Browse entries in the PDBbind-CN Database
HEADER STRUCTURAL PROTEIN/DNA 14-JUN-05 1ZZI TITLE CRYSTAL STRUCTURE ANALYSIS OF THE THIRD KH DOMAIN OF HNRNP K IN TITLE 2 COMPLEX WITH SSDNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*CP*TP*CP*CP*CP*C)-3'; COMPND 3 CHAIN: C, D; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: HETEROGENEOUS NUCLEAR RIBONUCLEOPROTEIN K; COMPND 7 CHAIN: A, B; COMPND 8 FRAGMENT: KH3 DOMAIN; COMPND 9 SYNONYM: HNRNP K, TRANSFORMATION UP-REGULATED NUCLEAR PROTEIN, TUNP; COMPND 10 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 5 ORGANISM_COMMON: HUMAN; SOURCE 6 ORGANISM_TAXID: 9606; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PLYSS; SOURCE 10 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 11 EXPRESSION_SYSTEM_PLASMID: PETM11 KEYWDS PROTEIN-SSDNA COMPLEX, STRUCTURAL PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR P.H.BACKE,A.C.MESSIAS,R.B.RAVELLI,M.SATTLER,S.CUSACK REVDAT 3 13-JUL-11 1ZZI 1 VERSN REVDAT 2 24-FEB-09 1ZZI 1 VERSN REVDAT 1 09-AUG-05 1ZZI 0 JRNL AUTH P.H.BACKE,A.C.MESSIAS,R.B.RAVELLI,M.SATTLER,S.CUSACK JRNL TITL X-RAY CRYSTALLOGRAPHIC AND NMR STUDIES OF THE THIRD KH JRNL TITL 2 DOMAIN OF HNRNP K IN COMPLEX WITH SINGLE-STRANDED NUCLEIC JRNL TITL 3 ACIDS JRNL REF STRUCTURE V. 13 1055 2005 JRNL REFN ISSN 0969-2126 JRNL PMID 16004877 JRNL DOI 10.1016/J.STR.2005.04.008 REMARK 2 REMARK 2 RESOLUTION. 1.80 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0005 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.80 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 97.9 REMARK 3 NUMBER OF REFLECTIONS : 15030 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) : 0.197 REMARK 3 R VALUE (WORKING SET) : 0.195 REMARK 3 FREE R VALUE : 0.240 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 795 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) : 1.80 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.85 REMARK 3 REFLECTION IN BIN (WORKING SET) : 866 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 80.96 REMARK 3 BIN R VALUE (WORKING SET) : 0.2430 REMARK 3 BIN FREE R VALUE SET COUNT : 57 REMARK 3 BIN FREE R VALUE : 0.3250 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1235 REMARK 3 NUCLEIC ACID ATOMS : 209 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 136 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 36.82 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.88000 REMARK 3 B22 (A**2) : 0.88000 REMARK 3 B33 (A**2) : -1.32000 REMARK 3 B12 (A**2) : 0.44000 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): 0.154 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.144 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.103 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 6.410 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.956 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.933 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1488 ; 0.018 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2041 ; 1.894 ; 2.147 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 161 ; 5.866 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 54 ;38.096 ;25.926 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 243 ;16.098 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 6 ;24.933 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 236 ; 0.111 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1029 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 785 ; 0.229 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1065 ; 0.321 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 157 ; 0.162 ; 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): 75 ; 0.220 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 24 ; 0.203 ; 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): 815 ; 1.071 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1293 ; 1.742 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 764 ; 2.768 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 748 ; 3.793 ; 4.500 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 : 2 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 2 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 8 A 89 REMARK 3 RESIDUE RANGE : C 1 C 6 REMARK 3 ORIGIN FOR THE GROUP (A): 57.9725 39.5546 21.0852 REMARK 3 T TENSOR REMARK 3 T11: -0.1696 T22: -0.1753 REMARK 3 T33: -0.1178 T12: 0.0086 REMARK 3 T13: -0.0125 T23: 0.0186 REMARK 3 L TENSOR REMARK 3 L11: 1.7683 L22: 1.9498 REMARK 3 L33: 13.0701 L12: -0.0850 REMARK 3 L13: 2.8545 L23: -0.4235 REMARK 3 S TENSOR REMARK 3 S11: 0.1452 S12: -0.1007 S13: -0.2148 REMARK 3 S21: -0.0017 S22: -0.0329 S23: 0.0872 REMARK 3 S31: 0.5184 S32: -0.3394 S33: -0.1123 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 2 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 11 B 89 REMARK 3 RESIDUE RANGE : D 2 D 6 REMARK 3 ORIGIN FOR THE GROUP (A): 41.9822 39.8017 -0.9654 REMARK 3 T TENSOR REMARK 3 T11: -0.1368 T22: -0.1809 REMARK 3 T33: -0.1449 T12: 0.0421 REMARK 3 T13: -0.0080 T23: -0.0090 REMARK 3 L TENSOR REMARK 3 L11: 2.6045 L22: 2.8770 REMARK 3 L33: 5.3514 L12: -0.1595 REMARK 3 L13: 0.7431 L23: 2.3654 REMARK 3 S TENSOR REMARK 3 S11: 0.0645 S12: -0.0550 S13: 0.1095 REMARK 3 S21: -0.1630 S22: -0.2221 S23: 0.1032 REMARK 3 S31: -0.1630 S32: -0.2875 S33: 0.1576 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : BABINET MODEL WITH MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1ZZI COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 17-JUN-05. REMARK 100 THE RCSB ID CODE IS RCSB033304. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 02-SEP-02 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ESRF REMARK 200 BEAMLINE : ID14-4 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.94 REMARK 200 MONOCHROMATOR : KHOZU DUAL CRYSTAL SI(111) 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 : CCP4 (SCALA) REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 15859 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.800 REMARK 200 RESOLUTION RANGE LOW (A) : 34.300 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.0 REMARK 200 DATA REDUNDANCY : 6.900 REMARK 200 R MERGE (I) : 0.06200 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : 23.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.80 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.90 REMARK 200 COMPLETENESS FOR SHELL (%) : 87.6 REMARK 200 DATA REDUNDANCY IN SHELL : 6.10 REMARK 200 R MERGE FOR SHELL (I) : 0.41000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : 3.900 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 (%): 37.30 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.00 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 4000, TRIS HCL, MAGNESIUM REMARK 280 CHLORIDE, PH 8.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 294K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 31 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z+2/3 REMARK 290 6555 -X,-X+Y,-Z+1/3 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 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 34.96367 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 69.92733 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 69.92733 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 34.96367 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 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 300 REMARK: ASYMMETRIC UNIT CONTAINS TWO KH3-SSDNA COMPLEXES (CHAINS A+ REMARK 300 C AND B+D) WITH APPROXIMATELY 2-FOLD NCS REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: C, A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: D, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY B 8 REMARK 465 ALA B 9 REMARK 465 MET B 10 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 DC D 1 O5' C5' C4' O4' C3' C2' C1' REMARK 470 DC D 1 N1 C2 O2 N3 C4 N4 C5 REMARK 470 DC D 1 C6 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 DC D 6 O3' DC D 6 C3' -0.053 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DC C 4 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DT D 2 O4' - C1' - N1 ANGL. DEV. = -4.8 DEGREES REMARK 500 DC D 3 O4' - C1' - N1 ANGL. DEV. = -8.7 DEGREES REMARK 500 DC D 4 N3 - C2 - O2 ANGL. DEV. = 4.9 DEGREES REMARK 500 DC D 6 O4' - C1' - N1 ANGL. DEV. = -12.0 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1ZZJ RELATED DB: PDB REMARK 900 RELATED ID: 1ZZK RELATED DB: PDB DBREF 1ZZI A 11 89 UNP P61978 HNRPK_HUMAN 