30 C ATOM 924 O TYR B 55 26.339 -8.354 -7.974 1.00 33.18 O ATOM 925 CB TYR B 55 28.708 -9.872 -6.849 1.00 34.60 C ATOM 926 CG TYR B 55 29.557 -10.933 -6.200 1.00 35.38 C ATOM 927 CD1 TYR B 55 29.805 -10.909 -4.819 1.00 33.05 C ATOM 928 CD2 TYR B 55 30.059 -11.989 -6.950 1.00 34.59 C ATOM 929 CE1 TYR B 55 30.561 -11.894 -4.213 1.00 35.07 C ATOM 930 CE2 TYR B 55 30.810 -12.986 -6.359 1.00 37.56 C ATOM 931 CZ TYR B 55 31.065 -12.922 -4.991 1.00 36.33 C ATOM 932 OH TYR B 55 31.803 -13.917 -4.416 1.00 36.49 O ATOM 933 N LYS B 56 25.824 -8.351 -5.802 1.00 34.89 N ATOM 934 CA LYS B 56 25.088 -7.077 -5.862 1.00 35.93 C ATOM 935 C LYS B 56 25.926 -5.902 -6.394 1.00 39.88 C ATOM 936 O LYS B 56 25.383 -5.047 -7.101 1.00 40.06 O ATOM 937 CB LYS B 56 24.510 -6.741 -4.494 1.00 36.20 C ATOM 938 CG LYS B 56 23.421 -7.698 -4.044 1.00 34.68 C ATOM 939 CD LYS B 56 23.102 -7.449 -2.603 1.00 39.83 C ATOM 940 CE LYS B 56 21.924 -8.322 -2.152 1.00 44.68 C ATOM 941 NZ LYS B 56 21.370 -7.846 -0.839 1.00 46.35 N ATOM 942 N HIS B 57 27.235 -5.871 -6.077 1.00 37.79 N ATOM 943 CA HIS B 57 28.116 -4.776 -6.518 1.00 35.92 C ATOM 944 C HIS B 57 28.138 -4.730 -8.044 1.00 37.46 C ATOM 945 O HIS B 57 28.543 -3.737 -8.644 1.00 35.89 O ATOM 946 CB HIS B 57 29.551 -4.898 -5.930 1.00 33.60 C ATOM 947 CG HIS B 57 30.318 -6.108 -6.401 1.00 31.05 C ATOM 948 ND1 HIS B 57 30.745 -7.102 -5.542 1.00 32.04 N ATOM 949 CD2 HIS B 57 30.726 -6.487 -7.638 1.00 28.44 C ATOM 950 CE1 HIS B 57 31.387 -8.032 -6.225 1.00 30.78 C ATOM 951 NE2 HIS B 57 31.382 -7.687 -7.502 1.00 30.42 N ATOM 952 N ALA B 58 27.676 -5.816 -8.666 1.00 39.67 N ATOM 953 CA ALA B 58 27.686 -5.935 -10.131 1.00 39.40 C ATOM 954 C ALA B 58 26.305 -5.671 -10.751 1.00 37.66 C ATOM 955 O ALA B 58 26.170 -5.587 -11.973 1.00 40.37 O ATOM 956 CB ALA B 58 28.196 -7.314 -10.533 1.00 35.09 C ATOM 957 N ILE B 59 25.295 -5.525 -9.900 1.00 36.49 N ATOM 958 CA ILE B 59 23.912 -5.298 -10.331 1.00 36.39 C ATOM 959 C ILE B 59 23.624 -3.793 -10.427 1.00 35.40 C ATOM 960 O ILE B 59 23.969 -3.046 -9.520 1.00 35.54 O ATOM 961 CB ILE B 59 22.921 -5.987 -9.337 1.00 37.20 C ATOM 962 CG1 ILE B 59 23.153 -7.517 -9.319 1.00 36.03 C ATOM 963 CG2 ILE B 59 21.479 -5.649 -9.682 1.00 38.60 C ATOM 964 CD1 ILE B 59 22.220 -8.329 -8.349 1.00 34.74 C ATOM 965 N SER B 60 23.021 -3.340 -11.526 1.00 38.70 N ATOM 966 CA SER B 60 22.462 -1.976 -11.572 1.00 42.06 C ATOM 967 C SER B 60 20.972 -1.886 -11.151 1.00 43.88 C ATOM 968 O SER B 60 20.602 -0.999 -10.377 1.00 40.37 O ATOM 969 CB SER B 60 22.709 -1.316 -12.922 1.00 46.06 C ATOM 970 OG SER B 60 21.725 -1.661 -13.864 1.00 51.41 O ATOM 971 N THR B 61 20.141 -2.818 -11.638 1.00 44.86 N ATOM 972 CA THR B 61 18.696 -2.853 -11.333 1.00 47.11 C ATOM 973 C THR B 61 18.114 -4.269 -11.280 1.00 50.50 C ATOM 974 O THR B 61 18.517 -5.155 -12.044 1.00 51.89 O ATOM 975 CB THR B 61 17.837 -2.063 -12.345 1.00 45.24 C ATOM 976 OG1 THR B 61 17.884 -2.722 -13.605 1.00 47.32 O ATOM 977 CG2 THR B 61 18.337 -0.621 -12.533 1.00 44.90 C ATOM 978 N VAL B 62 17.174 -4.457 -10.353 1.00 50.04 N ATOM 979 CA VAL B 62 16.302 -5.622 -10.295 1.00 48.64 C ATOM 980 C VAL B 62 14.878 -5.204 -10.751 1.00 50.01 C ATOM 981 O VAL B 62 14.183 -4.460 -10.045 1.00 48.21 O ATOM 982 CB VAL B 62 16.278 -6.218 -8.864 1.00 48.02 C ATOM 983 CG1 VAL B 62 15.390 -7.476 -8.791 1.00 45.19 C ATOM 984 CG2 VAL B 62 17.702 -6.525 -8.393 1.00 47.01 C ATOM 985 N VAL B 63 14.487 -5.655 -11.947 1.00 50.30 N ATOM 986 CA VAL B 63 13.156 -5.394 -12.513 1.00 53.61 C ATOM 987 C VAL B 63 12.245 -6.627 -12.417 1.00 54.04 C ATOM 988 O VAL B 63 12.521 -7.648 -13.038 1.00 52.58 O ATOM 989 CB VAL B 63 13.210 -4.917 -13.998 1.00 54.10 C ATOM 990 CG1 VAL B 63 11.824 -4.484 -14.480 1.00 54.63 C ATOM 991 CG2 VAL B 63 14.184 -3.755 -14.172 1.00 57.34 C ATOM 992 N PRO B 64 11.150 -6.528 -11.639 1.00 57.86 N ATOM 993 CA PRO B 64 10.148 -7.604 -11.638 1.00 61.58 C ATOM 994 C PRO B 64 9.369 -7.593 -12.951 1.00 66.66 C ATOM 995 O PRO B 64 9.096 -6.515 -13.486 1.00 68.59 O ATOM 996 CB PRO B 64 9.209 -7.230 -10.486 1.00 60.66 C ATOM 997 CG PRO B 64 9.782 -5.998 -9.828 1.00 60.22 C ATOM 998 CD PRO B 64 10.787 -5.406 -10.750 1.00 58.30 C ATOM 999 N SER B 65 9.020 -8.773 -13.465 1.00 71.90 N ATOM 1000 CA SER B 65 8.212 -8.892 -14.692 1.00 78.13 C ATOM 1001 C SER B 65 6.737 -8.472 -14.495 1.00 82.79 C ATOM 1002 O SER B 65 6.205 -7.669 -15.269 1.00 81.35 O ATOM 1003 CB SER B 65 8.272 -10.320 -15.224 1.00 76.97 C ATOM 1004 OG SER B 65 7.732 -11.209 -14.259 1.00 76.93 O ATOM 1005 N ARG B 66 6.087 -9.033 -13.473 1.00 89.10 N ATOM 1006 CA ARG B 66 4.716 -8.660 -13.091 1.00 95.69 C ATOM 1007 C ARG B 66 4.755 -7.529 -12.047 1.00100.40 C ATOM 1008 O ARG B 66 5.763 -7.380 -11.348 1.00101.10 O ATOM 1009 CB ARG B 66 3.952 -9.885 -12.553 1.00 94.92 C ATOM 1010 N PRO B 67 3.673 -6.723 -11.936 1.00104.47 N ATOM 1011 CA PRO B 67 3.696 -5.599 -10.984 1.00107.25 C ATOM 1012 C PRO B 67 3.606 -5.998 -9.496 1.00109.84 C ATOM 1013 O PRO B 67 2.823 -5.406 -8.749 1.00110.77 O ATOM 1014 CB PRO B 67 2.480 -4.761 -11.405 1.00106.81 C ATOM 1015 CG PRO B 67 1.537 -5.749 -12.006 1.00106.47 C ATOM 1016 CD PRO B 67 2.399 -6.785 -12.683 1.00106.00 C ATOM 1017 N VAL B 68 4.430 -6.969 -9.086 1.00112.81 N ATOM 1018 CA VAL B 68 4.491 -7.506 -7.705 1.00115.14 C ATOM 1019 C VAL B 68 3.120 -8.002 -7.204 1.00116.38 C ATOM 1020 O VAL B 68 2.635 -9.039 -7.663 1.00116.53 O ATOM 1021 CB VAL B 68 5.163 -6.517 -6.678 1.00115.84 C ATOM 1022 CG1 VAL B 68 5.518 -7.237 -5.370 1.00115.17 C ATOM 1023 CG2 VAL B 68 6.413 -5.854 -7.272 1.00116.19 C TER 1024 VAL B 68 ATOM 1025 N SER C 6 23.107 13.953 4.133 1.00 69.06 N ATOM 1026 CA SER C 6 22.478 15.228 4.596 1.00 70.76 C ATOM 1027 C SER C 6 22.420 16.314 3.497 1.00 69.89 C ATOM 1028 O SER C 6 21.921 17.428 3.717 1.00 69.79 O ATOM 1029 CB SER C 6 23.125 15.740 5.896 1.00 71.92 C ATOM 1030 OG SER C 6 24.359 16.382 5.652 1.00 75.80 O ATOM 1031 N LEU C 7 22.946 15.987 2.321 1.00 67.17 N ATOM 1032 CA LEU C 7 22.484 16.607 1.085 1.00 64.00 C ATOM 1033 C LEU C 7 21.711 15.534 0.292 