385 463 DBREF 1ZZI B 11 89 UNP P61978 HNRPK_HUMAN 385 463 DBREF 1ZZI C 1 6 PDB 1ZZI 1ZZI 1 6 DBREF 1ZZI D 1 6 PDB 1ZZI 1ZZI 1 6 SEQADV 1ZZI GLY A 8 UNP P61978 CLONING ARTIFACT SEQADV 1ZZI ALA A 9 UNP P61978 CLONING ARTIFACT SEQADV 1ZZI MET A 10 UNP P61978 CLONING ARTIFACT SEQADV 1ZZI GLY B 8 UNP P61978 CLONING ARTIFACT SEQADV 1ZZI ALA B 9 UNP P61978 CLONING ARTIFACT SEQADV 1ZZI MET B 10 UNP P61978 CLONING ARTIFACT SEQRES 1 C 6 DC DT DC DC DC DC SEQRES 1 D 6 DC DT DC DC DC DC SEQRES 1 A 82 GLY ALA MET GLY PRO ILE ILE THR THR GLN VAL THR ILE SEQRES 2 A 82 PRO LYS ASP LEU ALA GLY SER ILE ILE GLY LYS GLY GLY SEQRES 3 A 82 GLN ARG ILE LYS GLN ILE ARG HIS GLU SER GLY ALA SER SEQRES 4 A 82 ILE LYS ILE ASP GLU PRO LEU GLU GLY SER GLU ASP ARG SEQRES 5 A 82 ILE ILE THR ILE THR GLY THR GLN ASP GLN ILE GLN ASN SEQRES 6 A 82 ALA GLN TYR LEU LEU GLN ASN SER VAL LYS GLN TYR SER SEQRES 7 A 82 GLY LYS PHE PHE SEQRES 1 B 82 GLY ALA MET GLY PRO ILE ILE THR THR GLN VAL THR ILE SEQRES 2 B 82 PRO LYS ASP LEU ALA GLY SER ILE ILE GLY LYS GLY GLY SEQRES 3 B 82 GLN ARG ILE LYS GLN ILE ARG HIS GLU SER GLY ALA SER SEQRES 4 B 82 ILE LYS ILE ASP GLU PRO LEU GLU GLY SER GLU ASP ARG SEQRES 5 B 82 ILE ILE THR ILE THR GLY THR GLN ASP GLN ILE GLN ASN SEQRES 6 B 82 ALA GLN TYR LEU LEU GLN ASN SER VAL LYS GLN TYR SER SEQRES 7 B 82 GLY LYS PHE PHE FORMUL 5 HOH *136(H2 O) HELIX 1 1 LEU A 24 GLY A 30 1 7 HELIX 2 2 GLY A 33 GLY A 44 1 12 HELIX 3 3 THR A 66 GLN A 83 1 18 HELIX 4 4 LEU B 24 GLY B 30 1 7 HELIX 5 5 GLY B 33 GLY B 44 1 12 HELIX 6 6 THR B 66 VAL B 81 1 16 HELIX 7 7 LYS B 82 TYR B 84 5 3 SHEET 1 A 3 ILE A 14 PRO A 21 0 SHEET 2 A 3 ASP A 58 GLY A 65 -1 O ILE A 63 N THR A 16 SHEET 3 A 3 SER A 46 ILE A 49 -1 N SER A 46 O THR A 64 SHEET 1 B 3 ILE B 14 PRO B 21 0 SHEET 2 B 3 ASP B 58 GLY B 65 -1 O GLY B 65 N ILE B 14 SHEET 3 B 3 SER B 46 ILE B 49 -1 N SER B 46 O THR B 64 CRYST1 52.590 52.590 104.891 90.00 90.00 120.00 P 31 2 1 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 0.019015 0.010978 0.000000 0.00000 SCALE2 0.000000 0.021957 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009534 0.00000 ATOM 1 O5' DC C 1 60.390 43.032 35.063 1.00 35.36 O ATOM 2 C5' DC C 1 60.204 42.318 36.302 1.00 35.95 C ATOM 3 C4' DC C 1 58.776 41.837 36.555 1.00 35.33 C ATOM 4 O4' DC C 1 57.835 42.932 36.444 1.00 37.12 O ATOM 5 C3' DC C 1 58.332 40.881 35.462 1.00 34.52 C ATOM 6 O3' DC C 1 58.743 39.580 35.879 1.00 34.67 O ATOM 7 C2' DC C 1 56.823 41.035 35.414 1.00 35.86 C ATOM 8 C1' DC C 1 56.633 42.482 35.853 1.00 36.83 C ATOM 9 N1 DC C 1 56.286 43.386 34.744 1.00 35.13 N ATOM 10 C2 DC C 1 54.949 43.454 34.379 1.00 39.91 C ATOM 11 O2 DC C 1 54.120 42.772 35.014 1.00 40.91 O ATOM 12 N3 DC C 1 54.587 44.303 33.386 1.00 38.76 N ATOM 13 C4 DC C 1 55.513 45.029 32.740 1.00 40.06 C ATOM 14 N4 DC C 1 55.093 45.829 31.755 1.00 39.19 N ATOM 15 C5 DC C 1 56.881 44.960 33.079 1.00 35.33 C ATOM 16 C6 DC C 1 57.208 44.137 34.070 1.00 36.41 C ATOM 17 P DT C 2 58.994 38.513 34.688 1.00 33.89 P ATOM 18 OP1 DT C 2 58.012 38.627 33.619 1.00 29.84 O ATOM 19 OP2 DT C 2 59.343 37.274 35.487 1.00 29.81 O ATOM 20 O5' DT C 2 60.318 39.109 34.057 1.00 31.49 O ATOM 21 C5' DT C 2 61.485 39.278 34.845 1.00 31.82 C ATOM 22 C4' DT C 2 62.705 39.518 33.969 1.00 32.04 C ATOM 23 O4' DT C 2 63.228 38.250 33.478 1.00 32.67 O ATOM 24 C3' DT C 2 62.401 40.383 32.748 1.00 30.40 C ATOM 25 O3' DT C 2 63.579 41.227 32.461 1.00 33.57 O ATOM 26 C2' DT C 2 62.162 39.361 31.676 1.00 31.51 C ATOM 27 C1' DT C 2 63.161 38.284 32.076 1.00 33.48 C ATOM 28 N1 DT C 2 62.650 36.994 31.640 1.00 35.23 N ATOM 29 C2 DT C 2 63.449 36.210 30.845 1.00 36.09 C ATOM 30 O2 DT C 2 64.562 36.543 30.471 1.00 35.83 O ATOM 31 N3 DT C 2 62.845 35.060 30.436 1.00 33.64 N ATOM 32 C4 DT C 2 61.601 34.574 30.835 1.00 37.28 C ATOM 33 O4 DT C 2 61.134 33.486 30.438 1.00 36.34 O ATOM 34 C5 DT C 2 60.832 35.441 31.691 1.00 36.57 C ATOM 35 C7 DT C 2 59.570 34.929 32.336 1.00 36.00 C ATOM 36 C6 DT C 2 61.380 36.589 32.059 1.00 35.62 C ATOM 37 P DC C 3 63.579 42.730 33.029 1.00 31.14 P ATOM 38 OP1 DC C 3 64.965 43.249 32.846 1.00 33.36 O ATOM 39 OP2 DC C 3 62.938 42.615 34.336 1.00 32.63 O ATOM 40 O5' DC C 3 62.574 43.341 32.006 1.00 30.07 O ATOM 41 C5' DC C 3 63.021 43.804 30.681 1.00 32.19 C ATOM 42 C4' DC C 3 61.989 44.797 30.166 1.00 32.02 C ATOM 43 O4' DC C 3 60.803 44.063 29.750 1.00 33.37 O ATOM 44 C3' DC C 3 61.488 45.888 31.134 1.00 31.02 C ATOM 45 O3' DC C 3 61.223 47.043 30.373 1.00 32.43 O ATOM 46 C2' DC C 3 60.160 45.355 31.645 1.00 29.87 C ATOM 47 C1' DC C 3 59.672 44.610 30.398 1.00 31.86 C ATOM 48 N1 DC C 3 58.877 43.443 30.764 1.00 31.55 N ATOM 49 C2 DC C 3 57.591 43.313 30.268 1.00 34.05 C ATOM 50 O2 DC C 3 57.082 44.161 29.552 1.00 31.67 O ATOM 51 N3 DC C 3 56.877 42.202 30.595 1.00 33.01 N ATOM 52 C4 DC C 3 57.425 41.255 31.303 1.00 30.39 C ATOM 53 N4 DC C 3 56.625 40.234 31.575 1.00 32.79 N ATOM 54 C5 DC C 3 58.733 41.354 31.859 1.00 33.29 C ATOM 55 C6 DC C 3 59.448 42.453 31.542 1.00 30.96 C ATOM 56 P DC C 4 62.300 48.245 30.330 1.00 32.81 P ATOM 57 OP1 DC C 4 63.334 48.018 31.359 1.00 30.72 O ATOM 58 OP2 DC C 4 61.591 49.492 30.199 1.00 29.87 O ATOM 59 O5' DC C 4 62.899 48.009 28.888 1.00 33.04 O ATOM 60 C5' DC C 4 64.184 47.446 28.679 1.00 32.72 C ATOM 61 C4' DC C 4 64.239 46.961 27.241 1.00 31.22 C ATOM 62 O4' DC C 4 63.242 45.896 27.096 1.00 33.95 O ATOM 63 C3' DC C 4 63.805 47.972 26.252 1.00 30.67 C ATOM 64 O3' DC C 4 64.984 48.621 25.848 1.00 32.83 O ATOM 65 C2' DC C 4 63.304 47.174 25.085 1.00 34.17 C ATOM 66 C1' DC C 4 62.644 46.003 25.814 1.00 33.74 C ATOM 67 N1 DC C 4 61.181 46.080 25.937 1.00 34.54 N ATOM 68 C2 DC C 4 60.432 45.889 24.750 1.00 34.10 C ATOM 69 O2 DC C 4 61.047 45.739 23.688 1.00 35.63 O ATOM 70 N3 DC C 4 59.092 45.930 24.806 1.00 34.20 N ATOM 71 C4 DC C 4 58.471 46.102 25.979 1.00 34.16 C ATOM 72 N4 DC C 4 57.128 46.141 26.005 1.00 33.49 N ATOM 73 C5 DC C 4 59.190 46.335 27.180 1.00 33.84 C ATOM 74 C6 DC C 4 60.540 46.261 27.131 1.00 33.60 C ATOM 75 P DC C 5 64.875 50.170 25.560 1.00 36.92 P ATOM 76 OP1 DC C 5 66.249 50.633 25.140 1.00 35.72 O ATOM 77 OP2 DC C 5 64.092 50.874 26.622 1.00 37.97 O ATOM 78 O5' DC C 5 63.934 50.146 24.297 1.00 39.07 O ATOM 79 C5' DC C 5 64.311 49.744 22.984 1.00 40.83 C ATOM 80 C4' DC C 5 63.091 49.797 22.093 1.00 40.61 C ATOM 81 O4' DC C 5 62.121 48.860 22.582 1.00 40.73 O ATOM 82 C3' DC C 5 62.342 51.116 22.117 1.00 41.07 C ATOM 83 O3' DC C 5 62.936 51.870 21.096 1.00 46.57 O ATOM 84 C2' DC C 5 60.975 50.676 21.633 1.00 41.41 C ATOM 85 C1' DC C 5 60.838 49.341 22.347 1.00 39.63 C ATOM 86 N1 DC C 5 60.102 49.398 23.609 1.00 37.83 N ATOM 87 C2 DC C 5 58.718 49.270 23.508 1.00 38.49 C ATOM 88 O2 DC C 5 58.230 49.117 22.387 1.00 38.08 O ATOM 89 N3 DC C 5 57.983 49.318 24.632 1.00 35.21 N ATOM 90 C4 DC C 5 58.573 49.468 25.849 1.00 36.51 C ATOM 91 N4 DC C 5 57.790 49.535 26.939 1.00 34.84 N ATOM 92 C5 DC C 5 59.982 49.642 25.963 1.00 34.05 C ATOM 93 C6 DC C 5 60.715 49.601 24.825 1.00 35.15 C ATOM 94 P DC C 6 63.252 53.404 21.359 1.00 50.14 P ATOM 95 OP1 DC C 6 64.043 53.866 20.162 1.00 51.32 O ATOM 96 OP2 DC C 6 63.757 53.663 22.740 1.00 46.93 O ATOM 97 O5' DC C 6 61.757 54.008 21.283 1.00 50.42 O ATOM 98 C5' DC C 6 61.012 53.976 20.045 1.00 52.00 C ATOM 99 C4' DC C 6 59.534 54.242 20.311 1.00 52.30 C ATOM 100 O4' DC C 6 59.066 53.353 21.368 1.00 50.72 O ATOM 101 C3' DC C 6 59.205 55.683 20.714 1.00 51.49 C ATOM 102 O3' DC C 6 58.413 56.295 19.719 1.00 50.61 O ATOM 103 C2' DC C 6 58.428 55.543 22.027 1.00 52.69 C ATOM 104 C1' DC C 6 58.222 54.041 22.267 1.00 53.27 C ATOM 105 N1 DC C 6 58.549 53.651 23.673 1.00 54.76 N ATOM 106 C2 DC C 6 57.523 53.345 24.608 1.00 57.71 C ATOM 107 O2 DC C 6 56.331 53.395 24.253 1.00 58.42 O ATOM 108 N3 DC C 6 57.865 52.996 25.892 1.00 56.67 N ATOM 109 C4 DC C 6 59.167 52.949 26.257 1.00 55.19 C ATOM 110 N4 DC C 6 59.483 52.622 27.520 1.00 53.50 N ATOM 111 C5 DC C 6 60.217 53.254 25.317 1.00 56.68 C ATOM 112 C6 DC C 6 59.869 53.594 24.055 1.00 56.56 C TER 113 DC C 6 ATOM 114 O3' DC D 1 42.524 42.289 -15.335 1.00 39.66 O ATOM 115 P DT D 2 42.088 43.005 -13.949 1.00 42.37 P ATOM 116 OP1 DT D 2 42.133 44.489 -14.271 1.00 38.48 O ATOM 117 OP2 DT D 2 42.889 42.444 -12.839 1.00 41.21 O ATOM 118 O5' DT D 2 40.586 42.514 -13.687 1.00 38.42 O ATOM 119 C5' DT D 2 39.465 42.897 -14.494 1.00 37.64 C ATOM 120 C4' DT D 2 38.241 42.257 -13.834 1.00 36.43 C ATOM 121 O4' DT D 2 38.373 40.821 -13.769 1.00 35.13 O ATOM 122 C3' DT D 2 38.014 42.652 -12.359 1.00 33.99 C ATOM 123 O3' DT D 2 36.609 42.810 -12.151 1.00 35.60 O ATOM 124 C2' DT D 2 38.564 41.514 -11.539 1.00 34.91 C ATOM 125 C1' DT D 2 38.200 40.358 -12.456 1.00 35.05 C ATOM 126 N1 DT D 2 39.142 39.246 -12.369 1.00 34.78 N ATOM 127 C2 DT D 2 38.645 38.028 -11.935 1.00 35.80 C ATOM 128 O2 DT D 2 37.493 37.854 -11.577 1.00 37.55 O ATOM 129 N3 DT D 2 39.571 37.027 -11.889 1.00 36.40 N ATOM 130 C4 DT D 2 40.911 37.116 -12.240 1.00 35.13 C ATOM 131 O4 DT D 2 41.636 36.113 -12.155 1.00 35.83 O ATOM 132 C5 DT D 2 41.362 38.418 -12.724 1.00 35.75 C ATOM 133 C7 DT D 2 42.815 38.713 -12.942 1.00 35.17 C ATOM 134 C6 DT D 2 40.464 39.409 -12.763 1.00 34.48 C ATOM 135 P DC D 3 35.920 44.268 -12.179 1.00 35.18 P ATOM 136 OP1 DC D 3 34.480 43.954 -12.112 1.00 34.48 O ATOM 137 OP2 DC D 3 36.403 45.031 -13.364 1.00 34.59 O ATOM 138 O5' DC D 3 36.453 45.074 -10.963 1.00 34.13 O ATOM 139 C5' DC D 3 35.973 44.883 -9.606 1.00 34.58 C ATOM 140 C4' DC D 3 36.624 45.895 -8.667 1.00 34.08 C ATOM 141 O4' DC D 3 38.006 45.535 -8.423 1.00 32.58 O ATOM 142 C3' DC D 3 36.668 47.340 -9.145 1.00 34.95 C ATOM 143 O3' DC D 3 36.470 48.223 -8.022 1.00 34.43 O ATOM 144 C2' DC D 3 38.084 47.499 -9.687 1.00 34.33 C ATOM 145 C1' DC D 3 38.840 46.620 -8.681 1.00 35.97 C ATOM 146 N1 DC D 3 39.983 45.918 -9.196 1.00 36.88 N ATOM 147 C2 DC D 3 41.194 46.068 -8.529 1.00 35.87 C ATOM 148 O2 DC D 3 41.230 46.789 -7.549 1.00 36.81 O ATOM 149 N3 DC D 3 42.277 45.359 -8.958 1.00 36.51 N ATOM 150 C4 DC D 3 42.153 44.574 -10.020 1.00 34.21 C ATOM 151 N4 DC D 3 43.264 43.946 -10.398 1.00 37.37 N ATOM 152 C5 DC D 3 40.906 44.391 -10.729 1.00 36.15 C ATOM 153 C6 DC D 3 39.849 45.091 -10.292 1.00 36.61 C ATOM 154 P DC D 4 35.115 49.005 -7.771 1.00 33.84 P ATOM 155 OP1 DC D 4 34.277 48.859 -8.970 1.00 32.59 O ATOM 156 OP2 DC D 4 35.492 50.345 -7.242 1.00 33.11 O ATOM 157 O5' DC D 4 34.440 48.296 -6.516 1.00 33.83 O ATOM 158 C5' DC D 4 33.702 47.121 -6.648 1.00 32.75 C ATOM 159 C4' DC D 4 33.865 46.254 -5.431 1.00 30.96 C ATOM 160 O4' DC D 4 35.180 45.626 -5.448 1.00 30.81 O ATOM 161 C3' DC D 4 33.873 46.990 -4.123 1.00 29.33 C ATOM 162 O3' DC D 4 32.531 47.096 -3.722 1.00 33.41 O ATOM 163 C2' DC D 4 34.603 46.049 -3.181 1.00 32.59 C ATOM 164 C1' DC D 4 35.618 45.401 -4.133 1.00 32.20 C ATOM 165 N1 DC D 4 36.896 46.078 -4.051 1.00 31.81 N ATOM 166 C2 DC D 4 37.649 45.766 -2.934 1.00 32.92 C ATOM 167 O2 DC D 4 37.128 45.006 -2.107 1.00 31.83 O ATOM 168 N3 DC D 4 38.831 46.394 -2.816 1.00 32.96 N ATOM 169 C4 DC D 4 39.312 47.177 -3.785 1.00 33.65 C ATOM 170 N4 DC D 4 40.510 47.747 -3.614 1.00 34.15 N ATOM 171 C5 DC D 4 38.542 47.516 -4.951 1.00 32.32 C ATOM 172 C6 DC D 4 37.347 46.940 -5.021 1.00 32.38 C ATOM 173 P DC D 5 32.063 48.359 -2.919 1.00 34.58 P ATOM 174 OP1 DC D 5 30.645 48.107 -2.651 1.00 32.91 O ATOM 175 OP2 DC D 5 32.508 49.650 -3.519 1.00 30.32 O ATOM 176 O5' DC D 5 32.754 48.129 -1.496 1.00 31.78 O ATOM 177 C5' DC D 5 32.484 47.001 -0.665 1.00 32.76 C ATOM 178 C4' DC D 5 33.580 47.009 0.415 1.00 32.18 C ATOM 179 O4' DC D 5 34.898 47.160 -0.187 1.00 31.33 O ATOM 180 C3' DC D 5 33.428 48.167 1.387 1.00 33.02 C ATOM 181 O3' DC D 5 33.799 47.768 2.712 1.00 31.77 O ATOM 182 C2' DC D 5 34.413 49.226 0.912 1.00 33.62 C ATOM 183 C1' DC D 5 35.512 48.332 0.362 1.00 31.00 C ATOM 184 N1 DC D 5 36.329 48.948 -0.720 1.00 34.74 N ATOM 185 C2 DC D 5 37.693 49.169 -0.444 1.00 35.51 C ATOM 186 O2 DC D 5 38.106 48.833 0.670 1.00 34.91 O ATOM 187 N3 DC D 5 38.471 49.769 -1.390 1.00 36.71 N ATOM 188 C4 DC D 5 37.940 50.101 -2.573 1.00 34.81 C ATOM 189 N4 DC D 5 38.741 50.698 -3.484 1.00 35.17 N ATOM 190 C5 DC D 5 36.539 49.905 -2.860 1.00 35.10 C ATOM 191 C6 DC D 5 35.775 49.335 -1.922 1.00 33.03 C ATOM 192 P DC D 6 32.600 47.591 3.761 1.00 39.46 P ATOM 193 OP1 DC D 6 33.409 46.860 4.760 1.00 41.82 O ATOM 194 OP2 DC D 6 31.355 47.087 3.160 1.00 44.10 O ATOM 195 O5' DC D 6 32.247 49.064 4.232 1.00 36.04 O ATOM 196 C5' DC D 6 33.192 49.887 4.913 1.00 34.48 C ATOM 197 C4' DC D 6 32.683 51.302 4.899 1.00 31.40 C ATOM 198 O4' DC D 6 32.788 51.801 3.556 1.00 29.08 O ATOM 199 C3' DC D 6 31.194 51.454 5.232 1.00 31.94 C ATOM 200 O3' DC D 6 31.034 52.612 5.938 1.00 33.15 O ATOM 201 C2' DC D 6 30.530 51.580 3.854 1.00 32.31 C ATOM 202 C1' DC D 6 31.598 52.422 3.169 1.00 31.26 C ATOM 203 N1 DC D 6 31.814 52.291 1.746 1.00 29.02 N ATOM 204 C2 DC D 6 32.455 53.332 1.066 1.00 29.81 C ATOM 205 O2 DC D 6 32.778 54.344 1.655 1.00 30.71 O ATOM 206 N3 DC D 6 32.680 53.176 -0.263 1.00 34.49 N ATOM 207 C4 DC D 6 32.298 52.038 -0.854 1.00 29.62 C ATOM 208 N4 DC D 6 32.530 51.880 -2.156 1.00 34.70 N ATOM 209 C5 DC D 6 31.632 50.990 -0.174 1.00 29.51 C ATOM 210 C6 DC D 6 31.423 51.159 1.120 1.00 28.24 C TER 211 DC D 6 ATOM 212 N GLY A 8 67.359 38.621 -3.390 1.00 43.11 N ATOM 213 CA GLY A 8 66.143 38.818 -4.241 1.00 42.28 C ATOM 214 C GLY A 8 65.157 39.826 -3.651 1.00 41.18 C ATOM 215 O GLY A 8 65.449 40.472 -2.649 1.00 41.81 O ATOM 216 N ALA A 9 63.993 39.942 -4.293 1.00 40.38 N ATOM 217 CA ALA A 9 62.940 40.907 -3.941 1.00 39.24 C ATOM 218 C ALA A 9 62.153 40.550 -2.668 1.00 39.04 C ATOM 219 O ALA A 9 61.510 39.504 -2.603 1.00 39.79 O ATOM 220 CB ALA A 9 61.976 41.063 -5.113 1.00 39.52 C ATOM 221 N MET A 10 62.172 41.430 -1.677 1.00 36.16 N ATOM 222 CA MET A 10 61.553 41.126 -0.412 1.00 36.26 C ATOM 223 C MET A 10 60.140 41.653 -0.321 1.00 34.99 C ATOM 224 O MET A 10 59.411 41.267 0.581 1.00 35.19 O ATOM 225 CB MET A 10 62.383 41.667 0.753 1.00 36.66 C ATOM 226 CG MET A 10 63.671 40.936 1.003 1.00 41.09 C ATOM 227 SD MET A 10 63.430 39.161 1.207 1.00 45.62 S ATOM 228 CE MET A 10 64.003 38.565 -0.386 1.00 46.19 C ATOM 229 N GLY A 11 59.744 42.522 -1.259 1.00 33.89 N ATOM 230 CA GLY A 11 58.372 42.989 -1.296 1.00 34.06 C ATOM 231 C GLY A 11 58.117 44.052 -0.240 1.00 33.04 C ATOM 232 O GLY A 11 59.066 44.548 0.399 1.00 32.66 O ATOM 233 N PRO A 12 56.835 44.458 -0.089 1.00 33.12 N ATOM 234 CA PRO A 12 56.428 45.529 0.805 1.00 32.54 C ATOM 235 C PRO A 12 56.703 45.204 2.259 1.00 31.88 C ATOM 236 O PRO A 12 56.753 44.036 2.640 1.00 32.98 O ATOM 237 CB PRO A 12 54.909 45.579 0.590 1.00 32.57 C ATOM 238 CG PRO A 12 54.699 45.076 -0.734 1.00 34.31 C ATOM 239 CD PRO A 12 55.692 43.978 -0.875 1.00 33.65 C ATOM 240 N ILE A 13 56.924 46.254 3.033 1.00 31.81 N ATOM 241 CA ILE A 13 56.903 46.175 4.469 1.00 31.37 C ATOM 242 C ILE A 13 55.434 46.110 4.871 1.00 31.15 C ATOM 243 O ILE A 13 54.602 46.863 4.390 1.00 29.22 O ATOM 244 CB ILE A 13 57.560 47.356 5.033 1.00 30.71 C ATOM 245 CG1 ILE A 13 59.054 47.295 4.731 1.00 33.36 C ATOM 246 CG2 ILE A 13 57.461 47.388 6.548 1.00 29.93 C ATOM 247 CD1 ILE A 13 59.717 48.466 5.323 1.00 38.25 C ATOM 248 N ILE A 14 55.119 45.157 5.721 1.00 32.66 N ATOM 249 CA ILE A 14 53.758 44.903 6.114 1.00 32.33 C ATOM 250 C ILE A 14 53.780 44.745 7.620 1.00 33.07 C ATOM 251 O ILE A 14 54.847 44.600 8.231 1.00 32.50 O ATOM 252 CB ILE A 14 53.119 43.692 5.380 1.00 32.00 C ATOM 253 CG1 ILE A 14 54.082 42.486 5.345 1.00 32.25 C ATOM 254 CG2 ILE A 14 52.699 44.081 3.971 1.00 33.48 C ATOM 255 CD1 ILE A 14 53.429 41.084 5.012 1.00 33.58 C ATOM 256 N THR A 15 52.602 44.832 8.226 1.00 31.95 N ATOM 257 CA THR A 15 52.482 44.711 9.664 1.00 32.62 C ATOM 258 C THR A 15 51.555 43.560 10.043 1.00 32.99 C ATOM 259 O THR A 15 50.482 43.453 9.501 1.00 32.31 O ATOM 260 CB THR A 15 52.022 46.025 10.258 1.00 32.59 C ATOM 261 OG1 THR A 15 53.054 46.982 9.994 1.00 36.22 O ATOM 262 CG2 THR A 15 51.862 45.912 11.806 1.00 33.23 C ATOM 263 N THR A 16 52.034 42.662 10.907 1.00 33.21 N ATOM 264 CA THR A 16 51.204 41.591 11.399 1.00 34.71 C ATOM 265 C THR A 16 51.221 41.679 12.901 1.00 33.84 C ATOM 266 O THR A 16 52.211 42.107 13.513 1.00 34.01 O ATOM 267 CB THR A 16 51.719 40.168 11.017 1.00 36.04 C ATOM 268 OG1 THR A 16 51.912 40.091 9.596 1.00 42.39 O ATOM 269 CG2 THR A 16 50.650 39.080 11.396 1.00 36.46 C ATOM 270 N GLN A 17 50.141 41.217 13.489 1.00 31.80 N ATOM 271 CA GLN A 17 50.078 41.106 14.936 1.00 31.63 C ATOM 272 C GLN A 17 49.855 39.668 15.340 1.00 32.97 C ATOM 273 O GLN A 17 49.151 38.897 14.622 1.00 32.59 O ATOM 274 CB GLN A 17 48.921 41.954 15.403 1.00 32.82 C ATOM 275 CG GLN A 17 49.144 43.410 15.145 1.00 29.92 C ATOM 276 CD GLN A 17 48.099 44.254 15.803 1.00 28.96 C ATOM 277 OE1 GLN A 17 46.907 43.988 15.732 1.00 27.88 O ATOM 278 NE2 