1.00 64.07 C ATOM 1034 O LEU C 7 20.819 15.852 -0.495 1.00 63.76 O ATOM 1035 CB LEU C 7 23.638 17.213 0.271 1.00 64.19 C ATOM 1036 CG LEU C 7 23.389 17.606 -1.203 1.00 64.48 C ATOM 1037 CD1 LEU C 7 22.416 18.785 -1.390 1.00 65.22 C ATOM 1038 CD2 LEU C 7 24.690 17.862 -1.935 1.00 63.00 C ATOM 1039 N GLN C 8 22.032 14.264 0.539 1.00 63.17 N ATOM 1040 CA GLN C 8 21.457 13.161 -0.238 1.00 60.54 C ATOM 1041 C GLN C 8 20.001 12.874 0.114 1.00 60.16 C ATOM 1042 O GLN C 8 19.162 12.766 -0.778 1.00 59.61 O ATOM 1043 CB GLN C 8 22.295 11.875 -0.141 1.00 57.21 C ATOM 1044 CG GLN C 8 22.113 10.980 -1.370 1.00 56.27 C ATOM 1045 CD GLN C 8 22.567 9.536 -1.181 1.00 54.79 C ATOM 1046 OE1 GLN C 8 22.132 8.650 -1.916 1.00 53.33 O ATOM 1047 NE2 GLN C 8 23.437 9.293 -0.210 1.00 51.13 N ATOM 1048 N ASP C 9 19.716 12.720 1.402 1.00 61.53 N ATOM 1049 CA ASP C 9 18.357 12.418 1.854 1.00 63.67 C ATOM 1050 C ASP C 9 17.363 13.533 1.493 1.00 64.17 C ATOM 1051 O ASP C 9 16.383 13.262 0.791 1.00 65.26 O ATOM 1052 CB ASP C 9 18.341 12.099 3.347 1.00 64.65 C ATOM 1053 CG ASP C 9 19.300 10.988 3.703 1.00 66.83 C ATOM 1054 OD1 ASP C 9 19.061 9.842 3.271 1.00 66.45 O ATOM 1055 OD2 ASP C 9 20.299 11.260 4.410 1.00 71.37 O ATOM 1056 N PRO C 10 17.630 14.789 1.931 1.00 63.92 N ATOM 1057 CA PRO C 10 16.758 15.911 1.580 1.00 62.69 C ATOM 1058 C PRO C 10 16.489 16.006 0.092 1.00 61.39 C ATOM 1059 O PRO C 10 15.371 16.316 -0.311 1.00 64.46 O ATOM 1060 CB PRO C 10 17.568 17.130 2.032 1.00 63.94 C ATOM 1061 CG PRO C 10 18.351 16.624 3.191 1.00 64.66 C ATOM 1062 CD PRO C 10 18.746 15.235 2.794 1.00 64.57 C ATOM 1063 N PHE C 11 17.504 15.741 -0.721 1.00 58.84 N ATOM 1064 CA PHE C 11 17.363 15.858 -2.164 1.00 55.28 C ATOM 1065 C PHE C 11 16.357 14.827 -2.691 1.00 58.38 C ATOM 1066 O PHE C 11 15.467 15.166 -3.490 1.00 57.57 O ATOM 1067 CB PHE C 11 18.711 15.676 -2.848 1.00 47.66 C ATOM 1068 CG PHE C 11 18.679 15.924 -4.328 1.00 45.41 C ATOM 1069 CD1 PHE C 11 18.569 14.865 -5.223 1.00 44.58 C ATOM 1070 CD2 PHE C 11 18.768 17.215 -4.830 1.00 45.64 C ATOM 1071 CE1 PHE C 11 18.544 15.097 -6.607 1.00 44.85 C ATOM 1072 CE2 PHE C 11 18.748 17.452 -6.206 1.00 45.93 C ATOM 1073 CZ PHE C 11 18.633 16.396 -7.093 1.00 43.57 C ATOM 1074 N LEU C 12 16.504 13.583 -2.222 1.00 58.84 N ATOM 1075 CA LEU C 12 15.740 12.448 -2.731 1.00 56.19 C ATOM 1076 C LEU C 12 14.334 12.416 -2.157 1.00 55.63 C ATOM 1077 O LEU C 12 13.410 11.949 -2.813 1.00 54.46 O ATOM 1078 CB LEU C 12 16.473 11.125 -2.441 1.00 55.37 C ATOM 1079 CG LEU C 12 17.761 10.745 -3.196 1.00 53.16 C ATOM 1080 CD1 LEU C 12 18.383 9.477 -2.591 1.00 49.52 C ATOM 1081 CD2 LEU C 12 17.526 10.567 -4.693 1.00 51.20 C ATOM 1082 N ASN C 13 14.182 12.895 -0.924 1.00 58.06 N ATOM 1083 CA ASN C 13 12.865 13.050 -0.305 1.00 60.14 C ATOM 1084 C ASN C 13 11.996 14.097 -0.990 1.00 60.37 C ATOM 1085 O ASN C 13 10.802 13.879 -1.194 1.00 62.37 O ATOM 1086 CB ASN C 13 12.991 13.394 1.178 1.00 62.46 C ATOM 1087 CG ASN C 13 12.968 12.165 2.068 1.00 64.81 C ATOM 1088 OD1 ASN C 13 12.157 11.251 1.876 1.00 68.30 O ATOM 1089 ND2 ASN C 13 13.844 12.143 3.060 1.00 63.98 N ATOM 1090 N ALA C 14 12.604 15.226 -1.342 1.00 59.57 N ATOM 1091 CA ALA C 14 11.894 16.336 -1.969 1.00 59.23 C ATOM 1092 C ALA C 14 11.368 15.928 -3.331 1.00 61.26 C ATOM 1093 O ALA C 14 10.279 16.346 -3.730 1.00 61.86 O ATOM 1094 CB ALA C 14 12.795 17.550 -2.094 1.00 56.38 C ATOM 1095 N LEU C 15 12.148 15.117 -4.045 1.00 61.15 N ATOM 1096 CA LEU C 15 11.707 14.560 -5.321 1.00 60.54 C ATOM 1097 C LEU C 15 10.610 13.522 -5.107 1.00 59.16 C ATOM 1098 O LEU C 15 9.798 13.293 -5.992 1.00 59.27 O ATOM 1099 CB LEU C 15 12.871 13.919 -6.079 1.00 59.37 C ATOM 1100 CG LEU C 15 14.096 14.753 -6.443 1.00 61.00 C ATOM 1101 CD1 LEU C 15 15.271 13.837 -6.776 1.00 59.88 C ATOM 1102 CD2 LEU C 15 13.791 15.671 -7.604 1.00 61.53 C ATOM 1103 N ARG C 16 10.607 12.882 -3.941 1.00 60.59 N ATOM 1104 CA ARG C 16 9.632 11.828 -3.648 1.00 62.46 C ATOM 1105 C ARG C 16 8.274 12.434 -3.274 1.00 64.57 C ATOM 1106 O ARG C 16 7.239 12.021 -3.810 1.00 64.10 O ATOM 1107 CB ARG C 16 10.138 10.882 -2.547 1.00 60.17 C ATOM 1108 CG ARG C 16 9.183 9.731 -2.237 1.00 59.01 C ATOM 1109 CD ARG C 16 9.564 8.985 -0.986 1.00 59.25 C ATOM 1110 NE ARG C 16 9.858 9.885 0.121 1.00 63.96 N ATOM 1111 CZ ARG C 16 8.961 10.328 1.000 1.00 67.82 C ATOM 1112 NH1 ARG C 16 7.684 9.957 0.906 1.00 68.39 N ATOM 1113 NH2 ARG C 16 9.345 11.152 1.976 1.00 68.61 N ATOM 1114 N ARG C 17 8.300 13.412 -2.363 1.00 66.50 N ATOM 1115 CA ARG C 17 7.105 14.166 -1.959 1.00 66.64 C ATOM 1116 C ARG C 17 6.462 14.882 -3.132 1.00 65.75 C ATOM 1117 O ARG C 17 5.335 14.573 -3.511 1.00 66.74 O ATOM 1118 CB ARG C 17 7.432 15.169 -0.856 1.00 65.33 C ATOM 1119 CG ARG C 17 7.582 14.534 0.490 1.00 68.82 C ATOM 1120 CD ARG C 17 7.961 15.555 1.522 1.00 72.80 C ATOM 1121 NE ARG C 17 9.213 15.187 2.167 1.00 79.29 N ATOM 1122 CZ ARG C 17 9.331 14.265 3.122 1.00 82.80 C ATOM 1123 NH1 ARG C 17 8.263 13.607 3.562 1.00 83.97 N ATOM 1124 NH2 ARG C 17 10.528 13.998 3.637 1.00 84.33 N ATOM 1125 N GLU C 18 7.193 15.823 -3.715 1.00 66.96 N ATOM 1126 CA GLU C 18 6.674 16.650 -4.806 1.00 68.85 C ATOM 1127 C GLU C 18 6.434 15.836 -6.072 1.00 69.48 C ATOM 1128 O GLU C 18 6.013 16.378 -7.102 1.00 69.34 O ATOM 1129 CB GLU C 18 7.611 17.841 -5.065 1.00 72.06 C ATOM 1130 CG GLU C 18 7.655 18.839 -3.896 1.00 74.51 C ATOM 1131 CD GLU C 18 8.965 19.619 -3.807 1.00 77.35 C ATOM 1132 OE1 GLU C 18 9.277 20.397 -4.750 1.00 77.27 O ATOM 1133 OE2 GLU C 18 9.670 19.462 -2.776 1.00 76.84 O ATOM 1134 N ARG C 19 6.700 14.530 -5.970 1.00 70.10 N ATOM 1135 CA ARG C 19 6.463 13.544 -7.033 1.00 68.39 C ATOM 1136 C ARG C 19 7.052 13.930 -8.390 1.00 65.70 C ATOM 1137 O ARG C 19 6.474 13.645 -9.442 1.00 66.76 O ATOM 1138 CB ARG C 19 4.972 13.207 -7.134 1.00 71.37 C ATOM 1139 CG ARG C 19 4.456 12.456 -5.923 1.00 74.83 C ATOM 1140 CD ARG C 19 2.953 12.547 -5.815 1.00 79.18 C ATOM 1141 NE ARG C 19 2.494 12.247 -4.457 1.00 82.57 N ATOM 1142 CZ ARG C 19 1.226 12.313 -4.051 1.00 83.46 C ATOM 1143 NH1 ARG C 19 0.268 