GLN A 17 48.543 45.312 16.448 1.00 32.86 N ATOM 279 N VAL A 18 50.378 39.306 16.501 1.00 33.17 N ATOM 280 CA VAL A 18 50.065 38.002 17.080 1.00 35.71 C ATOM 281 C VAL A 18 49.885 38.252 18.544 1.00 35.69 C ATOM 282 O VAL A 18 50.452 39.182 19.067 1.00 36.76 O ATOM 283 CB VAL A 18 51.219 37.019 16.893 1.00 36.38 C ATOM 284 CG1 VAL A 18 51.235 36.508 15.460 1.00 39.43 C ATOM 285 CG2 VAL A 18 52.524 37.656 17.211 1.00 38.54 C ATOM 286 N THR A 19 49.127 37.427 19.228 1.00 36.37 N ATOM 287 CA THR A 19 49.054 37.660 20.652 1.00 37.40 C ATOM 288 C THR A 19 49.850 36.589 21.353 1.00 38.49 C ATOM 289 O THR A 19 49.980 35.479 20.849 1.00 39.83 O ATOM 290 CB THR A 19 47.625 37.720 21.141 1.00 36.53 C ATOM 291 OG1 THR A 19 47.026 36.417 21.077 1.00 38.83 O ATOM 292 CG2 THR A 19 46.797 38.671 20.225 1.00 37.12 C ATOM 293 N ILE A 20 50.398 36.920 22.506 1.00 38.86 N ATOM 294 CA ILE A 20 51.027 35.913 23.338 1.00 39.94 C ATOM 295 C ILE A 20 50.411 35.945 24.695 1.00 38.70 C ATOM 296 O ILE A 20 50.123 37.022 25.211 1.00 39.07 O ATOM 297 CB ILE A 20 52.539 36.097 23.458 1.00 40.22 C ATOM 298 CG1 ILE A 20 52.897 37.501 23.991 1.00 39.26 C ATOM 299 CG2 ILE A 20 53.130 35.939 22.087 1.00 43.25 C ATOM 300 CD1 ILE A 20 54.381 37.688 24.442 1.00 43.01 C ATOM 301 N PRO A 21 50.207 34.762 25.291 1.00 37.95 N ATOM 302 CA PRO A 21 49.827 34.782 26.668 1.00 36.64 C ATOM 303 C PRO A 21 50.806 35.659 27.427 1.00 36.14 C ATOM 304 O PRO A 21 52.023 35.549 27.270 1.00 35.63 O ATOM 305 CB PRO A 21 49.928 33.312 27.086 1.00 36.42 C ATOM 306 CG PRO A 21 49.756 32.555 25.840 1.00 36.93 C ATOM 307 CD PRO A 21 50.320 33.394 24.754 1.00 37.55 C ATOM 308 N LYS A 22 50.261 36.534 28.256 1.00 37.01 N ATOM 309 CA LYS A 22 51.061 37.523 28.935 1.00 37.41 C ATOM 310 C LYS A 22 52.216 36.888 29.707 1.00 37.91 C ATOM 311 O LYS A 22 53.301 37.484 29.823 1.00 37.43 O ATOM 312 CB LYS A 22 50.177 38.382 29.843 1.00 38.25 C ATOM 313 CG LYS A 22 49.733 37.699 31.115 1.00 41.26 C ATOM 314 CD LYS A 22 48.787 38.548 31.929 1.00 47.07 C ATOM 315 CE LYS A 22 48.643 37.974 33.341 1.00 47.51 C ATOM 316 NZ LYS A 22 47.215 37.665 33.683 1.00 52.81 N ATOM 317 N ASP A 23 52.026 35.662 30.186 1.00 36.33 N ATOM 318 CA ASP A 23 53.064 35.100 31.033 1.00 37.02 C ATOM 319 C ASP A 23 54.259 34.660 30.242 1.00 36.50 C ATOM 320 O ASP A 23 55.322 34.452 30.814 1.00 38.66 O ATOM 321 CB ASP A 23 52.500 33.958 31.848 1.00 37.16 C ATOM 322 CG ASP A 23 51.675 34.455 32.988 1.00 40.07 C ATOM 323 OD1 ASP A 23 51.889 35.629 33.369 1.00 44.16 O ATOM 324 OD2 ASP A 23 50.835 33.701 33.506 1.00 43.01 O ATOM 325 N LEU A 24 54.097 34.517 28.933 1.00 34.07 N ATOM 326 CA LEU A 24 55.210 34.168 28.105 1.00 34.48 C ATOM 327 C LEU A 24 55.993 35.406 27.697 1.00 34.04 C ATOM 328 O LEU A 24 57.118 35.289 27.185 1.00 34.81 O ATOM 329 CB LEU A 24 54.753 33.362 26.887 1.00 33.82 C ATOM 330 CG LEU A 24 53.836 32.165 27.153 1.00 34.10 C ATOM 331 CD1 LEU A 24 53.630 31.345 25.846 1.00 37.01 C ATOM 332 CD2 LEU A 24 54.268 31.255 28.307 1.00 37.34 C ATOM 333 N ALA A 25 55.454 36.586 27.965 1.00 35.24 N ATOM 334 CA ALA A 25 56.104 37.807 27.417 1.00 35.45 C ATOM 335 C ALA A 25 57.527 37.980 27.885 1.00 36.06 C ATOM 336 O ALA A 25 58.361 38.399 27.099 1.00 37.86 O ATOM 337 CB ALA A 25 55.292 39.063 27.660 1.00 36.06 C ATOM 338 N GLY A 26 57.819 37.603 29.129 1.00 35.77 N ATOM 339 CA GLY A 26 59.163 37.803 29.676 1.00 36.52 C ATOM 340 C GLY A 26 60.189 37.021 28.861 1.00 36.29 C ATOM 341 O GLY A 26 61.329 37.468 28.705 1.00 35.83 O ATOM 342 N SER A 27 59.785 35.852 28.329 1.00 35.66 N ATOM 343 CA SER A 27 60.709 35.004 27.543 1.00 35.66 C ATOM 344 C SER A 27 61.099 35.628 26.228 1.00 35.89 C ATOM 345 O SER A 27 62.208 35.433 25.726 1.00 36.70 O ATOM 346 CB SER A 27 60.131 33.591 27.307 1.00 35.70 C ATOM 347 OG SER A 27 59.180 33.612 26.249 1.00 37.51 O ATOM 348 N ILE A 28 60.176 36.339 25.629 1.00 35.57 N ATOM 349 CA ILE A 28 60.495 36.989 24.397 1.00 37.04 C ATOM 350 C ILE A 28 61.300 38.253 24.614 1.00 35.64 C ATOM 351 O ILE A 28 62.043 38.685 23.701 1.00 36.04 O ATOM 352 CB ILE A 28 59.287 37.205 23.420 1.00 37.28 C ATOM 353 CG1 ILE A 28 58.371 38.306 23.831 1.00 41.71 C ATOM 354 CG2 ILE A 28 58.546 35.906 23.104 1.00 40.18 C ATOM 355 CD1 ILE A 28 58.920 39.605 23.368 1.00 53.02 C ATOM 356 N ILE A 29 61.084 38.924 25.755 1.00 33.51 N ATOM 357 CA ILE A 29 61.765 40.180 25.981 1.00 32.70 C ATOM 358 C ILE A 29 63.153 39.926 26.505 1.00 33.35 C ATOM 359 O ILE A 29 64.112 40.465 25.989 1.00 34.18 O ATOM 360 CB ILE A 29 60.956 41.071 26.953 1.00 34.33 C ATOM 361 CG1 ILE A 29 59.588 41.327 26.292 1.00 33.32 C ATOM 362 CG2 ILE A 29 61.725 42.400 27.238 1.00 33.00 C ATOM 363 CD1 ILE A 29 58.590 42.063 27.233 1.00 35.46 C ATOM 364 N GLY A 30 63.265 39.070 27.521 1.00 33.58 N ATOM 365 CA GLY A 30 64.560 38.737 28.114 1.00 32.26 C ATOM 366 C GLY A 30 64.988 39.829 29.079 1.00 32.28 C ATOM 367 O GLY A 30 64.457 40.919 29.074 1.00 32.12 O ATOM 368 N ALYS A 31 65.970 39.523 29.905 0.50 31.46 N ATOM 369 N BLYS A 31 65.955 39.521 29.932 0.50 31.54 N ATOM 370 CA ALYS A 31 66.482 40.467 30.881 0.50 30.84 C ATOM 371 CA BLYS A 31 66.458 40.498 30.892 0.50 31.04 C ATOM 372 C ALYS A 31 67.033 41.716 30.187 0.50 31.09 C ATOM 373 C BLYS A 31 67.010 41.717 30.176 0.50 31.18 C ATOM 374 O ALYS A 31 67.790 41.629 29.203 0.50 31.25 O ATOM 375 O BLYS A 31 67.746 41.613 29.177 0.50 31.29 O ATOM 376 CB ALYS A 31 67.572 39.770 31.719 0.50 30.46 C ATOM 377 CB BLYS A 31 67.545 39.886 31.804 0.50 30.63 C ATOM 378 CG ALYS A 31 68.103 40.562 32.880 0.50 30.45 C ATOM 379 CG BLYS A 31 67.024 39.191 33.055 0.50 31.88 C ATOM 380 CD ALYS A 31 67.226 40.519 34.111 0.50 32.52 C ATOM 381 CD BLYS A 31 66.312 40.162 34.014 0.50 30.02 C ATOM 382 CE ALYS A 31 68.063 40.903 35.299 0.50 31.39 C ATOM 383 CE BLYS A 31 66.875 40.023 35.418 0.50 30.58 C ATOM 384 NZ ALYS A 31 67.282 41.491 36.403 0.50 33.45 N ATOM 385 NZ BLYS A 31 65.820 39.803 36.432 0.50 30.86 N ATOM 386 N GLY A 32 66.612 42.888 30.646 1.00 31.50 N ATOM 387 CA GLY A 32 67.015 44.146 29.970 1.00 30.72 C ATOM 388 C GLY A 32 66.482 44.275 28.567 1.00 32.05 C ATOM 389 O GLY A 32 66.873 45.181 27.867 1.00 32.96 O ATOM 390 N GLY A 33 65.561 43.399 28.159 1.00 31.62 N ATOM 391 CA GLY A 33 65.109 43.371 26.753 1.00 32.15 C ATOM 392 C GLY A 33 66.151 42.746 25.807 1.00 34.19 C ATOM 393 O GLY A 33 66.087 42.907 24.580 1.00 34.96 O ATOM 394 N GLN A 34 67.116 42.002 26.351 1.00 34.62 N ATOM 395 CA GLN A 34 68.186 41.513 25.482 1.00 36.23 C ATOM 396 C GLN A 34 67.665 40.519 24.421 1.00 36.72 C ATOM 397 O GLN A 34 68.194 40.466 23.310 1.00 36.18 O ATOM 398 CB GLN A 34 69.317 40.914 26.294 1.00 37.22 C ATOM 399 CG GLN A 34 68.956 39.565 26.880 1.00 41.64 C ATOM 400 CD GLN A 34 70.103 38.969 27.677 1.00 45.75 C ATOM 401 OE1 GLN A 34 71.267 39.396 27.541 1.00 46.21 O ATOM 402 NE2 GLN A 34 69.783 37.973 28.521 1.00 48.13 N ATOM 403 N ARG A 35 66.646 39.731 24.751 1.00 35.93 N ATOM 404 CA ARG A 35 66.147 38.744 23.794 1.00 36.94 C ATOM 405 C ARG A 35 65.425 39.435 22.652 1.00 35.08 C ATOM 406 O ARG A 35 65.686 39.195 21.468 1.00 34.80 O ATOM 407 CB ARG A 35 65.257 37.648 24.439 1.00 38.60 C ATOM 408 CG ARG A 35 64.656 36.570 23.430 1.00 38.97 C ATOM 409 CD ARG A 35 65.679 35.969 22.389 1.00 45.27 C ATOM 410 NE ARG A 35 65.085 34.916 21.520 1.00 45.41 N ATOM 411 CZ ARG A 35 65.654 34.426 20.403 1.00 48.47 C ATOM 412 NH1 ARG A 35 66.839 34.881 19.992 1.00 48.64 N ATOM 413 NH2 ARG A 35 65.039 33.482 19.667 1.00 45.25 N ATOM 414 N ILE A 36 64.507 40.320 22.997 1.00 34.19 N ATOM 415 CA ILE A 36 63.744 40.954 21.951 1.00 33.27 C ATOM 416 C ILE A 36 64.647 41.883 21.135 1.00 34.10 C ATOM 417 O ILE A 36 64.478 42.009 19.927 1.00 33.95 O ATOM 418 CB ILE A 36 62.541 41.685 22.508 1.00 33.17 C ATOM 419 CG1 ILE A 36 61.659 42.185 21.361 1.00 35.64 C ATOM 420 CG2 ILE A 36 62.964 42.892 23.426 1.00 31.64 C ATOM 421 CD1 ILE A 36 61.035 40.947 20.549 1.00 41.75 C ATOM 422 N LYS A 37 65.646 42.508 21.770 1.00 34.89 N ATOM 423 CA LYS A 37 66.606 43.284 20.965 1.00 33.50 C ATOM 424 C LYS A 37 67.265 42.344 19.950 1.00 34.81 C ATOM 425 O LYS A 37 67.424 42.688 18.780 1.00 34.40 O ATOM 426 CB LYS A 37 67.654 43.942 21.851 1.00 35.14 C ATOM 427 CG LYS A 37 67.076 45.132 22.645 1.00 37.60 C ATOM 428 CD LYS A 37 68.203 45.894 23.344 1.00 42.73 C ATOM 429 CE LYS A 37 67.726 46.547 24.604 1.00 43.45 C ATOM 430 NZ LYS A 37 68.929 46.999 25.374 1.00 45.46 N ATOM 431 N GLN A 