12.674 -4.898 1.00 82.03 N ATOM 1144 NH2 ARG C 19 0.919 12.017 -2.791 1.00 84.16 N ATOM 1145 N VAL C 20 8.226 14.551 -8.353 1.00 63.40 N ATOM 1146 CA VAL C 20 8.884 15.040 -9.569 1.00 63.13 C ATOM 1147 C VAL C 20 9.564 13.917 -10.385 1.00 65.46 C ATOM 1148 O VAL C 20 10.205 13.010 -9.817 1.00 64.80 O ATOM 1149 CB VAL C 20 9.814 16.298 -9.298 1.00 59.92 C ATOM 1150 CG1 VAL C 20 9.916 16.614 -7.822 1.00 56.94 C ATOM 1151 CG2 VAL C 20 11.188 16.147 -9.934 1.00 59.72 C ATOM 1152 N PRO C 21 9.384 13.958 -11.723 1.00 66.65 N ATOM 1153 CA PRO C 21 9.997 12.980 -12.616 1.00 65.40 C ATOM 1154 C PRO C 21 11.515 13.173 -12.687 1.00 64.75 C ATOM 1155 O PRO C 21 12.002 14.297 -12.872 1.00 64.69 O ATOM 1156 CB PRO C 21 9.345 13.280 -13.979 1.00 65.95 C ATOM 1157 CG PRO C 21 8.197 14.206 -13.686 1.00 66.21 C ATOM 1158 CD PRO C 21 8.583 14.950 -12.466 1.00 65.18 C ATOM 1159 N VAL C 22 12.257 12.082 -12.529 1.00 63.21 N ATOM 1160 CA VAL C 22 13.720 12.146 -12.562 1.00 60.71 C ATOM 1161 C VAL C 22 14.304 11.343 -13.712 1.00 59.08 C ATOM 1162 O VAL C 22 13.742 10.324 -14.138 1.00 58.07 O ATOM 1163 CB VAL C 22 14.357 11.639 -11.246 1.00 60.36 C ATOM 1164 CG1 VAL C 22 13.983 12.550 -10.075 1.00 60.78 C ATOM 1165 CG2 VAL C 22 13.957 10.183 -10.968 1.00 57.62 C ATOM 1166 N SER C 23 15.431 11.817 -14.218 1.00 57.00 N ATOM 1167 CA SER C 23 16.308 10.966 -14.995 1.00 57.15 C ATOM 1168 C SER C 23 17.418 10.446 -14.072 1.00 56.88 C ATOM 1169 O SER C 23 18.061 11.220 -13.359 1.00 55.67 O ATOM 1170 CB SER C 23 16.885 11.721 -16.182 1.00 58.76 C ATOM 1171 OG SER C 23 15.870 12.029 -17.110 1.00 59.33 O ATOM 1172 N ILE C 24 17.592 9.129 -14.059 1.00 55.01 N ATOM 1173 CA ILE C 24 18.681 8.482 -13.337 1.00 51.52 C ATOM 1174 C ILE C 24 19.663 7.897 -14.346 1.00 51.23 C ATOM 1175 O ILE C 24 19.348 6.917 -15.032 1.00 49.48 O ATOM 1176 CB ILE C 24 18.158 7.384 -12.376 1.00 49.96 C ATOM 1177 CG1 ILE C 24 17.443 8.040 -11.199 1.00 48.28 C ATOM 1178 CG2 ILE C 24 19.297 6.510 -11.869 1.00 47.95 C ATOM 1179 CD1 ILE C 24 16.670 7.117 -10.356 1.00 47.99 C ATOM 1180 N TYR C 25 20.841 8.518 -14.444 1.00 51.05 N ATOM 1181 CA TYR C 25 21.886 8.053 -15.351 1.00 48.83 C ATOM 1182 C TYR C 25 22.766 7.058 -14.633 1.00 45.20 C ATOM 1183 O TYR C 25 23.247 7.318 -13.540 1.00 45.20 O ATOM 1184 CB TYR C 25 22.718 9.222 -15.872 1.00 54.80 C ATOM 1185 CG TYR C 25 21.935 10.198 -16.723 1.00 57.00 C ATOM 1186 CD1 TYR C 25 21.876 10.055 -18.108 1.00 57.80 C ATOM 1187 CD2 TYR C 25 21.249 11.267 -16.139 1.00 57.14 C ATOM 1188 CE1 TYR C 25 21.158 10.961 -18.896 1.00 59.28 C ATOM 1189 CE2 TYR C 25 20.533 12.165 -16.904 1.00 58.41 C ATOM 1190 CZ TYR C 25 20.485 12.012 -18.282 1.00 59.27 C ATOM 1191 OH TYR C 25 19.762 12.919 -19.036 1.00 59.19 O ATOM 1192 N LEU C 26 22.942 5.899 -15.241 1.00 42.92 N ATOM 1193 CA LEU C 26 23.762 4.858 -14.658 1.00 44.73 C ATOM 1194 C LEU C 26 25.208 5.045 -15.097 1.00 44.51 C ATOM 1195 O LEU C 26 25.489 5.841 -15.994 1.00 44.15 O ATOM 1196 CB LEU C 26 23.230 3.460 -15.028 1.00 41.90 C ATOM 1197 CG LEU C 26 21.739 3.183 -14.768 1.00 40.67 C ATOM 1198 CD1 LEU C 26 21.371 1.812 -15.315 1.00 37.76 C ATOM 1199 CD2 LEU C 26 21.327 3.310 -13.277 1.00 38.20 C ATOM 1200 N VAL C 27 26.120 4.316 -14.459 1.00 45.51 N ATOM 1201 CA VAL C 27 27.551 4.458 -14.741 1.00 45.29 C ATOM 1202 C VAL C 27 27.916 3.934 -16.143 1.00 49.07 C ATOM 1203 O VAL C 27 28.962 4.293 -16.697 1.00 52.42 O ATOM 1204 CB VAL C 27 28.434 3.832 -13.627 1.00 42.71 C ATOM 1205 CG1 VAL C 27 28.143 4.486 -12.288 1.00 30.44 C ATOM 1206 CG2 VAL C 27 28.211 2.297 -13.526 1.00 44.77 C ATOM 1207 N ASN C 28 27.049 3.095 -16.712 1.00 50.69 N ATOM 1208 CA ASN C 28 27.186 2.630 -18.105 1.00 52.92 C ATOM 1209 C ASN C 28 26.571 3.572 -19.157 1.00 54.02 C ATOM 1210 O ASN C 28 26.681 3.321 -20.352 1.00 56.38 O ATOM 1211 CB ASN C 28 26.601 1.227 -18.266 1.00 53.07 C ATOM 1212 CG ASN C 28 25.162 1.147 -17.830 1.00 55.46 C ATOM 1213 OD1 ASN C 28 24.451 2.156 -17.780 1.00 55.51 O ATOM 1214 ND2 ASN C 28 24.716 -0.058 -17.505 1.00 57.68 N ATOM 1215 N GLY C 29 25.925 4.645 -18.705 1.00 54.96 N ATOM 1216 CA GLY C 29 25.365 5.650 -19.593 1.00 53.41 C ATOM 1217 C GLY C 29 23.882 5.485 -19.860 1.00 55.97 C ATOM 1218 O GLY C 29 23.269 6.383 -20.431 1.00 57.87 O ATOM 1219 N ILE C 30 23.302 4.347 -19.462 1.00 56.82 N ATOM 1220 CA ILE C 30 21.850 4.129 -19.582 1.00 57.98 C ATOM 1221 C ILE C 30 21.070 5.201 -18.806 1.00 58.72 C ATOM 1222 O ILE C 30 21.443 5.561 -17.682 1.00 58.76 O ATOM 1223 CB ILE C 30 21.399 2.706 -19.087 1.00 58.48 C ATOM 1224 CG1 ILE C 30 21.984 1.549 -19.928 1.00 59.57 C ATOM 1225 CG2 ILE C 30 19.877 2.599 -18.976 1.00 57.28 C ATOM 1226 CD1 ILE C 30 22.382 1.870 -21.350 1.00 61.35 C ATOM 1227 N LYS C 31 19.999 5.714 -19.409 1.00 58.22 N ATOM 1228 CA LYS C 31 19.139 6.677 -18.725 1.00 58.96 C ATOM 1229 C LYS C 31 17.853 5.999 -18.278 1.00 58.51 C ATOM 1230 O LYS C 31 17.142 5.393 -19.080 1.00 62.15 O ATOM 1231 CB LYS C 31 18.816 7.877 -19.611 1.00 59.01 C ATOM 1232 CG LYS C 31 18.425 9.124 -18.830 1.00 62.02 C ATOM 1233 CD LYS C 31 17.086 9.726 -19.282 1.00 66.46 C ATOM 1234 CE LYS C 31 17.040 10.131 -20.770 1.00 67.81 C ATOM 1235 NZ LYS C 31 17.290 11.585 -20.972 1.00 68.59 N ATOM 1236 N LEU C 32 17.567 6.083 -16.988 1.00 53.64 N ATOM 1237 CA LEU C 32 16.319 5.595 -16.487 1.00 53.33 C ATOM 1238 C LEU C 32 15.414 6.793 -16.194 1.00 55.42 C ATOM 1239 O LEU C 32 15.888 7.841 -15.740 1.00 54.10 O ATOM 1240 CB LEU C 32 16.531 4.697 -15.256 1.00 52.81 C ATOM 1241 CG LEU C 32 17.308 3.389 -15.510 1.00 53.49 C ATOM 1242 CD1 LEU C 32 17.620 2.630 -14.231 1.00 49.22 C ATOM 1243 CD2 LEU C 32 16.574 2.495 -16.503 1.00 52.66 C ATOM 1244 N GLN C 33 14.121 6.637 -16.487 1.00 57.89 N ATOM 1245 CA GLN C 33 13.112 7.670 -16.221 1.00 59.32 C ATOM 1246 C GLN C 33 11.993 7.097 -15.363 1.00 58.14 C ATOM 1247 O GLN C 33 11.679 5.902 -15.451 1.00 57.09 O ATOM 1248 CB GLN C 33 12.550 8.229 -17.526 1.00 63.86 C ATOM 1249 CG GLN C 33 13.604 8.528 -18.579 1.00 69.48 C ATOM 1250 CD GLN C 33 13.188 9.650 -19.522 1.00 73.52 C ATOM 