38 67.617 41.143 20.387 1.00 34.53 N ATOM 432 CA GLN A 38 68.277 40.216 19.461 1.00 35.99 C ATOM 433 C GLN A 38 67.359 39.794 18.337 1.00 35.34 C ATOM 434 O GLN A 38 67.768 39.698 17.172 1.00 35.31 O ATOM 435 CB GLN A 38 68.756 38.971 20.208 1.00 37.10 C ATOM 436 CG GLN A 38 69.319 37.874 19.280 1.00 40.79 C ATOM 437 CD GLN A 38 70.530 38.323 18.464 1.00 47.15 C ATOM 438 OE1 GLN A 38 71.265 39.252 18.863 1.00 49.98 O ATOM 439 NE2 GLN A 38 70.777 37.630 17.329 1.00 46.96 N ATOM 440 N ILE A 39 66.135 39.467 18.690 1.00 34.33 N ATOM 441 CA ILE A 39 65.186 39.023 17.700 1.00 33.83 C ATOM 442 C ILE A 39 64.930 40.149 16.692 1.00 34.66 C ATOM 443 O ILE A 39 64.820 39.902 15.485 1.00 33.56 O ATOM 444 CB ILE A 39 63.865 38.607 18.385 1.00 34.22 C ATOM 445 CG1 ILE A 39 64.037 37.320 19.197 1.00 35.99 C ATOM 446 CG2 ILE A 39 62.735 38.456 17.336 1.00 35.39 C ATOM 447 CD1 ILE A 39 62.888 37.080 20.170 1.00 38.04 C ATOM 448 N ARG A 40 64.786 41.394 17.163 1.00 32.78 N ATOM 449 CA ARG A 40 64.649 42.509 16.237 1.00 32.90 C ATOM 450 C ARG A 40 65.849 42.610 15.318 1.00 34.48 C ATOM 451 O ARG A 40 65.728 42.702 14.104 1.00 33.48 O ATOM 452 CB ARG A 40 64.532 43.814 17.024 1.00 32.87 C ATOM 453 CG ARG A 40 63.220 43.949 17.757 1.00 30.45 C ATOM 454 CD ARG A 40 63.296 45.166 18.696 1.00 33.32 C ATOM 455 NE ARG A 40 62.026 45.381 19.338 1.00 33.83 N ATOM 456 CZ ARG A 40 61.854 45.701 20.627 1.00 34.82 C ATOM 457 NH1 ARG A 40 62.893 45.800 21.439 1.00 33.65 N ATOM 458 NH2 ARG A 40 60.636 45.821 21.098 1.00 35.59 N ATOM 459 N HIS A 41 67.021 42.585 15.925 1.00 34.15 N ATOM 460 CA HIS A 41 68.257 42.620 15.153 1.00 35.25 C ATOM 461 C HIS A 41 68.371 41.480 14.130 1.00 35.44 C ATOM 462 O HIS A 41 68.683 41.707 12.952 1.00 35.01 O ATOM 463 CB HIS A 41 69.424 42.607 16.087 1.00 35.56 C ATOM 464 CG HIS A 41 70.725 42.371 15.394 1.00 38.84 C ATOM 465 ND1 HIS A 41 71.259 43.270 14.497 1.00 40.25 N ATOM 466 CD2 HIS A 41 71.568 41.316 15.423 1.00 40.60 C ATOM 467 CE1 HIS A 41 72.380 42.778 14.003 1.00 41.69 C ATOM 468 NE2 HIS A 41 72.596 41.598 14.557 1.00 42.40 N ATOM 469 N GLU A 42 68.113 40.259 14.575 1.00 34.85 N ATOM 470 CA GLU A 42 68.316 39.086 13.729 1.00 35.21 C ATOM 471 C GLU A 42 67.289 39.037 12.594 1.00 33.51 C ATOM 472 O GLU A 42 67.638 38.797 11.439 1.00 33.67 O ATOM 473 CB GLU A 42 68.158 37.822 14.576 1.00 35.31 C ATOM 474 CG GLU A 42 68.447 36.521 13.805 1.00 39.00 C ATOM 475 CD GLU A 42 68.655 35.317 14.730 1.00 40.23 C ATOM 476 OE1 GLU A 42 68.858 35.522 15.961 1.00 43.62 O ATOM 477 OE2 GLU A 42 68.626 34.177 14.199 1.00 46.29 O ATOM 478 N SER A 43 66.027 39.253 12.951 1.00 32.78 N ATOM 479 CA SER A 43 64.923 39.236 11.983 1.00 33.96 C ATOM 480 C SER A 43 64.883 40.441 11.016 1.00 34.09 C ATOM 481 O SER A 43 64.450 40.320 9.836 1.00 34.40 O ATOM 482 CB SER A 43 63.594 39.115 12.691 1.00 33.42 C ATOM 483 OG SER A 43 63.233 40.326 13.351 1.00 34.10 O ATOM 484 N GLY A 44 65.394 41.581 11.476 1.00 33.88 N ATOM 485 CA GLY A 44 65.296 42.802 10.685 1.00 33.22 C ATOM 486 C GLY A 44 63.913 43.435 10.802 1.00 35.03 C ATOM 487 O GLY A 44 63.690 44.539 10.321 1.00 34.48 O ATOM 488 N ALA A 45 63.006 42.754 11.501 1.00 33.90 N ATOM 489 CA ALA A 45 61.625 43.212 11.670 1.00 34.95 C ATOM 490 C ALA A 45 61.547 44.192 12.831 1.00 34.83 C ATOM 491 O ALA A 45 62.267 44.020 13.832 1.00 36.36 O ATOM 492 CB ALA A 45 60.712 42.029 11.974 1.00 33.86 C ATOM 493 N SER A 46 60.630 45.148 12.767 1.00 35.32 N ATOM 494 CA SER A 46 60.313 45.935 13.975 1.00 35.78 C ATOM 495 C SER A 46 59.339 45.114 14.767 1.00 36.34 C ATOM 496 O SER A 46 58.456 44.505 14.209 1.00 37.52 O ATOM 497 CB SER A 46 59.594 47.246 13.634 1.00 36.31 C ATOM 498 OG SER A 46 60.404 48.054 12.835 1.00 40.12 O ATOM 499 N ILE A 47 59.474 45.092 16.086 1.00 35.16 N ATOM 500 CA ILE A 47 58.615 44.239 16.860 1.00 34.75 C ATOM 501 C ILE A 47 58.226 45.063 18.072 1.00 35.21 C ATOM 502 O ILE A 47 59.106 45.630 18.745 1.00 36.19 O ATOM 503 CB ILE A 47 59.346 42.962 17.282 1.00 36.34 C ATOM 504 CG1 ILE A 47 59.897 42.206 16.037 1.00 37.66 C ATOM 505 CG2 ILE A 47 58.414 42.096 18.095 1.00 38.30 C ATOM 506 CD1 ILE A 47 60.913 41.166 16.434 1.00 38.28 C ATOM 507 N LYS A 48 56.926 45.158 18.326 1.00 32.98 N ATOM 508 CA LYS A 48 56.430 45.877 19.435 1.00 35.40 C ATOM 509 C LYS A 48 55.621 44.941 20.277 1.00 35.60 C ATOM 510 O LYS A 48 54.773 44.199 19.763 1.00 37.35 O ATOM 511 CB LYS A 48 55.510 46.989 18.975 1.00 35.37 C ATOM 512 CG LYS A 48 54.983 47.740 20.221 1.00 39.21 C ATOM 513 CD LYS A 48 54.517 49.126 19.917 1.00 43.66 C ATOM 514 CE LYS A 48 54.677 50.033 21.144 1.00 45.98 C ATOM 515 NZ LYS A 48 54.142 51.375 20.719 1.00 54.10 N ATOM 516 N ILE A 49 55.863 44.925 21.576 1.00 34.22 N ATOM 517 CA ILE A 49 55.035 44.106 22.417 1.00 35.04 C ATOM 518 C ILE A 49 54.273 45.060 23.286 1.00 34.94 C ATOM 519 O ILE A 49 54.887 45.790 24.029 1.00 34.97 O ATOM 520 CB ILE A 49 55.889 43.205 23.343 1.00 36.86 C ATOM 521 CG1 ILE A 49 57.049 42.599 22.564 1.00 39.38 C ATOM 522 CG2 ILE A 49 54.930 42.205 24.131 1.00 34.51 C ATOM 523 CD1 ILE A 49 56.685 41.623 21.591 1.00 42.80 C ATOM 524 N ASP A 50 52.958 45.060 23.205 1.00 33.82 N ATOM 525 CA ASP A 50 52.177 45.985 23.995 1.00 34.40 C ATOM 526 C ASP A 50 52.046 45.478 25.411 1.00 35.73 C ATOM 527 O ASP A 50 52.311 44.321 25.714 1.00 36.13 O ATOM 528 CB ASP A 50 50.764 46.100 23.426 1.00 35.95 C ATOM 529 CG ASP A 50 50.740 46.722 22.075 1.00 39.07 C ATOM 530 OD1 ASP A 50 51.751 47.323 21.684 1.00 43.68 O ATOM 531 OD2 ASP A 50 49.708 46.610 21.394 1.00 40.77 O ATOM 532 N GLU A 51 51.594 46.354 26.282 1.00 36.62 N ATOM 533 CA GLU A 51 50.986 45.922 27.528 1.00 38.13 C ATOM 534 C GLU A 51 49.669 45.207 27.247 1.00 38.51 C ATOM 535 O GLU A 51 49.048 45.402 26.180 1.00 39.12 O ATOM 536 CB GLU A 51 50.768 47.172 28.363 1.00 39.10 C ATOM 537 CG GLU A 51 52.076 47.708 28.863 1.00 40.78 C ATOM 538 CD GLU A 51 52.612 46.859 30.020 1.00 44.89 C ATOM 539 OE1 GLU A 51 51.923 46.721 31.052 1.00 50.37 O ATOM 540 OE2 GLU A 51 53.710 46.310 29.882 1.00 46.77 O ATOM 541 N PRO A 52 49.199 44.369 28.190 1.00 40.64 N ATOM 542 CA PRO A 52 47.833 43.850 27.958 1.00 41.00 C ATOM 543 C PRO A 52 46.777 44.958 27.934 1.00 42.07 C ATOM 544 O PRO A 52 46.923 45.961 28.629 1.00 42.45 O ATOM 545 CB PRO A 52 47.589 42.930 29.163 1.00 40.63 C ATOM 546 CG PRO A 52 48.545 43.420 30.200 1.00 41.23 C ATOM 547 CD PRO A 52 49.783 43.848 29.452 1.00 39.53 C ATOM 548 N LEU A 53 45.727 44.784 27.134 1.00 43.04 N ATOM 549 CA LEU A 53 44.564 45.665 27.218 1.00 44.70 C ATOM 550 C LEU A 53 43.895 45.411 28.561 1.00 45.48 C ATOM 551 O LEU A 53 44.153 44.386 29.192 1.00 45.37 O ATOM 552 CB LEU A 53 43.562 45.403 26.080 1.00 44.93 C ATOM 553 CG LEU A 53 43.955 45.222 24.599 1.00 45.43 C ATOM 554 CD1 LEU A 53 42.715 45.222 23.716 1.00 45.97 C ATOM 555 CD2 LEU A 53 44.941 46.258 24.084 1.00 47.70 C ATOM 556 N GLU A 54 43.024 46.333 28.979 1.00 46.96 N ATOM 557 CA GLU A 54 42.333 46.253 30.272 1.00 48.09 C ATOM 558 C GLU A 54 41.767 44.861 30.566 1.00 47.88 C ATOM 559 O GLU A 54 40.822 44.409 29.901 1.00 47.97 O ATOM 560 CB GLU A 54 41.209 47.282 30.323 1.00 48.34 C ATOM 561 CG GLU A 54 41.400 48.440 31.307 1.00 50.10 C ATOM 562 CD GLU A 54 40.499 49.631 30.949 1.00 50.19 C ATOM 563 OE1 GLU A 54 39.477 49.867 31.649 1.00 50.55 O ATOM 564 OE2 GLU A 54 40.813 50.317 29.943 1.00 52.01 O ATOM 565 N GLY A 55 42.376 44.192 31.549 1.00 47.58 N ATOM 566 CA GLY A 55 41.952 42.862 32.013 1.00 46.40 C ATOM 567 C GLY A 55 42.114 41.717 31.019 1.00 45.52 C ATOM 568 O GLY A 55 41.281 40.802 30.976 1.00 45.31 O ATOM 569 N SER A 56 43.179 41.762 30.221 1.00 44.30 N ATOM 570 CA SER A 56 43.428 40.740 29.203 1.00 42.91 C ATOM 571 C SER A 56 44.559 39.795 29.613 1.00 42.88 C ATOM 572 O SER A 56 45.519 40.206 30.276 1.00 42.60 O ATOM 573 CB SER A 56 43.787 41.394 27.863 1.00 42.93 C ATOM 574 OG SER A 56 44.182 40.420 26.910 1.00 38.74 O ATOM 575 N GLU A 57 44.435 38.535 29.198 1.00 42.23 N ATOM 576 CA GLU A 57 45.464 37.538 29.446 1.00 42.86 C ATOM 577 C GLU A 57 46.524 37.544 28.350 1.00 41.17 C ATOM 578 O GLU A 57 47.507 36.831 28.456 1.00 40.70 O ATOM 579 CB GLU A 57 44.874 36.138 29.519 1.00 43.56 C ATOM 580 CG GLU A 57 44.132 35.783 30.814 1.00 45.78 C ATOM 581 CD GLU A 57 43.161 34.611 30.612 1.00 46.34 C ATOM 582 OE1 GLU A 57 43.206 33.956 29.534 1.00 52.04 O ATOM 583 OE2 GLU A 57 42.341 34.348 31.522 1.00 47.66 O ATOM 584 N ASP A 58 46.305 38.323 