1251 OE1 GLN C 33 12.860 9.412 -20.694 1.00 74.29 O ATOM 1252 NE2 GLN C 33 13.199 10.883 -19.015 1.00 74.42 N ATOM 1253 N GLY C 34 11.412 7.943 -14.514 1.00 55.35 N ATOM 1254 CA GLY C 34 10.368 7.503 -13.591 1.00 50.58 C ATOM 1255 C GLY C 34 10.293 8.413 -12.392 1.00 49.71 C ATOM 1256 O GLY C 34 10.719 9.553 -12.464 1.00 51.04 O ATOM 1257 N GLN C 35 9.767 7.909 -11.281 1.00 50.79 N ATOM 1258 CA GLN C 35 9.702 8.686 -10.057 1.00 53.38 C ATOM 1259 C GLN C 35 10.252 7.947 -8.848 1.00 55.26 C ATOM 1260 O GLN C 35 10.050 6.736 -8.681 1.00 55.35 O ATOM 1261 CB GLN C 35 8.254 9.077 -9.765 1.00 58.03 C ATOM 1262 CG GLN C 35 7.703 10.106 -10.721 1.00 62.74 C ATOM 1263 CD GLN C 35 6.235 10.351 -10.524 1.00 64.82 C ATOM 1264 OE1 GLN C 35 5.533 10.682 -11.475 1.00 65.49 O ATOM 1265 NE2 GLN C 35 5.755 10.199 -9.287 1.00 66.66 N ATOM 1266 N ILE C 36 10.922 8.689 -7.979 1.00 54.14 N ATOM 1267 CA ILE C 36 11.404 8.118 -6.744 1.00 55.36 C ATOM 1268 C ILE C 36 10.157 7.737 -5.968 1.00 58.62 C ATOM 1269 O ILE C 36 9.439 8.604 -5.472 1.00 62.36 O ATOM 1270 CB ILE C 36 12.266 9.112 -5.900 1.00 51.71 C ATOM 1271 CG1 ILE C 36 13.386 9.764 -6.741 1.00 50.00 C ATOM 1272 CG2 ILE C 36 12.724 8.462 -4.570 1.00 43.98 C ATOM 1273 CD1 ILE C 36 14.666 9.014 -6.819 1.00 53.39 C ATOM 1274 N GLU C 37 9.890 6.438 -5.899 1.00 60.08 N ATOM 1275 CA GLU C 37 8.827 5.921 -5.058 1.00 61.63 C ATOM 1276 C GLU C 37 9.275 5.882 -3.596 1.00 60.01 C ATOM 1277 O GLU C 37 8.601 6.423 -2.727 1.00 59.36 O ATOM 1278 CB GLU C 37 8.416 4.542 -5.546 1.00 66.46 C ATOM 1279 CG GLU C 37 7.384 3.859 -4.681 1.00 73.31 C ATOM 1280 CD GLU C 37 6.872 2.598 -5.322 1.00 77.91 C ATOM 1281 OE1 GLU C 37 6.981 2.487 -6.568 1.00 79.32 O ATOM 1282 OE2 GLU C 37 6.370 1.722 -4.584 1.00 80.76 O ATOM 1283 N SER C 38 10.390 5.202 -3.331 1.00 59.14 N ATOM 1284 CA SER C 38 11.134 5.367 -2.080 1.00 57.18 C ATOM 1285 C SER C 38 12.620 5.102 -2.298 1.00 55.56 C ATOM 1286 O SER C 38 13.075 4.999 -3.443 1.00 52.88 O ATOM 1287 CB SER C 38 10.571 4.501 -0.952 1.00 58.16 C ATOM 1288 OG SER C 38 10.563 3.145 -1.315 1.00 62.17 O ATOM 1289 N PHE C 39 13.366 5.026 -1.195 1.00 54.76 N ATOM 1290 CA PHE C 39 14.796 4.779 -1.219 1.00 54.07 C ATOM 1291 C PHE C 39 15.246 4.383 0.170 1.00 55.93 C ATOM 1292 O PHE C 39 14.521 4.593 1.139 1.00 56.21 O ATOM 1293 CB PHE C 39 15.581 6.008 -1.720 1.00 58.38 C ATOM 1294 CG PHE C 39 15.484 7.214 -0.825 1.00 59.42 C ATOM 1295 CD1 PHE C 39 16.429 7.431 0.181 1.00 61.19 C ATOM 1296 CD2 PHE C 39 14.460 8.149 -1.000 1.00 60.30 C ATOM 1297 CE1 PHE C 39 16.350 8.554 1.021 1.00 62.07 C ATOM 1298 CE2 PHE C 39 14.361 9.268 -0.168 1.00 61.66 C ATOM 1299 CZ PHE C 39 15.315 9.477 0.844 1.00 60.83 C ATOM 1300 N ASP C 40 16.426 3.773 0.264 1.00 54.94 N ATOM 1301 CA ASP C 40 17.090 3.605 1.551 1.00 54.53 C ATOM 1302 C ASP C 40 18.585 3.924 1.409 1.00 52.47 C ATOM 1303 O ASP C 40 18.970 4.648 0.496 1.00 51.66 O ATOM 1304 CB ASP C 40 16.798 2.223 2.177 1.00 56.12 C ATOM 1305 CG ASP C 40 17.410 1.058 1.404 1.00 56.23 C ATOM 1306 OD1 ASP C 40 18.111 1.268 0.393 1.00 58.26 O ATOM 1307 OD2 ASP C 40 17.183 -0.090 1.829 1.00 56.05 O ATOM 1308 N GLN C 41 19.419 3.394 2.295 1.00 52.81 N ATOM 1309 CA GLN C 41 20.841 3.688 2.249 1.00 54.41 C ATOM 1310 C GLN C 41 21.539 3.205 0.972 1.00 53.38 C ATOM 1311 O GLN C 41 22.505 3.830 0.523 1.00 55.32 O ATOM 1312 CB GLN C 41 21.548 3.116 3.470 1.00 57.92 C ATOM 1313 CG GLN C 41 23.005 3.563 3.585 1.00 64.70 C ATOM 1314 CD GLN C 41 23.744 2.842 4.680 1.00 68.01 C ATOM 1315 OE1 GLN C 41 23.462 1.680 4.974 1.00 72.13 O ATOM 1316 NE2 GLN C 41 24.696 3.527 5.299 1.00 69.91 N ATOM 1317 N PHE C 42 21.054 2.111 0.388 1.00 49.58 N ATOM 1318 CA PHE C 42 21.739 1.507 -0.753 1.00 48.57 C ATOM 1319 C PHE C 42 20.970 1.472 -2.073 1.00 46.79 C ATOM 1320 O PHE C 42 21.585 1.386 -3.128 1.00 49.62 O ATOM 1321 CB PHE C 42 22.289 0.117 -0.390 1.00 51.78 C ATOM 1322 CG PHE C 42 23.366 0.147 0.669 1.00 51.28 C ATOM 1323 CD1 PHE C 42 23.144 -0.418 1.912 1.00 52.61 C ATOM 1324 CD2 PHE C 42 24.599 0.763 0.417 1.00 52.34 C ATOM 1325 CE1 PHE C 42 24.147 -0.394 2.898 1.00 55.26 C ATOM 1326 CE2 PHE C 42 25.606 0.801 1.388 1.00 52.29 C ATOM 1327 CZ PHE C 42 25.380 0.219 2.634 1.00 53.00 C ATOM 1328 N VAL C 43 19.643 1.536 -2.026 1.00 43.30 N ATOM 1329 CA VAL C 43 18.851 1.445 -3.248 1.00 40.97 C ATOM 1330 C VAL C 43 17.826 2.563 -3.384 1.00 42.56 C ATOM 1331 O VAL C 43 17.402 3.167 -2.407 1.00 44.05 O ATOM 1332 CB VAL C 43 18.120 0.059 -3.396 1.00 41.43 C ATOM 1333 CG1 VAL C 43 19.089 -1.109 -3.211 1.00 35.85 C ATOM 1334 CG2 VAL C 43 16.922 -0.043 -2.432 1.00 35.68 C ATOM 1335 N ILE C 44 17.433 2.815 -4.622 1.00 43.33 N ATOM 1336 CA ILE C 44 16.299 3.655 -4.930 1.00 44.80 C ATOM 1337 C ILE C 44 15.215 2.843 -5.660 1.00 45.65 C ATOM 1338 O ILE C 44 15.497 2.148 -6.619 1.00 46.28 O ATOM 1339 CB ILE C 44 16.736 4.864 -5.803 1.00 43.51 C ATOM 1340 CG1 ILE C 44 17.678 5.777 -5.014 1.00 39.47 C ATOM 1341 CG2 ILE C 44 15.507 5.598 -6.360 1.00 43.71 C ATOM 1342 CD1 ILE C 44 18.365 6.816 -5.846 1.00 39.06 C ATOM 1343 N LEU C 45 13.973 2.940 -5.197 1.00 51.71 N ATOM 1344 CA LEU C 45 12.839 2.383 -5.920 1.00 51.41 C ATOM 1345 C LEU C 45 12.314 3.373 -6.947 1.00 50.10 C ATOM 1346 O LEU C 45 11.821 4.446 -6.603 1.00 53.30 O ATOM 1347 CB LEU C 45 11.730 2.009 -4.956 1.00 57.96 C ATOM 1348 CG LEU C 45 11.132 0.638 -5.245 1.00 63.23 C ATOM 1349 CD1 LEU C 45 11.868 -0.382 -4.378 1.00 65.57 C ATOM 1350 CD2 LEU C 45 9.639 0.624 -4.954 1.00 64.50 C ATOM 1351 N LEU C 46 12.424 3.007 -8.212 1.00 47.42 N ATOM 1352 CA LEU C 46 12.018 3.868 -9.298 1.00 48.51 C ATOM 1353 C LEU C 46 10.700 3.386 -9.943 1.00 55.44 C ATOM 1354 O LEU C 46 10.669 2.370 -10.654 1.00 55.90 O ATOM 1355 CB LEU C 46 13.147 3.971 -10.331 1.00 40.22 C ATOM 1356 CG LEU C 46 12.957 4.982 -11.463 1.00 40.27 C ATOM 1357 CD1 LEU C 46 13.032 6.463 -11.009 1.00 34.68 C ATOM 1358 CD2 LEU C 46 13.935 4.677 -12.539 1.00 37.35 C ATOM 1359 N LYS C 47 9.617 4.115 -9.676 1.00 61.18 N ATOM 1360 CA LYS C 47 8.315 3.823 -10.287 1.00 66.15 C ATOM 1361 C LYS C 47 8.146 4.437 -11.677 1.00 65.87 C ATOM 1362 O LYS C 47 8.467 5.601 -11.915 1.00 64.77 O ATOM 1363 CB LYS C 47 7.157 4.264 -9.387 1.00 70.96 C ATOM 1364 CG LYS C 47 5.841 3.575 -9.731 1.00 75.70 C ATOM 1365 CD LYS C 47 4.643 4.449 -9.410 1.00 79.03 C ATOM 1366 CE LYS C 47 3.525 4.243 -10.441 1.00 81.69 C ATOM 1367 NZ LYS C 47 3.830 4.902 -11.756 1.00 81.99 N ATOM 1368 N ASN C 48 7.651 3.620 -12.589 1.00 67.12 N ATOM 1369 CA ASN C 48 7.178 4.073 -13.882 1.00 72.80 C ATOM 1370 C ASN C 48 6.094 3.069 -14.293 1.00 75.06 C ATOM 1371 O ASN C 48 5.032 3.026 -13.661 1.00 76.83 O ATOM 1372 CB ASN C 48 8.321 4.162 -14.891 1.00 72.53 C ATOM 1373 CG ASN C 48 7.917 4.854 -16.178 1.00 74.95 C ATOM 1374 OD1 ASN C 48 6.878 4.548 -16.773 1.00 77.69 O ATOM 1375 ND2 ASN C 48 8.749 5.779 -16.630 1.00 74.96 N ATOM 1376 N THR C 49 6.351 2.252 -15.309 1.00 75.60 N ATOM 1377 CA THR C 49 5.447 1.146 -15.607 1.00 79.19 C ATOM 1378 C THR C 49 5.511 0.075 -14.504 1.00 79.13 C ATOM 1379 O THR C 49 4.483 -0.487 -14.115 1.00 79.90 O ATOM 1380 CB THR C 49 5.659 0.556 -17.016 1.00 80.70 C ATOM 1381 OG1 THR C 49 5.309 -0.831 -16.997 1.00 83.75 O ATOM 1382 CG2 THR C 49 7.111 0.704 -17.474 1.00 82.93 C ATOM 1383 N VAL C 50 6.717 -0.190 -13.998 1.00 79.46 N ATOM 1384 CA VAL C 50 6.898 -0.983 -12.762 1.00 76.26 C ATOM 1385 C VAL C 50 7.731 -0.264 -11.702 1.00 72.28 C ATOM 1386 O VAL C 50 8.343 0.763 -11.960 1.00 71.26 O ATOM 1387 CB VAL C 50 7.537 -2.392 -13.006 1.00 77.33 C ATOM 1388 CG1 VAL C 50 6.595 -3.499 -12.539 1.00 76.97 C ATOM 1389 CG2 VAL C 50 8.014 -2.575 -14.464 1.00 76.68 C ATOM 1390 N SER C 51 7.726 -0.815 -10.497 1.00 70.61 N ATOM 1391 CA SER C 51 8.689 -0.448 -9.484 1.00 68.78 C ATOM 1392 C SER C 51 9.925 -1.344 -9.599 1.00 65.35 C ATOM 1393 O SER C 51 9.891 -2.521 -9.222 1.00 65.32 O ATOM 1394 CB SER C 51 8.075 -0.569 -8.093 1.00 70.31 C ATOM 1395 OG SER C 51 7.076 0.408 -7.926 1.00 75.42 O ATOM 1396 N GLN C 52 11.006 -0.785 -10.140 1.00 61.49 N ATOM 1397 CA GLN C 52 12.301 -1.464 -10.132 1.00 56.30 C ATOM 1398 C GLN C 52 13.194 -0.934 -9.015 1.00 53.29 C ATOM 1399 O GLN C 52 13.091 0.228 -8.619 1.00 51.43 O ATOM 1400 CB GLN C 52 12.998 -1.370 -11.488 1.00 55.31 C ATOM 1401 CG GLN C 52 13.418 0.025 -11.919 1.00 54.35 C ATOM 1402 CD GLN C 52 14.051 0.021 -13.293 1.00 56.78 C ATOM 1403 OE1 GLN C 52 15.031 -0.686 -13.530 1.00 60.87 O ATOM 1404 NE2 GLN C 52 13.495 0.803 -14.212 1.00 54.75 N ATOM 1405 N MET C 53 14.053 -1.813 -8.506 1.00 50.60 N ATOM 1406 CA MET C 53 15.062 -1.450 -7.532 1.00 48.62 C ATOM 1407 C MET C 53 16.393 -1.119 -8.226 1.00 46.52 C ATOM 1408 O MET C 53 16.967 -1.961 -8.917 1.00 47.38 O ATOM 1409 CB MET C 53 15.249 -2.572 -6.524 1.00 45.76 C ATOM 1410 CG MET C 53 16.133 -2.210 -5.389 1.00 46.43 C ATOM 1411 SD MET C 53 16.253 -3.545 -4.222 1.00 51.00 S ATOM 1412 CE MET C 53 17.160 -4.726 -5.211 1.00 53.38 C ATOM 1413 N VAL C 54 16.862 0.109 -8.017 1.00 43.01 N ATOM 1414 CA VAL C 54 18.086 0.623 -8.610 1.00 41.46 C ATOM 1415 C VAL C 54 19.143 0.739 -7.517 1.00 39.88 C ATOM 1416 O VAL C 54 18.941 1.422 -6.523 1.00 40.70 O ATOM 1417 CB VAL C 54 17.840 2.009 -9.236 1.00 43.81 C ATOM 1418 CG1 VAL C 54 19.022 2.446 -10.120 1.00 43.24 C ATOM 1419 CG2 VAL C 54 16.515 2.028 -10.029 1.00 39.60 C ATOM 1420 N TYR C 55 20.258 0.033 -7.681 1.00 39.89 N ATOM 1421 CA TYR C 55 21.374 0.135 -6.737 1.00 36.76 C ATOM 1422 C TYR C 55 22.079 1.479 -6.898 1.00 35.26 C ATOM 1423 O TYR C 55 22.444 1.849 -7.999 1.00 36.04 O ATOM 1424 CB TYR C 55 22.351 -1.031 -6.930 1.00 34.66 C ATOM 1425 CG TYR C 55 21.876 -2.290 -6.243 1.00 35.28 C ATOM 1426 CD1 TYR C 55 22.084 -2.484 -4.881 1.00 31.65 C ATOM 1427 CD2 TYR C 55 21.163 -3.259 -6.950 1.00 35.11 C ATOM 1428 CE1 TYR C 55 21.627 -3.637 -4.249 1.00 32.90 C ATOM 1429 CE2 TYR C 55 20.708 -4.398 -6.344 1.00 36.17 C ATOM 1430 CZ TYR C 55 20.950 -4.586 -4.991 1.00 35.79 C ATOM 1431 OH TYR C 55 20.476 -5.724 -4.401 1.00 36.15 O ATOM 1432 N LYS C 56 22.255 2.208 -5.804 1.00 36.44 N ATOM 1433 CA LYS C 56 22.950 3.501 -5.846 1.00 39.66 C ATOM 1434 C LYS C 56 24.381 3.423 -6.391 1.00 41.45 C ATOM 1435 O LYS C 56 24.839 4.369 -7.028 1.00 41.40 O ATOM 1436 CB LYS C 56 22.957 4.162 -4.470 1.00 38.56 C ATOM 1437 CG LYS C 56 21.596 4.670 -4.008 1.00 38.91 C ATOM 1438 CD LYS C 56 21.665 5.020 -2.531 1.00 40.96 C ATOM 1439 CE LYS C 56 20.513 5.904 -2.114 1.00 45.38 C ATOM 1440 NZ LYS C 56 20.816 6.578 -0.801 1.00 46.10 N ATOM 1441 N HIS C 57 25.072 2.299 -6.148 1.00 39.77 N ATOM 1442 CA HIS C 57 26.445 2.106 -6.644 1.00 37.09 C ATOM 1443 C HIS C 57 26.516 2.106 -8.165 1.00 39.21 C ATOM 1444 O HIS C 57 27.591 2.282 -8.739 1.00 39.70 O ATOM 1445 CB HIS C 57 27.107 0.841 -6.046 1.00 32.13 C ATOM 1446 CG HIS C 57 26.431 -0.450 -6.407 1.00 31.42 C ATOM 1447 ND1 HIS C 57 25.936 -1.317 -5.456 1.00 28.71 N ATOM 1448 CD2 HIS C 57 26.188 -1.034 -7.608 1.00 29.32 C ATOM 1449 CE1 HIS C 57 25.420 -2.376 -6.050 1.00 28.80 C ATOM 1450 NE2 HIS C 57 25.553 -2.225 -7.357 1.00 30.72 N ATOM 1451 N ALA C 58 25.366 1.914 -8.815 1.00 37.78 N ATOM 1452 CA ALA C 58 25.301 1.899 -10.280 1.00 36.32 C ATOM 1453 C ALA C 58 24.886 3.247 -10.873 1.00 36.16 C ATOM 1454 O ALA C 58 24.909 3.424 -12.076 1.00 39.45 O ATOM 1455 CB ALA C 58 24.358 0.809 -10.750 1.00 34.33 C ATOM 1456 N ILE C 59 24.517 4.192 -10.022 1.00 35.52 N ATOM 1457 CA ILE C 59 24.070 5.505 -10.453 1.00 38.89 C ATOM 1458 C ILE C 59 25.229 6.522 -10.541 1.00 37.03 C ATOM 1459 O ILE C 59 26.012 6.609 -9.611 1.00 38.31 O ATOM 1460 CB ILE C 59 22.978 6.024 -9.457 1.00 40.10 C ATOM 1461 CG1 ILE C 59 21.801 5.027 -9.387 1.00 41.30 C ATOM 1462 CG2 ILE C 59 22.533 7.415 -9.834 1.00 41.11 C ATOM 1463 CD1 ILE C 59 20.698 5.350 -8.340 1.00 39.44 C ATOM 1464 N SER C 60 25.327 7.271 -11.647 1.00 38.92 N ATOM 1465 CA SER C 60 26.173 8.481 -11.724 1.00 44.69 C ATOM 1466 C SER C 60 25.444 9.697 -11.162 1.00 47.21 C ATOM 1467 O SER C 60 25.940 10.354 -10.251 1.00 44.18 O ATOM 1468 CB SER C 60 26.577 8.859 -13.155 1.00 47.68 C ATOM 1469 OG SER C 60 26.454 7.802 -14.074 1.00 53.61 O ATOM 1470 N