27.289 1.00 39.85 N ATOM 585 CA ASP A 58 47.218 38.343 26.158 1.00 38.91 C ATOM 586 C ASP A 58 47.924 39.678 26.000 1.00 37.67 C ATOM 587 O ASP A 58 47.372 40.722 26.362 1.00 37.56 O ATOM 588 CB ASP A 58 46.489 38.055 24.855 1.00 39.35 C ATOM 589 CG ASP A 58 45.768 36.742 24.875 1.00 42.64 C ATOM 590 OD1 ASP A 58 46.391 35.729 25.310 1.00 45.82 O ATOM 591 OD2 ASP A 58 44.586 36.739 24.464 1.00 41.40 O ATOM 592 N ARG A 59 49.126 39.641 25.426 1.00 35.02 N ATOM 593 CA ARG A 59 49.754 40.843 24.931 1.00 34.79 C ATOM 594 C ARG A 59 49.879 40.750 23.427 1.00 35.63 C ATOM 595 O ARG A 59 50.121 39.662 22.872 1.00 35.99 O ATOM 596 CB ARG A 59 51.123 41.057 25.565 1.00 35.05 C ATOM 597 CG ARG A 59 50.895 41.310 27.047 1.00 33.90 C ATOM 598 CD ARG A 59 52.114 41.302 27.873 1.00 31.10 C ATOM 599 NE ARG A 59 52.990 42.401 27.469 1.00 32.15 N ATOM 600 CZ ARG A 59 54.134 42.670 28.094 1.00 33.09 C ATOM 601 NH1 ARG A 59 54.480 41.932 29.158 1.00 32.30 N ATOM 602 NH2 ARG A 59 54.918 43.664 27.655 1.00 33.92 N ATOM 603 N ILE A 60 49.693 41.887 22.781 1.00 33.89 N ATOM 604 CA ILE A 60 49.739 41.912 21.363 1.00 33.52 C ATOM 605 C ILE A 60 51.118 42.332 20.925 1.00 33.57 C ATOM 606 O ILE A 60 51.658 43.314 21.421 1.00 32.69 O ATOM 607 CB ILE A 60 48.659 42.865 20.781 1.00 33.87 C ATOM 608 CG1 ILE A 60 47.268 42.358 21.120 1.00 33.13 C ATOM 609 CG2 ILE A 60 48.851 42.979 19.261 1.00 33.68 C ATOM 610 CD1 ILE A 60 46.191 43.342 20.804 1.00 41.16 C ATOM 611 N ILE A 61 51.711 41.531 20.032 1.00 32.35 N ATOM 612 CA ILE A 61 52.959 41.814 19.439 1.00 32.80 C ATOM 613 C ILE A 61 52.634 42.265 18.025 1.00 32.54 C ATOM 614 O ILE A 61 51.842 41.614 17.304 1.00 31.94 O ATOM 615 CB ILE A 61 53.843 40.532 19.352 1.00 32.35 C ATOM 616 CG1 ILE A 61 53.867 39.820 20.719 1.00 36.00 C ATOM 617 CG2 ILE A 61 55.185 40.821 18.681 1.00 34.28 C ATOM 618 CD1 ILE A 61 54.923 38.635 20.799 1.00 37.12 C ATOM 619 N THR A 62 53.276 43.344 17.625 1.00 31.57 N ATOM 620 CA THR A 62 53.100 43.861 16.278 1.00 32.41 C ATOM 621 C THR A 62 54.432 43.731 15.622 1.00 32.43 C ATOM 622 O THR A 62 55.457 44.199 16.141 1.00 33.91 O ATOM 623 CB THR A 62 52.680 45.326 16.313 1.00 32.36 C ATOM 624 OG1 THR A 62 51.536 45.481 17.166 1.00 32.30 O ATOM 625 CG2 THR A 62 52.402 45.831 14.917 1.00 34.52 C ATOM 626 N ILE A 63 54.438 43.088 14.454 1.00 31.80 N ATOM 627 CA ILE A 63 55.686 42.822 13.785 1.00 32.00 C ATOM 628 C ILE A 63 55.590 43.506 12.428 1.00 32.03 C ATOM 629 O ILE A 63 54.626 43.306 11.719 1.00 32.53 O ATOM 630 CB ILE A 63 55.867 41.323 13.538 1.00 30.17 C ATOM 631 CG1 ILE A 63 55.689 40.564 14.886 1.00 31.54 C ATOM 632 CG2 ILE A 63 57.262 41.104 12.911 1.00 33.80 C ATOM 633 CD1 ILE A 63 55.763 38.956 14.772 1.00 32.42 C ATOM 634 N THR A 64 56.580 44.300 12.096 1.00 32.84 N ATOM 635 CA THR A 64 56.518 45.058 10.860 1.00 32.96 C ATOM 636 C THR A 64 57.797 44.773 10.137 1.00 31.84 C ATOM 637 O THR A 64 58.875 44.985 10.668 1.00 33.85 O ATOM 638 CB THR A 64 56.414 46.555 11.129 1.00 34.01 C ATOM 639 OG1 THR A 64 55.173 46.812 11.805 1.00 34.44 O ATOM 640 CG2 THR A 64 56.537 47.397 9.836 1.00 31.88 C ATOM 641 N GLY A 65 57.666 44.325 8.905 1.00 33.08 N ATOM 642 CA GLY A 65 58.842 44.088 8.087 1.00 31.90 C ATOM 643 C GLY A 65 58.389 43.485 6.801 1.00 31.21 C ATOM 644 O GLY A 65 57.199 43.377 6.538 1.00 33.22 O ATOM 645 N THR A 66 59.335 43.098 5.968 1.00 30.05 N ATOM 646 CA THR A 66 58.984 42.315 4.797 1.00 30.26 C ATOM 647 C THR A 66 58.408 40.969 5.251 1.00 29.92 C ATOM 648 O THR A 66 58.567 40.582 6.424 1.00 30.55 O ATOM 649 CB THR A 66 60.219 42.083 3.918 1.00 30.32 C ATOM 650 OG1 THR A 66 61.206 41.374 4.667 1.00 31.33 O ATOM 651 CG2 THR A 66 60.819 43.413 3.459 1.00 31.46 C ATOM 652 N GLN A 67 57.714 40.273 4.361 1.00 30.34 N ATOM 653 CA GLN A 67 57.148 38.995 4.742 1.00 32.33 C ATOM 654 C GLN A 67 58.235 38.076 5.323 1.00 31.96 C ATOM 655 O GLN A 67 58.073 37.481 6.385 1.00 32.73 O ATOM 656 CB GLN A 67 56.438 38.329 3.557 1.00 32.92 C ATOM 657 CG GLN A 67 55.719 37.036 3.981 1.00 37.50 C ATOM 658 CD GLN A 67 54.863 37.259 5.247 1.00 45.26 C ATOM 659 OE1 GLN A 67 53.866 38.008 5.218 1.00 47.61 O ATOM 660 NE2 GLN A 67 55.265 36.634 6.367 1.00 45.86 N ATOM 661 N ASP A 68 59.370 38.005 4.651 1.00 32.39 N ATOM 662 CA ASP A 68 60.470 37.140 5.146 1.00 33.18 C ATOM 663 C ASP A 68 60.940 37.533 6.542 1.00 32.27 C ATOM 664 O ASP A 68 61.219 36.673 7.381 1.00 32.02 O ATOM 665 CB ASP A 68 61.600 37.139 4.140 1.00 33.77 C ATOM 666 CG ASP A 68 61.269 36.282 2.940 1.00 41.41 C ATOM 667 OD1 ASP A 68 60.590 35.229 3.115 1.00 47.74 O ATOM 668 OD2 ASP A 68 61.660 36.644 1.809 1.00 48.13 O ATOM 669 N GLN A 69 60.967 38.827 6.824 1.00 31.77 N ATOM 670 CA GLN A 69 61.415 39.302 8.145 1.00 31.25 C ATOM 671 C GLN A 69 60.417 38.939 9.208 1.00 31.46 C ATOM 672 O GLN A 69 60.774 38.497 10.312 1.00 31.99 O ATOM 673 CB GLN A 69 61.596 40.816 8.129 1.00 31.56 C ATOM 674 CG GLN A 69 62.847 41.192 7.386 1.00 33.66 C ATOM 675 CD GLN A 69 62.913 42.673 7.221 1.00 36.06 C ATOM 676 OE1 GLN A 69 61.886 43.349 7.224 1.00 32.42 O ATOM 677 NE2 GLN A 69 64.109 43.188 7.077 1.00 36.02 N ATOM 678 N ILE A 70 59.158 39.095 8.869 1.00 31.09 N ATOM 679 CA ILE A 70 58.087 38.830 9.839 1.00 34.12 C ATOM 680 C ILE A 70 58.112 37.319 10.143 1.00 34.19 C ATOM 681 O ILE A 70 58.046 36.888 11.323 1.00 34.89 O ATOM 682 CB ILE A 70 56.761 39.195 9.255 1.00 34.16 C ATOM 683 CG1 ILE A 70 56.565 40.722 9.348 1.00 35.06 C ATOM 684 CG2 ILE A 70 55.603 38.398 9.995 1.00 34.63 C ATOM 685 CD1 ILE A 70 55.411 41.182 8.606 1.00 38.26 C ATOM 686 N GLN A 71 58.286 36.534 9.090 1.00 33.62 N ATOM 687 CA GLN A 71 58.310 35.063 9.173 1.00 34.95 C ATOM 688 C GLN A 71 59.426 34.678 10.104 1.00 34.52 C ATOM 689 O GLN A 71 59.215 33.871 11.031 1.00 35.10 O ATOM 690 CB GLN A 71 58.549 34.441 7.780 1.00 35.13 C ATOM 691 CG GLN A 71 57.318 34.517 6.840 1.00 37.66 C ATOM 692 CD GLN A 71 57.561 33.934 5.440 1.00 37.69 C ATOM 693 OE1 GLN A 71 58.651 33.423 5.130 0.50 40.65 O ATOM 694 NE2 GLN A 71 56.536 33.990 4.600 0.50 38.54 N ATOM 695 N ASN A 72 60.605 35.277 9.892 1.00 34.42 N ATOM 696 CA ASN A 72 61.780 35.044 10.750 1.00 34.04 C ATOM 697 C ASN A 72 61.543 35.454 12.194 1.00 32.22 C ATOM 698 O ASN A 72 61.860 34.717 13.146 1.00 31.53 O ATOM 699 CB ASN A 72 63.008 35.807 10.189 1.00 35.44 C ATOM 700 CG ASN A 72 64.388 35.292 10.762 1.00 41.63 C ATOM 701 OD1 ASN A 72 65.443 35.915 10.511 1.00 48.09 O ATOM 702 ND2 ASN A 72 64.381 34.174 11.513 1.00 44.55 N ATOM 703 N ALA A 73 61.005 36.653 12.378 1.00 32.13 N ATOM 704 CA ALA A 73 60.696 37.102 13.693 1.00 31.81 C ATOM 705 C ALA A 73 59.759 36.145 14.420 1.00 31.89 C ATOM 706 O ALA A 73 59.934 35.883 15.581 1.00 30.74 O ATOM 707 CB ALA A 73 60.018 38.481 13.595 1.00 32.02 C ATOM 708 N GLN A 74 58.693 35.732 13.757 1.00 31.80 N ATOM 709 CA GLN A 74 57.750 34.818 14.368 1.00 33.61 C ATOM 710 C GLN A 74 58.457 33.548 14.836 1.00 33.54 C ATOM 711 O GLN A 74 58.271 33.085 15.968 1.00 33.36 O ATOM 712 CB GLN A 74 56.655 34.515 13.363 1.00 36.25 C ATOM 713 CG GLN A 74 55.784 35.735 13.207 1.00 37.68 C ATOM 714 CD GLN A 74 54.476 35.474 12.543 1.00 45.49 C ATOM 715 OE1 GLN A 74 53.423 35.612 13.171 1.00 48.85 O ATOM 716 NE2 GLN A 74 54.516 35.094 11.267 1.00 47.72 N ATOM 717 N TYR A 75 59.257 32.984 13.948 1.00 32.90 N ATOM 718 CA TYR A 75 59.980 31.754 14.298 1.00 33.93 C ATOM 719 C TYR A 75 60.801 31.985 15.557 1.00 32.37 C ATOM 720 O TYR A 75 60.825 31.148 16.474 1.00 32.17 O ATOM 721 CB TYR A 75 60.897 31.338 13.162 1.00 34.87 C ATOM 722 CG TYR A 75 61.542 30.012 13.389 1.00 38.92 C ATOM 723 CD1 TYR A 75 60.757 28.848 13.476 1.00 41.57 C ATOM 724 CD2 TYR A 75 62.932 29.889 13.501 1.00 40.18 C ATOM 725 CE1 TYR A 75 61.329 27.609 13.678 1.00 41.65 C ATOM 726 CE2 TYR A 75 63.519 28.643 13.710 1.00 41.45 C ATOM 727 CZ TYR A 75 62.702 27.504 13.799 1.00 41.24 C ATOM 728 OH TYR A 75 63.228 26.243 13.991 1.00 40.72 O ATOM 729 N LEU A 76 61.520 33.094 15.578 1.00 32.10 N ATOM 730 CA LEU A 76 62.399 33.420 16.714 1.00 32.85 C ATOM 731 C LEU A 76 61.660 33.739 17.990 1.00 32.67 C ATOM 732 O LEU A 76 62.134 33.425 19.102 1.00 32.16 O ATOM 733 CB LEU A 76 63.308 34.607 16.385 1.00 32.23 C ATOM 734 CG LEU A 76 64.387 34.399 15.322 1.00 35.41 C ATOM 735 CD1 LEU A 76 64.990 35.804 15.149 1.00 37.15 C ATOM 736 CD2 LEU A 76 65.457 33.376 15.717 1.00 38.65 C ATOM 737 N LEU A 77 60.484 34.328 17.840 1.00 32.31 N ATOM 738 CA LEU A 77 59.620 34.567 