THR C 61 24.284 10.011 -11.752 1.00 49.54 N ATOM 1471 CA THR C 61 23.498 11.201 -11.384 1.00 51.30 C ATOM 1472 C THR C 61 21.984 10.966 -11.280 1.00 51.12 C ATOM 1473 O THR C 61 21.422 10.095 -11.952 1.00 49.96 O ATOM 1474 CB THR C 61 23.721 12.369 -12.371 1.00 52.40 C ATOM 1475 OG1 THR C 61 23.161 12.022 -13.634 1.00 54.45 O ATOM 1476 CG2 THR C 61 25.213 12.683 -12.558 1.00 50.79 C ATOM 1477 N VAL C 62 21.348 11.744 -10.402 1.00 50.99 N ATOM 1478 CA VAL C 62 19.896 11.886 -10.368 1.00 48.58 C ATOM 1479 C VAL C 62 19.514 13.322 -10.769 1.00 52.37 C ATOM 1480 O VAL C 62 19.737 14.271 -10.006 1.00 51.88 O ATOM 1481 CB VAL C 62 19.312 11.565 -8.993 1.00 46.97 C ATOM 1482 CG1 VAL C 62 17.787 11.572 -9.073 1.00 47.03 C ATOM 1483 CG2 VAL C 62 19.816 10.218 -8.495 1.00 45.47 C ATOM 1484 N VAL C 63 18.948 13.458 -11.967 1.00 52.71 N ATOM 1485 CA VAL C 63 18.572 14.744 -12.540 1.00 57.87 C ATOM 1486 C VAL C 63 17.048 15.014 -12.438 1.00 61.90 C ATOM 1487 O VAL C 63 16.257 14.331 -13.096 1.00 62.55 O ATOM 1488 CB VAL C 63 18.976 14.805 -14.035 1.00 57.55 C ATOM 1489 CG1 VAL C 63 18.914 16.233 -14.564 1.00 55.15 C ATOM 1490 CG2 VAL C 63 20.370 14.213 -14.248 1.00 58.76 C ATOM 1491 N PRO C 64 16.634 16.007 -11.616 1.00 64.68 N ATOM 1492 CA PRO C 64 15.255 16.522 -11.693 1.00 67.38 C ATOM 1493 C PRO C 64 14.885 17.088 -13.074 1.00 71.87 C ATOM 1494 O PRO C 64 15.681 17.820 -13.682 1.00 72.23 O ATOM 1495 CB PRO C 64 15.243 17.650 -10.656 1.00 64.52 C ATOM 1496 CG PRO C 64 16.357 17.341 -9.727 1.00 64.00 C ATOM 1497 CD PRO C 64 17.409 16.677 -10.551 1.00 64.11 C ATOM 1498 N SER C 65 13.691 16.746 -13.560 1.00 77.17 N ATOM 1499 CA SER C 65 13.135 17.342 -14.792 1.00 83.34 C ATOM 1500 C SER C 65 12.772 18.829 -14.608 1.00 86.84 C ATOM 1501 O SER C 65 12.905 19.634 -15.536 1.00 87.87 O ATOM 1502 CB SER C 65 11.901 16.567 -15.257 1.00 81.96 C ATOM 1503 OG SER C 65 10.883 16.637 -14.270 1.00 81.47 O ATOM 1504 N ARG C 66 12.300 19.173 -13.411 1.00 90.65 N ATOM 1505 CA ARG C 66 12.044 20.559 -13.028 1.00 93.93 C ATOM 1506 C ARG C 66 12.896 20.894 -11.791 1.00 97.19 C ATOM 1507 O ARG C 66 13.106 20.021 -10.937 1.00 96.44 O ATOM 1508 CB ARG C 66 10.542 20.783 -12.761 1.00 94.11 C ATOM 1509 CG ARG C 66 10.028 20.283 -11.398 1.00 93.70 C ATOM 1510 CD ARG C 66 8.554 20.586 -11.195 1.00 92.43 C ATOM 1511 NE ARG C 66 7.719 19.425 -11.486 1.00 91.32 N ATOM 1512 CZ ARG C 66 7.043 18.730 -10.572 1.00 90.93 C ATOM 1513 NH1 ARG C 66 7.083 19.079 -9.288 1.00 89.70 N ATOM 1514 NH2 ARG C 66 6.315 17.683 -10.945 1.00 90.15 N ATOM 1515 N PRO C 67 13.400 22.149 -11.691 1.00 99.84 N ATOM 1516 CA PRO C 67 14.242 22.524 -10.540 1.00100.95 C ATOM 1517 C PRO C 67 13.596 22.183 -9.186 1.00101.67 C ATOM 1518 O PRO C 67 14.181 21.444 -8.374 1.00101.47 O ATOM 1519 CB PRO C 67 14.403 24.044 -10.706 1.00100.87 C ATOM 1520 CG PRO C 67 14.285 24.264 -12.189 1.00100.30 C ATOM 1521 CD PRO C 67 13.230 23.278 -12.632 1.00100.31 C TER 1522 PRO C 67 ATOM 1523 OP3 A H 1 25.132 14.483 -25.050 0.83 72.21 O ATOM 1524 P A H 1 24.424 13.401 -24.319 0.83 75.10 P ATOM 1525 OP1 A H 1 24.058 12.338 -25.292 0.83 76.18 O ATOM 1526 OP2 A H 1 23.344 14.013 -23.505 0.83 72.83 O ATOM 1527 O5' A H 1 25.503 12.767 -23.326 0.83 72.92 O ATOM 1528 C5' A H 1 26.143 11.543 -23.683 0.83 68.76 C ATOM 1529 C4' A H 1 26.011 10.569 -22.537 0.83 65.60 C ATOM 1530 O4' A H 1 25.904 11.363 -21.334 0.83 61.84 O ATOM 1531 C3' A H 1 24.790 9.656 -22.597 0.83 65.45 C ATOM 1532 O3' A H 1 25.184 8.277 -22.482 0.83 69.06 O ATOM 1533 C2' A H 1 23.922 10.118 -21.423 0.83 62.94 C ATOM 1534 O2' A H 1 23.307 9.024 -20.776 0.83 61.76 O ATOM 1535 C1' A H 1 24.932 10.798 -20.494 0.83 59.27 C ATOM 1536 N9 A H 1 24.446 11.905 -19.668 0.83 58.46 N ATOM 1537 C8 A H 1 23.766 13.019 -20.081 0.83 57.14 C ATOM 1538 N7 A H 1 23.471 13.854 -19.119 0.83 56.69 N ATOM 1539 C5 A H 1 23.994 13.251 -17.992 0.83 56.16 C ATOM 1540 C6 A H 1 24.015 13.628 -16.635 0.83 57.60 C ATOM 1541 N6 A H 1 23.468 14.765 -16.179 0.83 56.90 N ATOM 1542 N1 A H 1 24.623 12.782 -15.758 0.83 57.02 N ATOM 1543 C2 A H 1 25.182 11.655 -16.208 0.83 56.22 C ATOM 1544 N3 A H 1 25.230 11.200 -17.457 0.83 56.35 N ATOM 1545 C4 A H 1 24.613 12.052 -18.308 0.83 57.73 C ATOM 1546 P A H 2 25.637 7.387 -23.753 0.83 74.62 P ATOM 1547 OP1 A H 2 26.400 6.211 -23.267 0.83 73.06 O ATOM 1548 OP2 A H 2 26.264 8.297 -24.740 0.83 73.45 O ATOM 1549 O5' A H 2 24.257 6.849 -24.375 0.83 75.85 O ATOM 1550 C5' A H 2 23.361 6.035 -23.623 0.83 78.12 C ATOM 1551 C4' A H 2 22.168 5.641 -24.474 0.83 80.46 C ATOM 1552 O4' A H 2 22.638 5.295 -25.800 0.83 83.47 O ATOM 1553 C3' A H 2 21.388 4.417 -23.994 0.83 80.97 C ATOM 1554 O3' A H 2 19.997 4.593 -24.250 0.83 76.59 O ATOM 1555 C2' A H 2 21.961 3.279 -24.837 0.83 83.85 C ATOM 1556 O2' A H 2 21.079 2.176 -24.956 0.83 85.00 O ATOM 1557 C1' A H 2 22.125 4.023 -26.158 0.83 86.79 C ATOM 1558 N9 A H 2 23.010 3.400 -27.146 0.83 88.50 N ATOM 1559 C8 A H 2 24.205 2.754 -26.933 0.83 88.96 C ATOM 1560 N7 A H 2 24.764 2.301 -28.032 0.83 89.23 N ATOM 1561 C5 A H 2 23.877 2.681 -29.036 0.83 89.45 C ATOM 1562 C6 A H 2 23.883 2.510 -30.442 0.83 88.69 C ATOM 1563 N6 A H 2 24.865 1.877 -31.090 0.83 88.65 N ATOM 1564 N1 A H 2 22.845 3.011 -31.158 0.83 88.63 N ATOM 1565 C2 A H 2 21.858 3.652 -30.508 0.83 88.89 C ATOM 1566 N3 A H 2 21.743 3.877 -29.194 0.83 89.06 N ATOM 1567 C4 A H 2 22.790 3.362 -28.508 0.83 89.24 C ATOM 1568 P A H 3 19.010 5.081 -23.090 0.83 73.45 P ATOM 1569 OP1 A H 3 17.875 5.816 -23.697 0.83 74.26 O ATOM 1570 OP2 A H 3 19.838 5.788 -22.083 0.83 74.42 O ATOM 1571 O5' A H 3 18.473 3.708 -22.482 0.83 68.90 O ATOM 1572 C5' A H 3 17.123 3.590 -22.123 0.83 68.01 C ATOM 1573 C4' A H 3 16.849 2.180 -21.648 0.83 67.32 C ATOM 1574 O4' A H 3 16.352 2.240 -20.298 0.83 64.62 O ATOM 1575 C3' A H 3 15.802 1.403 -22.441 0.83 68.39 C ATOM 1576 O3' A H 3 16.180 0.030 -22.496 0.83 70.16 O ATOM 1577 C2' A H 3 14.522 1.578 -21.633 0.83 67.69 C ATOM 1578 O2' A H 3 13.653 0.460 -21.762 0.83 71.04 O ATOM 1579 C1' A H 3 15.092 1.614 -20.226 0.83 62.43 C ATOM 1580 N9 A H 3 14.291 2.330 -19.248 0.83 60.83 N ATOM 1581 C8 A H 3 14.253 3.678 -18.998 0.83 60.18 C ATOM 1582 N7 A H 3 13.439 4.004 -18.023 0.83 59.37 N ATOM 1583 C5 A H 3 12.909 2.788 -17.619 0.83 59.22 C ATOM 1584 C6 A H 3 11.980 2.427 -16.628 0.83 59.48 C ATOM 1585 N6 A H 3 11.386 3.305 -15.822 0.83 60.21 N ATOM 1586 N1 A H 3 11.683 1.115 -16.481 0.83 60.87 N ATOM 1587 C2 A H 3 12.262 0.209 -17.278 0.83 60.59 C ATOM 1588 N3 A H 3 13.154 0.430 -18.244 0.83 61.27 N ATOM 1589 C4 A H 3 13.431 1.746 -18.361 0.83 60.11 C ATOM 1590 P A H 4 16.477 -0.698 -23.890 0.83 72.03 P ATOM 1591 OP1 A H 4 16.493 0.349 -24.946 0.83 70.37 O ATOM 1592 OP2 A H 4 15.597 -1.894 -23.944 0.83 68.85 O ATOM 1593 O5' A H 4 17.965 -1.275 -23.733 0.83 71.00 O ATOM 1594 C5' A H 4 19.137 -0.451 -23.794 0.83 67.77 C ATOM 1595 C4' A H 4 20.163 -0.928 -22.770 0.83 65.64 C ATOM 1596 O4' A H 4 19.679 -0.589 -21.448 0.83 63.24 O ATOM 1597 C3' A H 4 20.484 -2.424 -22.735 0.83 64.13 C ATOM 1598 O3' A H 4 21.875 -2.658 -22.464 0.83 68.05 O ATOM 1599 C2' A H 4 19.617 -2.929 -21.590 0.83 62.24 C ATOM 1600 O2' A H 4 20.132 -4.124 -21.028 0.83 60.30 O ATOM 1601 C1' A H 4 19.662 -1.734 -20.631 0.83 60.26 C ATOM 1602 N9 A H 4 18.500 -1.597 -19.753 0.83 60.46 N ATOM 1603 C8 A H 4 17.181 -1.583 -20.132 0.83 59.54 C ATOM 1604 N7 A H 4 16.334 -1.452 -19.141 0.83 59.19 N ATOM 1605 C5 A H 4 17.148 -1.369 -18.026 0.83 58.98 C ATOM 1606 C6 A H 4 16.854 -1.221 -16.660 0.83 58.53 C ATOM 1607 N6 A H 4 15.602 -1.126 -16.191 0.83 58.22 N ATOM 1608 N1 A H 4 17.904 -1.175 -15.803 0.83 59.06 N ATOM 1609 C2 A H 4 19.155 -1.259 -16.276 0.83 58.81 C ATOM 1610 N3 A H 4 19.556 -1.395 -17.540 0.83 58.46 N ATOM 1611 C4 A H 4 18.494 -1.446 -18.376 0.83 60.43 C ATOM 1612 P A H 5 22.959 -2.856 -23.640 0.83 71.73 P ATOM 1613 OP1 A H 5 24.313 -2.922 -23.031 0.83 71.37 O ATOM 1614 OP2 A H 5 22.667 -1.811 -24.650 0.83 71.07 O ATOM 1615 O5' A H 5 22.625 -4.297 -24.275 0.83 73.01 O ATOM 1616 C5' A H 5 23.083 -5.496 -23.650 0.83 76.05 C ATOM 1617 C4' A H 5 22.657 -6.732 -24.426 0.83 78.33 C ATOM 1618 O4' A H 5 23.072 -6.617 -25.809 0.83 80.36 O ATOM 1619 C3' A H 5 23.269 -8.046 -23.954 0.83 79.20 C ATOM 1620 O3' A H 5 22.365 -9.113 -24.223 0.83 76.93 O ATOM 1621 C2' A H 5 24.517 -8.165 -24.821 0.83 81.17 C ATOM 1622 O2' A H 5 24.988 -9.496 -24.908 0.83 81.80 O ATOM 1623 C1' A H 5 23.924 -7.699 -26.145 0.83 83.20 C ATOM 1624 N9 A H 5 24.879 -7.246 -27.155 0.83 84.61 N ATOM 1625 C8 A H 5 26.039 -6.542 -26.954 0.83 85.04 C ATOM 1626 N7 A H 5 26.692 -6.269 -28.061 0.83 85.58 N ATOM 1627 C5 A H 5 25.899 -6.825 -29.058 0.83 85.73 C ATOM 1628 C6 A H 5 26.033 -6.877 -30.467 0.83 85.24 C ATOM 1629 N6 A H 5 27.073 -6.329 -31.106 0.83 84.85 N ATOM 1630 N1 A H 5 25.065 -7.510 -31.183 0.83 84.86 N ATOM 1631 C2 A H 5 24.025 -8.053 -30.524 0.83 84.88 C ATOM 1632 N3 A H 5 23.792 -8.067 -29.206 0.83 84.71 N ATOM 1633 C4 A H 5 24.773 -7.433 -28.520 0.83 85.19 C ATOM 1634 P A H 6 21.529 -9.789 -23.044 0.83 75.30 P ATOM 1635 OP1 A H 6 20.335 -10.459 -23.613 0.83 76.90 O ATOM 1636 OP2 A H 6 21.344 -8.744 -22.015 0.83 76.39 O ATOM 1637 O5' A H 6 22.536 -10.891 -22.489 0.83 71.26 O ATOM 1638 C5' A H 6 22.032 -12.024 -21.836 0.83 68.43 C ATOM 1639 C4' A H 6 23.146 -13.035 -21.653 0.83 66.48 C ATOM 1640 O4' A H 6 23.091 -13.574 -20.313 0.83 63.36 O ATOM 1641 C3' A H 6 23.078 -14.253 -22.565 0.83 67.67 C ATOM 1642 O3' A H 6 24.388 -14.803 -22.660 0.83 72.08 O ATOM 1643 C2' A H 6 22.141 -15.172 -21.785 0.83 66.95 C ATOM 1644 O2' A H 6 22.263 -16.541 -22.127 0.83 65.24 O ATOM 1645 C1' A H 6 22.649 -14.925 -20.362 0.83 63.27 C ATOM 1646 N9 A H 6 21.655 -15.183 -19.320 0.83 61.73 N ATOM 1647 C8 A H 6 20.494 -14.497 -19.034 0.83 61.15 C ATOM 1648 N7 A H 6 19.827 -14.999 -18.013 0.83 59.85 N ATOM 1649 C5 A H 6 20.600 -16.082 -17.614 0.83 60.32 C ATOM 1650 C6 A H 6 20.465 -17.047 -16.592 0.83 61.34 C ATOM 1651 N6 A H 6 19.439 -17.074 -15.738 0.83 61.81 N ATOM 1652 N1 A H 6 21.429 -17.995 -16.468 0.83 61.31 N ATOM 1653 C2 A H 6 22.466 -17.992 -17.314 0.83 60.70 C ATOM 1654 N3 A H 6 22.704 -17.138 -18.313 0.83 61.44 N ATOM 1655 C4 A H 6 21.731 -16.204 -18.407 0.83 61.25 C ATOM 1656 P A H 7 25.221 -14.793 -24.030 0.83 74.55 P ATOM 1657 OP1 A H 7 24.360 -14.205 -25.088 0.83 72.24 O ATOM 1658 OP2 A H 7 25.809 -16.148 -24.138 0.83 74.14 O ATOM 1659 O5' A H 7 26.483 -13.832 -23.764 0.83 73.80 O ATOM 1660 C5' A H 7 26.457 -12.412 -23.957 0.83 69.96 C ATOM 1661 C4' A H 7 27.286 -11.746 -22.869 0.83 67.31 C ATOM 1662 O4' A H 7 26.707 -12.124 -21.597 0.83 64.38 O ATOM 1663 C3' A H 7 28.765 -12.132 -22.795 0.83 66.95 C ATOM 1664 O3' A H 7 29.612 -10.990 -22.570 0.83 70.37 O ATOM 1665 C2' A H 7 28.816 -13.093 -21.615 0.83 64.67 C ATOM 1666 O2' A H 7 30.070 -13.063 -20.969 0.83 65.77 O ATOM 1667 C1' A H 7 27.721 -12.531 -20.716 0.83 61.38 C ATOM 1668 N9 A H 7 27.143 -13.504 -19.797 0.83 60.52 N ATOM 1669 C8 A H 7 26.562 -14.702 -20.128 0.83 60.48 C ATOM 1670 N7 A H 7 26.127 -15.401 -19.111 0.83 59.29 N ATOM 1671 C5 A H 7 26.435 -14.596 -18.029 0.83 59.36 C ATOM 1672 C6 A H 7 26.232 -14.766 -16.654 0.83 59.35 C ATOM 1673 N6 A H 7 25.641 -15.851 -16.140 0.83 59.10 N ATOM 1674 N1 A H 7 26.665 -13.779 -15.837 0.83 59.91 N ATOM 1675 C2 A H 7 27.253 -12.690 -16.349 0.83 58.97 C ATOM 1676 N3 A H 7 27.497 -12.419 -17.625 0.83 59.28 N ATOM 1677 C4 A H 7 27.061 -13.420 -18.424 0.83 60.51 C ATOM 1678 P A H 8 30.450 -10.315 -23.772 0.83 74.17 P ATOM 1679 OP1 A H 8 31.189 -9.143 -23.234 0.83 71.09 O ATOM 1680 OP2 A H 8 29.496 -10.110 -24.888 0.83 72.32 O ATOM 1681 O5' A H 8 31.488 -11.477 -24.209 0.83 75.13 O ATOM 1682 C5' A H 8 32.820 -11.582 -23.674 0.83 76.48 C ATOM 1683 C4' A H 8 33.780 -12.238 -24.659 0.83 77.80 C ATOM 1684 O4' A H 8 33.825 -11.449 -25.871 0.83 79.19 O ATOM 1685 C3' A H 8 35.233 -12.358 -24.191 0.83 78.72 C ATOM 1686 O3' A H 8 35.741 -13.682 -24.421 0.83 76.15 O ATOM 1687 C2' A H 8 35.983 -11.291 -24.999 0.83 80.09 C ATOM 1688 O2' A H 8 37.329 -11.625 -25.285 0.83 80.36 O ATOM 1689 C1' A H 8 35.161 -11.256 -26.281 0.83 82.39 C ATOM 