18.983 1.00 33.06 C ATOM 739 C LEU A 77 59.095 33.241 19.507 1.00 32.58 C ATOM 740 O LEU A 77 59.091 33.029 20.710 1.00 33.97 O ATOM 741 CB LEU A 77 58.456 35.477 18.600 1.00 32.39 C ATOM 742 CG LEU A 77 58.817 36.954 18.354 1.00 35.48 C ATOM 743 CD1 LEU A 77 57.670 37.609 17.622 1.00 35.74 C ATOM 744 CD2 LEU A 77 59.103 37.655 19.669 1.00 33.89 C ATOM 745 N GLN A 78 58.714 32.343 18.608 1.00 32.97 N ATOM 746 CA GLN A 78 58.234 31.023 19.019 1.00 34.63 C ATOM 747 C GLN A 78 59.357 30.297 19.749 1.00 36.01 C ATOM 748 O GLN A 78 59.159 29.699 20.831 1.00 35.02 O ATOM 749 CB GLN A 78 57.808 30.186 17.802 1.00 35.08 C ATOM 750 CG GLN A 78 56.848 29.068 18.191 1.00 39.01 C ATOM 751 CD GLN A 78 55.438 29.597 18.455 1.00 42.10 C ATOM 752 OE1 GLN A 78 54.692 29.002 19.234 1.00 46.99 O ATOM 753 NE2 GLN A 78 55.072 30.715 17.801 1.00 39.62 N ATOM 754 N ASN A 79 60.535 30.330 19.130 1.00 36.82 N ATOM 755 CA ASN A 79 61.730 29.708 19.709 1.00 38.06 C ATOM 756 C ASN A 79 62.013 30.186 21.097 1.00 37.95 C ATOM 757 O ASN A 79 62.513 29.430 21.924 1.00 37.14 O ATOM 758 CB ASN A 79 62.967 30.018 18.871 1.00 38.10 C ATOM 759 CG ASN A 79 62.957 29.327 17.555 1.00 41.52 C ATOM 760 OD1 ASN A 79 62.150 28.419 17.310 1.00 41.93 O ATOM 761 ND2 ASN A 79 63.852 29.758 16.669 1.00 44.82 N ATOM 762 N SER A 80 61.726 31.458 21.348 1.00 38.13 N ATOM 763 CA SER A 80 62.003 32.102 22.642 1.00 39.64 C ATOM 764 C SER A 80 61.295 31.473 23.826 1.00 40.86 C ATOM 765 O SER A 80 61.881 31.332 24.913 1.00 40.51 O ATOM 766 CB SER A 80 61.641 33.579 22.580 1.00 39.24 C ATOM 767 OG SER A 80 62.684 34.255 21.953 1.00 43.65 O ATOM 768 N VAL A 81 60.028 31.109 23.621 1.00 41.65 N ATOM 769 CA VAL A 81 59.348 30.158 24.538 1.00 42.29 C ATOM 770 C VAL A 81 60.167 28.955 24.998 1.00 42.73 C ATOM 771 O VAL A 81 60.203 28.678 26.177 1.00 42.25 O ATOM 772 CB VAL A 81 57.965 29.728 24.020 1.00 42.45 C ATOM 773 CG1 VAL A 81 57.148 29.109 25.165 1.00 42.67 C ATOM 774 CG2 VAL A 81 57.249 30.932 23.506 1.00 42.18 C ATOM 775 N LYS A 82 60.822 28.210 24.111 1.00 43.65 N ATOM 776 CA LYS A 82 61.684 27.152 24.617 1.00 43.91 C ATOM 777 C LYS A 82 62.595 27.544 25.817 1.00 42.91 C ATOM 778 O LYS A 82 62.739 26.746 26.754 1.00 42.10 O ATOM 779 CB LYS A 82 62.438 26.433 23.494 1.00 44.99 C ATOM 780 CG LYS A 82 61.551 26.157 22.272 1.00 47.68 C ATOM 781 CD LYS A 82 61.816 24.793 21.631 1.00 48.19 C ATOM 782 CE LYS A 82 61.324 24.795 20.163 1.00 49.19 C ATOM 783 NZ LYS A 82 61.358 23.453 19.465 1.00 49.69 N ATOM 784 N GLN A 83 63.167 28.758 25.797 1.00 41.41 N ATOM 785 CA GLN A 83 63.915 29.347 26.935 1.00 41.15 C ATOM 786 C GLN A 83 63.054 29.904 28.090 1.00 38.96 C ATOM 787 O GLN A 83 63.603 30.456 29.033 1.00 36.59 O ATOM 788 CB GLN A 83 64.787 30.537 26.462 1.00 41.80 C ATOM 789 CG GLN A 83 66.329 30.311 26.298 1.00 44.28 C ATOM 790 CD GLN A 83 66.986 31.372 25.332 1.00 46.26 C ATOM 791 OE1 GLN A 83 67.680 32.306 25.771 1.00 47.81 O ATOM 792 NE2 GLN A 83 66.762 31.197 24.011 1.00 49.98 N ATOM 793 N TYR A 84 61.728 29.804 28.015 1.00 37.32 N ATOM 794 CA TYR A 84 60.849 30.488 28.973 1.00 35.09 C ATOM 795 C TYR A 84 61.046 29.932 30.374 1.00 34.83 C ATOM 796 O TYR A 84 61.058 28.723 30.580 1.00 32.59 O ATOM 797 CB TYR A 84 59.372 30.381 28.549 1.00 36.24 C ATOM 798 CG TYR A 84 58.342 30.673 29.632 1.00 35.98 C ATOM 799 CD1 TYR A 84 58.263 31.929 30.237 1.00 38.21 C ATOM 800 CD2 TYR A 84 57.436 29.691 30.038 1.00 40.52 C ATOM 801 CE1 TYR A 84 57.323 32.205 31.207 1.00 37.83 C ATOM 802 CE2 TYR A 84 56.483 29.951 31.027 1.00 40.49 C ATOM 803 CZ TYR A 84 56.419 31.233 31.577 1.00 39.06 C ATOM 804 OH TYR A 84 55.511 31.535 32.559 1.00 40.87 O ATOM 805 N SER A 85 61.231 30.846 31.323 1.00 34.58 N ATOM 806 CA SER A 85 61.755 30.448 32.640 1.00 34.65 C ATOM 807 C SER A 85 60.674 30.332 33.715 1.00 36.06 C ATOM 808 O SER A 85 60.978 29.906 34.837 1.00 35.42 O ATOM 809 CB SER A 85 62.821 31.451 33.110 1.00 33.09 C ATOM 810 OG SER A 85 62.250 32.737 33.189 1.00 36.39 O ATOM 811 N GLY A 86 59.432 30.721 33.382 1.00 37.74 N ATOM 812 CA GLY A 86 58.323 30.656 34.346 1.00 38.38 C ATOM 813 C GLY A 86 57.469 29.385 34.302 1.00 39.56 C ATOM 814 O GLY A 86 57.845 28.385 33.670 1.00 39.43 O ATOM 815 N LYS A 87 56.335 29.424 35.009 1.00 40.42 N ATOM 816 CA LYS A 87 55.329 28.323 35.024 1.00 40.95 C ATOM 817 C LYS A 87 54.467 28.459 33.776 1.00 40.97 C ATOM 818 O LYS A 87 54.057 29.579 33.409 1.00 42.32 O ATOM 819 CB LYS A 87 54.389 28.424 36.236 1.00 41.08 C ATOM 820 CG LYS A 87 54.952 28.377 37.629 1.00 42.02 C ATOM 821 CD LYS A 87 53.833 28.821 38.585 1.00 42.95 C ATOM 822 CE LYS A 87 54.115 28.576 40.053 1.00 45.80 C ATOM 823 NZ LYS A 87 53.479 27.325 40.620 1.00 47.97 N ATOM 824 N PHE A 88 54.233 27.355 33.072 1.00 40.74 N ATOM 825 CA PHE A 88 53.324 27.376 31.926 1.00 40.28 C ATOM 826 C PHE A 88 51.896 27.388 32.431 1.00 41.41 C ATOM 827 O PHE A 88 50.991 27.883 31.749 1.00 41.82 O ATOM 828 CB PHE A 88 53.539 26.162 31.015 1.00 40.23 C ATOM 829 CG PHE A 88 54.729 26.286 30.119 1.00 39.87 C ATOM 830 CD1 PHE A 88 54.623 26.933 28.897 1.00 38.20 C ATOM 831 CD2 PHE A 88 55.962 25.754 30.498 1.00 39.39 C ATOM 832 CE1 PHE A 88 55.720 27.055 28.075 1.00 39.79 C ATOM 833 CE2 PHE A 88 57.069 25.876 29.683 1.00 38.07 C ATOM 834 CZ PHE A 88 56.950 26.517 28.464 1.00 39.31 C ATOM 835 N PHE A 89 51.733 26.814 33.623 1.00 40.90 N ATOM 836 CA PHE A 89 50.507 26.820 34.390 1.00 41.82 C ATOM 837 C PHE A 89 50.867 26.298 35.775 1.00 41.87 C ATOM 838 O PHE A 89 49.981 26.033 36.595 1.00 42.78 O ATOM 839 CB PHE A 89 49.454 25.901 33.739 1.00 41.81 C ATOM 840 CG PHE A 89 49.851 24.455 33.703 1.00 41.36 C ATOM 841 CD1 PHE A 89 49.560 23.615 34.769 1.00 39.81 C ATOM 842 CD2 PHE A 89 50.527 23.936 32.611 1.00 41.30 C ATOM 843 CE1 PHE A 89 49.925 22.270 34.742 1.00 43.42 C ATOM 844 CE2 PHE A 89 50.895 22.593 32.579 1.00 40.86 C ATOM 845 CZ PHE A 89 50.591 21.760 33.640 1.00 42.19 C ATOM 846 OXT PHE A 89 52.041 26.087 36.109 1.00 41.95 O TER 847 PHE A 89 ATOM 848 N GLY B 11 38.132 36.129 20.603 1.00 44.03 N ATOM 849 CA GLY B 11 39.349 36.620 21.349 1.00 42.83 C ATOM 850 C GLY B 11 39.752 38.041 20.989 1.00 41.41 C ATOM 851 O GLY B 11 38.901 38.834 20.613 1.00 42.45 O ATOM 852 N PRO B 12 41.042 38.389 21.157 1.00 39.98 N ATOM 853 CA PRO B 12 41.525 39.736 20.806 1.00 38.71 C ATOM 854 C PRO B 12 41.339 39.998 19.314 1.00 38.28 C ATOM 855 O PRO B 12 41.534 39.083 18.491 1.00 37.69 O ATOM 856 CB PRO B 12 43.008 39.685 21.124 1.00 38.85 C ATOM 857 CG PRO B 12 43.178 38.523 22.061 1.00 40.12 C ATOM 858 CD PRO B 12 42.100 37.539 21.722 1.00 39.88 C ATOM 859 N ILE B 13 40.911 41.211 18.973 1.00 36.84 N ATOM 860 CA ILE B 13 40.777 41.590 17.569 1.00 36.23 C ATOM 861 C ILE B 13 42.117 42.168 17.152 1.00 35.38 C ATOM 862 O ILE B 13 42.611 43.107 17.787 1.00 34.86 O ATOM 863 CB ILE B 13 39.670 42.650 17.363 1.00 36.85 C ATOM 864 CG1 ILE B 13 38.298 42.049 17.670 1.00 37.51 C ATOM 865 CG2 ILE B 13 39.682 43.173 15.938 1.00 34.66 C ATOM 866 CD1 ILE B 13 37.128 42.926 17.244 1.00 41.23 C ATOM 867 N ILE B 14 42.710 41.618 16.096 1.00 33.72 N ATOM 868 CA ILE B 14 44.044 42.053 15.724 1.00 33.80 C ATOM 869 C ILE B 14 44.077 42.239 14.240 1.00 34.00 C ATOM 870 O ILE B 14 43.094 41.966 13.562 1.00 32.94 O ATOM 871 CB ILE B 14 45.161 41.041 16.174 1.00 33.44 C ATOM 872 CG1 ILE B 14 44.819 39.627 15.699 1.00 33.37 C ATOM 873 CG2 ILE B 14 45.374 41.118 17.714 1.00 34.54 C ATOM 874 CD1 ILE B 14 45.869 38.595 15.947 1.00 35.23 C ATOM 875 N THR B 15 45.202 42.731 13.736 1.00 34.85 N ATOM 876 CA THR B 15 45.241 43.038 12.309 1.00 36.22 C ATOM 877 C THR B 15 46.471 42.398 11.748 1.00 35.88 C ATOM 878 O THR B 15 47.518 42.397 12.378 1.00 35.95 O ATOM 879 CB THR B 15 45.235 44.581 12.060 1.00 36.65 C ATOM 880 OG1 THR B 15 44.009 45.137 12.518 1.00 38.94 O ATOM 881 CG2 THR B 15 45.338 44.915 10.584 1.00 39.20 C ATOM 882 N THR B 16 46.347 41.783 10.577 1.00 35.20 N ATOM 883 CA THR B 16 47.499 41.240 9.901 1.00 35.59 C ATOM 884 C THR B 16 47.437 41.711 8.473 1.00 34.56 C ATOM 885 O THR B 16 46.362 41.883 7.930 1.00 35.24 O ATOM 886 CB THR B 16 47.480 39.711 9.868 1.00 35.27 C ATOM 887 OG1 THR B 16 47.487 39.229 11.214 1.00 41.99 O ATOM 888 CG2 THR B 16 48.732 39.122 9.173 1.00 34.87 C ATOM 889 N GLN B 17 48.598 41.888 7.883 1.00 33.73 N ATOM 890 CA GLN B 17 48.703 42.238 6.461 1.00 33.83 C ATOM 891 C GLN B 17 49.379 41.128 5.693 1.00 34.46 C ATOM 892 O GLN B 17 50.264 40.424 