1690 N9 A H 8 35.215 -10.001 -27.030 0.83 83.69 N ATOM 1691 C8 A H 8 35.170 -8.721 -26.532 0.83 84.01 C ATOM 1692 N7 A H 8 35.230 -7.785 -27.456 0.83 84.13 N ATOM 1693 C5 A H 8 35.316 -8.496 -28.647 0.83 84.67 C ATOM 1694 C6 A H 8 35.403 -8.091 -30.002 0.83 84.34 C ATOM 1695 N6 A H 8 35.421 -6.806 -30.389 0.83 83.87 N ATOM 1696 N1 A H 8 35.471 -9.065 -30.948 0.83 84.16 N ATOM 1697 C2 A H 8 35.451 -10.355 -30.567 0.83 84.45 C ATOM 1698 N3 A H 8 35.369 -10.855 -29.329 0.83 85.12 N ATOM 1699 C4 A H 8 35.305 -9.868 -28.404 0.83 84.86 C ATOM 1700 P A H 9 35.854 -14.771 -23.241 0.83 73.78 P ATOM 1701 OP1 A H 9 35.932 -16.107 -23.876 0.83 74.71 O ATOM 1702 OP2 A H 9 34.764 -14.497 -22.276 0.83 74.82 O ATOM 1703 O5' A H 9 37.265 -14.479 -22.553 0.83 71.36 O ATOM 1704 C5' A H 9 37.897 -15.535 -21.850 0.83 69.96 C ATOM 1705 C4' A H 9 39.390 -15.327 -21.685 0.83 69.42 C ATOM 1706 O4' A H 9 39.776 -15.787 -20.373 0.83 68.05 O ATOM 1707 C3' A H 9 40.289 -16.116 -22.634 0.83 70.92 C ATOM 1708 O3' A H 9 41.509 -15.413 -22.821 0.83 71.79 O ATOM 1709 C2' A H 9 40.608 -17.384 -21.865 0.83 70.03 C ATOM 1710 O2' A H 9 41.826 -17.966 -22.296 0.83 71.29 O ATOM 1711 C1' A H 9 40.774 -16.781 -20.478 0.83 66.79 C ATOM 1712 N9 A H 9 40.589 -17.739 -19.402 0.83 66.14 N ATOM 1713 C8 A H 9 39.463 -18.474 -19.128 0.83 66.28 C ATOM 1714 N7 A H 9 39.597 -19.262 -18.085 0.83 66.42 N ATOM 1715 C5 A H 9 40.894 -19.034 -17.652 0.83 65.47 C ATOM 1716 C6 A H 9 41.658 -19.561 -16.586 0.83 66.01 C ATOM 1717 N6 A H 9 41.191 -20.466 -15.724 0.83 65.98 N ATOM 1718 N1 A H 9 42.932 -19.118 -16.435 0.83 66.38 N ATOM 1719 C2 A H 9 43.407 -18.201 -17.296 0.83 65.97 C ATOM 1720 N3 A H 9 42.784 -17.630 -18.332 0.83 65.08 N ATOM 1721 C4 A H 9 41.522 -18.092 -18.457 0.83 65.61 C TER 1722 A H 9 HETATM 1723 C3' NHE A 70 36.226 -3.210 2.238 0.00 20.00 C HETATM 1724 C2' NHE A 70 34.988 -3.260 1.341 0.00 20.00 C HETATM 1725 C1' NHE A 70 34.477 -4.700 1.255 0.00 20.00 C HETATM 1726 C6' NHE A 70 34.116 -5.197 2.654 0.00 20.00 C HETATM 1727 N NHE A 70 33.288 -4.747 0.394 0.00 20.00 N HETATM 1728 C1 NHE A 70 33.275 -6.074 -0.235 0.00 20.00 C HETATM 1729 C2 NHE A 70 32.136 -6.167 -1.082 1.00103.62 C HETATM 1730 S NHE A 70 32.067 -7.642 -1.851 1.00105.07 S HETATM 1731 O1 NHE A 70 31.961 -8.754 -0.870 1.00103.53 O HETATM 1732 O2 NHE A 70 33.308 -7.806 -2.645 1.00103.79 O HETATM 1733 O3 NHE A 70 30.879 -7.659 -2.742 1.00103.45 O HETATM 1734 C5' NHE A 70 35.355 -5.148 3.550 0.00 20.00 C HETATM 1735 C4' NHE A 70 35.864 -3.707 3.637 0.00 20.00 C HETATM 1736 C3' NHE A 71 39.480 -4.447 6.006 0.00 20.00 C HETATM 1737 C2' NHE A 71 40.180 -3.875 4.773 0.00 20.00 C HETATM 1738 C1' NHE A 71 39.429 -4.308 3.512 0.00 20.00 C HETATM 1739 C6' NHE A 71 37.992 -3.790 3.571 0.00 20.00 C HETATM 1740 N NHE A 71 40.101 -3.759 2.327 0.00 20.00 N HETATM 1741 C1 NHE A 71 39.864 -4.707 1.231 0.00 20.00 C HETATM 1742 C2 NHE A 71 39.755 -4.320 -0.049 1.00112.08 C HETATM 1743 S NHE A 71 40.167 -5.177 -1.413 1.00112.09 S HETATM 1744 O1 NHE A 71 38.947 -5.695 -2.086 1.00110.61 O HETATM 1745 O2 NHE A 71 41.065 -6.294 -1.019 1.00110.65 O HETATM 1746 O3 NHE A 71 40.870 -4.262 -2.340 1.00111.56 O HETATM 1747 C5' NHE A 71 37.292 -4.362 4.805 0.00 20.00 C HETATM 1748 C4' NHE A 71 38.043 -3.927 6.065 0.00 20.00 C HETATM 1749 C3' NHE C 70 30.384 -3.110 4.136 0.00 20.00 C HETATM 1750 C2' NHE C 70 29.965 -2.225 2.961 0.00 20.00 C HETATM 1751 C1' NHE C 70 28.584 -2.657 2.462 0.00 20.00 C HETATM 1752 C6' NHE C 70 27.567 -2.520 3.595 0.00 20.00 C HETATM 1753 N NHE C 70 28.182 -1.806 1.335 0.00 20.00 N HETATM 1754 C1 NHE C 70 27.322 -2.628 0.473 0.00 20.00 C HETATM 1755 C2 NHE C 70 26.865 -2.152 -0.529 1.00100.09 C HETATM 1756 S NHE C 70 25.893 -2.812 -1.707 1.00101.24 S HETATM 1757 O1 NHE C 70 24.552 -3.153 -1.163 1.00100.16 O HETATM 1758 O2 NHE C 70 26.528 -4.049 -2.223 1.00 99.68 O HETATM 1759 O3 NHE C 70 25.745 -1.812 -2.791 1.00 99.80 O HETATM 1760 C5' NHE C 70 27.986 -3.407 4.769 0.00 20.00 C HETATM 1761 C4' NHE C 70 29.367 -2.972 5.268 0.00 20.00 C HETATM 1762 O HOH A 72 36.968 -8.470 -3.418 1.00 32.07 O HETATM 1763 O HOH B 70 27.854 -7.361 -3.357 1.00 37.64 O HETATM 1764 O HOH B 71 29.449 -9.853 -16.835 1.00 49.11 O HETATM 1765 O HOH C 71 24.201 0.931 -3.487 1.00 30.70 O HETATM 1766 O HOH C 72 26.591 8.400 -16.945 1.00 48.99 O HETATM 1767 O HOH C 73 11.686 6.966 2.299 1.00 60.49 O HETATM 1768 O HOH C 74 22.797 -1.720 -16.809 1.00 54.23 O HETATM 1769 O HOH H 10 13.718 -1.898 -19.496 1.00 53.67 O HETATM 1770 O HOH H 11 25.319 -18.007 -18.990 1.00 57.71 O CONECT 1723 1724 1735 CONECT 1724 1723 1725 CONECT 1725 1724 1726 1727 CONECT 1726 1725 1734 CONECT 1727 1725 1728 CONECT 1728 1727 1729 CONECT 1729 1728 1730 CONECT 1730 1729 1731 1732 1733 CONECT 1731 1730 CONECT 1732 1730 CONECT 1733 1730 CONECT 1734 1726 1735 CONECT 1735 1723 1734 CONECT 1736 1737 1748 CONECT 1737 1736 1738 CONECT 1738 1737 1739 1740 CONECT 1739 1738 1747 CONECT 1740 1738 1741 CONECT 1741 1740 1742 CONECT 1742 1741 1743 CONECT 1743 1742 1744 1745 1746 CONECT 1744 1743 CONECT 1745 1743 CONECT 1746 1743 CONECT 1747 1739 1748 CONECT 1748 1736 1747 CONECT 1749 1750 1761 CONECT 1750 1749 1751 CONECT 1751 1750 1752 1753 CONECT 1752 1751 1760 CONECT 1753 1751 1754 CONECT 1754 1753 1755 CONECT 1755 1754 1756 CONECT 1756 1755 1757 1758 1759 CONECT 1757 1756 CONECT 1758 1756 CONECT 1759 1756 CONECT 1760 1752 1761 CONECT 1761 1749 1760 MASTER 355 0 3 3 15 0 3 6 1766 4 39 19 END
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Entry Information
PDB ID
3gib
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
E. coli Protein hfq
Ligand Name
9-mer
EC.Number
E.C.-.-.-.-
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
Kd=1.4nM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) Proc.Natl.Acad.Sci.USA Vol. 106: pp. 19292-19297
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P0A6X3
Entrez Gene ID
NCBI Entrez Gene ID:
61753826
948689
ASD
Information of known allosteric effects of PDB entries
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