6.235 1.00 34.43 O ATOM 893 CB GLN B 17 49.491 43.500 6.325 1.00 32.93 C ATOM 894 CG GLN B 17 48.724 44.735 6.810 1.00 31.61 C ATOM 895 CD GLN B 17 49.421 46.017 6.496 1.00 32.47 C ATOM 896 OE1 GLN B 17 50.658 46.122 6.536 1.00 30.51 O ATOM 897 NE2 GLN B 17 48.642 47.023 6.175 1.00 31.37 N ATOM 898 N VAL B 18 48.973 40.946 4.452 1.00 35.04 N ATOM 899 CA VAL B 18 49.587 39.956 3.574 1.00 34.79 C ATOM 900 C VAL B 18 49.731 40.663 2.247 1.00 35.21 C ATOM 901 O VAL B 18 48.991 41.606 1.943 1.00 33.95 O ATOM 902 CB VAL B 18 48.737 38.663 3.430 1.00 36.09 C ATOM 903 CG1 VAL B 18 48.597 37.983 4.774 1.00 37.72 C ATOM 904 CG2 VAL B 18 47.355 38.938 2.855 1.00 35.20 C ATOM 905 N THR B 19 50.673 40.248 1.431 1.00 33.65 N ATOM 906 CA THR B 19 50.733 40.880 0.082 1.00 35.17 C ATOM 907 C THR B 19 50.311 39.876 -0.947 1.00 36.62 C ATOM 908 O THR B 19 50.536 38.694 -0.758 1.00 35.81 O ATOM 909 CB THR B 19 52.132 41.377 -0.256 1.00 35.19 C ATOM 910 OG1 THR B 19 53.031 40.275 -0.371 1.00 38.27 O ATOM 911 CG2 THR B 19 52.605 42.332 0.816 1.00 37.86 C ATOM 912 N ILE B 20 49.727 40.346 -2.046 1.00 34.87 N ATOM 913 CA ILE B 20 49.474 39.514 -3.191 1.00 35.96 C ATOM 914 C ILE B 20 50.142 40.178 -4.408 1.00 35.10 C ATOM 915 O ILE B 20 50.070 41.375 -4.547 1.00 34.29 O ATOM 916 CB ILE B 20 47.957 39.380 -3.434 1.00 36.90 C ATOM 917 CG1 ILE B 20 47.704 38.450 -4.595 1.00 39.23 C ATOM 918 CG2 ILE B 20 47.242 40.737 -3.622 1.00 39.62 C ATOM 919 CD1 ILE B 20 46.281 38.079 -4.698 1.00 42.98 C ATOM 920 N PRO B 21 50.724 39.380 -5.311 1.00 34.70 N ATOM 921 CA PRO B 21 51.189 39.996 -6.560 1.00 34.12 C ATOM 922 C PRO B 21 50.047 40.728 -7.206 1.00 34.14 C ATOM 923 O PRO B 21 48.932 40.224 -7.243 1.00 34.34 O ATOM 924 CB PRO B 21 51.581 38.775 -7.402 1.00 35.70 C ATOM 925 CG PRO B 21 52.083 37.812 -6.377 1.00 33.13 C ATOM 926 CD PRO B 21 51.054 37.952 -5.269 1.00 34.77 C ATOM 927 N LYS B 22 50.296 41.917 -7.748 1.00 34.44 N ATOM 928 CA LYS B 22 49.169 42.695 -8.233 1.00 35.30 C ATOM 929 C LYS B 22 48.486 42.017 -9.400 1.00 34.98 C ATOM 930 O LYS B 22 47.292 42.188 -9.555 1.00 34.74 O ATOM 931 CB LYS B 22 49.544 44.121 -8.631 1.00 35.98 C ATOM 932 CG LYS B 22 50.642 44.272 -9.564 1.00 38.03 C ATOM 933 CD LYS B 22 50.895 45.740 -9.689 1.00 39.29 C ATOM 934 CE LYS B 22 51.928 45.982 -10.711 1.00 40.60 C ATOM 935 NZ LYS B 22 52.320 47.416 -10.650 1.00 39.99 N ATOM 936 N ASP B 23 49.244 41.265 -10.196 1.00 35.32 N ATOM 937 CA ASP B 23 48.655 40.613 -11.357 1.00 38.14 C ATOM 938 C ASP B 23 47.576 39.590 -10.952 1.00 38.12 C ATOM 939 O ASP B 23 46.722 39.224 -11.795 1.00 39.35 O ATOM 940 CB ASP B 23 49.730 39.906 -12.182 1.00 38.77 C ATOM 941 CG ASP B 23 50.551 40.865 -13.051 1.00 43.89 C ATOM 942 OD1 ASP B 23 50.189 42.075 -13.193 1.00 48.32 O ATOM 943 OD2 ASP B 23 51.553 40.370 -13.626 1.00 49.26 O ATOM 944 N LEU B 24 47.612 39.131 -9.701 1.00 37.36 N ATOM 945 CA LEU B 24 46.721 38.053 -9.214 1.00 36.85 C ATOM 946 C LEU B 24 45.556 38.607 -8.413 1.00 37.36 C ATOM 947 O LEU B 24 44.619 37.896 -8.029 1.00 36.48 O ATOM 948 CB LEU B 24 47.486 37.149 -8.252 1.00 37.51 C ATOM 949 CG LEU B 24 48.669 36.381 -8.845 1.00 37.03 C ATOM 950 CD1 LEU B 24 49.142 35.378 -7.797 1.00 35.57 C ATOM 951 CD2 LEU B 24 48.246 35.688 -10.078 1.00 44.19 C ATOM 952 N ALA B 25 45.617 39.898 -8.118 1.00 36.80 N ATOM 953 CA ALA B 25 44.717 40.464 -7.139 1.00 36.18 C ATOM 954 C ALA B 25 43.292 40.438 -7.653 1.00 36.54 C ATOM 955 O ALA B 25 42.317 40.337 -6.884 1.00 35.97 O ATOM 956 CB ALA B 25 45.150 41.911 -6.817 1.00 37.92 C ATOM 957 N GLY B 26 43.154 40.547 -8.969 1.00 34.69 N ATOM 958 CA GLY B 26 41.840 40.510 -9.577 1.00 34.99 C ATOM 959 C GLY B 26 41.083 39.251 -9.201 1.00 34.20 C ATOM 960 O GLY B 26 39.857 39.257 -9.121 1.00 34.92 O ATOM 961 N SER B 27 41.803 38.175 -8.942 1.00 34.27 N ATOM 962 CA SER B 27 41.149 36.894 -8.629 1.00 34.26 C ATOM 963 C SER B 27 40.562 36.901 -7.208 1.00 35.91 C ATOM 964 O SER B 27 39.544 36.245 -6.946 1.00 35.23 O ATOM 965 CB SER B 27 42.144 35.715 -8.797 1.00 32.71 C ATOM 966 OG SER B 27 43.223 35.851 -7.877 1.00 32.62 O ATOM 967 N ILE B 28 41.187 37.668 -6.305 1.00 33.94 N ATOM 968 CA ILE B 28 40.716 37.730 -4.957 1.00 35.60 C ATOM 969 C ILE B 28 39.521 38.710 -4.841 1.00 33.73 C ATOM 970 O ILE B 28 38.675 38.583 -3.961 1.00 34.79 O ATOM 971 CB ILE B 28 41.878 38.071 -3.913 1.00 35.56 C ATOM 972 CG1 ILE B 28 42.124 39.546 -3.821 1.00 40.72 C ATOM 973 CG2 ILE B 28 43.153 37.190 -4.130 1.00 38.23 C ATOM 974 CD1 ILE B 28 42.958 39.985 -2.593 1.00 39.72 C ATOM 975 N ILE B 29 39.499 39.684 -5.715 1.00 34.13 N ATOM 976 CA ILE B 29 38.351 40.612 -5.786 1.00 33.34 C ATOM 977 C ILE B 29 37.169 39.983 -6.506 1.00 34.09 C ATOM 978 O ILE B 29 36.041 39.967 -5.980 1.00 34.36 O ATOM 979 CB ILE B 29 38.761 41.980 -6.409 1.00 33.92 C ATOM 980 CG1 ILE B 29 39.864 42.620 -5.543 1.00 32.48 C ATOM 981 CG2 ILE B 29 37.544 42.897 -6.508 1.00 32.51 C ATOM 982 CD1 ILE B 29 40.547 43.733 -6.222 1.00 38.02 C ATOM 983 N GLY B 30 37.421 39.481 -7.717 1.00 33.70 N ATOM 984 CA GLY B 30 36.413 38.819 -8.545 1.00 33.88 C ATOM 985 C GLY B 30 35.646 39.858 -9.297 1.00 34.93 C ATOM 986 O GLY B 30 35.705 41.028 -8.953 1.00 33.86 O ATOM 987 N LYS B 31 34.922 39.451 -10.326 1.00 35.88 N ATOM 988 CA LYS B 31 34.161 40.433 -11.066 1.00 36.16 C ATOM 989 C LYS B 31 33.154 41.116 -10.150 1.00 36.55 C ATOM 990 O LYS B 31 32.494 40.455 -9.344 1.00 35.73 O ATOM 991 CB LYS B 31 33.499 39.794 -12.289 1.00 38.68 C ATOM 992 CG LYS B 31 34.488 39.538 -13.446 1.00 41.16 C ATOM 993 CD LYS B 31 34.830 40.819 -14.219 1.00 46.44 C ATOM 994 CE LYS B 31 35.610 40.510 -15.502 1.00 46.89 C ATOM 995 NZ LYS B 31 35.469 41.649 -16.492 1.00 48.25 N ATOM 996 N GLY B 32 33.082 42.448 -10.259 1.00 35.91 N ATOM 997 CA GLY B 32 32.224 43.284 -9.411 1.00 35.57 C ATOM 998 C GLY B 32 32.493 43.067 -7.947 1.00 36.19 C ATOM 999 O GLY B 32 31.637 43.362 -7.082 1.00 35.44 O ATOM 1000 N GLY B 33 33.699 42.580 -7.640 1.00 34.41 N ATOM 1001 CA GLY B 33 34.012 42.282 -6.246 1.00 36.11 C ATOM 1002 C GLY B 33 33.246 41.132 -5.616 1.00 35.25 C ATOM 1003 O GLY B 33 33.163 41.048 -4.393 1.00 36.39 O ATOM 1004 N GLN B 34 32.785 40.184 -6.416 1.00 35.93 N ATOM 1005 CA GLN B 34 31.946 39.112 -5.871 1.00 36.94 C ATOM 1006 C GLN B 34 32.706 38.151 -4.953 1.00 36.28 C ATOM 1007 O GLN B 34 32.136 37.652 -3.971 1.00 35.65 O ATOM 1008 CB GLN B 34 31.208 38.347 -6.980 1.00 38.41 C ATOM 1009 CG GLN B 34 32.025 37.589 -7.995 1.00 41.63 C ATOM 1010 CD GLN B 34 31.083 36.806 -8.986 1.00 41.10 C ATOM 1011 OE1 GLN B 34 31.125 35.574 -9.062 1.00 47.63 O ATOM 1012 NE2 GLN B 34 30.223 37.538 -9.700 1.00 46.30 N ATOM 1013 N ARG B 35 33.973 37.890 -5.287 1.00 35.36 N ATOM 1014 CA ARG B 35 34.765 36.961 -4.509 1.00 35.55 C ATOM 1015 C ARG B 35 35.133 37.588 -3.157 1.00 34.60 C ATOM 1016 O ARG B 35 34.965 36.956 -2.101 1.00 35.48 O ATOM 1017 CB ARG B 35 36.040 36.526 -5.261 1.00 34.96 C ATOM 1018 CG ARG B 35 36.897 35.576 -4.504 1.00 34.56 C ATOM 1019 CD ARG B 35 36.126 34.308 -4.097 1.00 34.89 C ATOM 1020 NE ARG B 35 37.009 33.515 -3.241 1.00 41.15 N ATOM 1021 CZ ARG B 35 36.620 32.557 -2.402 1.00 37.89 C ATOM 1022 NH1 ARG B 35 35.338 32.220 -2.303 1.00 36.52 N ATOM 1023 NH2 ARG B 35 37.547 31.949 -1.655 1.00 45.36 N ATOM 1024 N ILE B 36 35.638 38.818 -3.165 1.00 34.18 N ATOM 1025 CA ILE B 36 36.035 39.433 -1.914 1.00 33.82 C ATOM 1026 C ILE B 36 34.804 39.663 -1.037 1.00 34.81 C ATOM 1027 O ILE B 36 34.862 39.564 0.176 1.00 35.95 O ATOM 1028 CB ILE B 36 36.842 40.743 -2.100 1.00 33.93 C ATOM 1029 CG1 ILE B 36 37.374 41.314 -0.765 1.00 31.16 C ATOM 1030 CG2 ILE B 36 36.026 41.868 -2.802 1.00 34.33 C ATOM 1031 CD1 ILE B 36 38.169 40.217 0.115 1.00 36.73 C ATOM 1032 N LYS B 37 33.677 39.928 -1.659 1.00 35.18 N ATOM 1033 CA LYS B 37 32.436 40.041 -0.889 1.00 36.73 C ATOM 1034 C LYS B 37 32.158 38.701 -0.190 1.00 36.47 C ATOM 1035 O LYS B 37 31.855 38.675 0.998 1.00 37.90 O ATOM 1036 CB LYS B 37 31.292 40.438 -1.800 1.00 35.85 C ATOM 1037 CG LYS B 37 29.948 40.698 -1.063 1.00 37.35 C ATOM 1038 CD LYS B 37 28.784 40.754 -2.044 1.00 37.13 C ATOM 1039 CE LYS B 37 27.556 41.447 -1.356 1.00 41.92 C ATOM 1040 NZ LYS B 37 26.250 41.005 -1.920 1.00 41.40 N ATOM 1041 N GLN B 38 32.316 37.583 -0.899 1.00 38.36 N ATOM 1042 CA GLN B 38 32.090 36.278 -0.279 1.00 37.51 C ATOM 1043 C GLN B 38 33.068 36.003 0.854 1.00 37.84 C ATOM 1044 O GLN B 38 32.669 35.444 1.889 1.00 37.51 O ATOM 1045 CB GLN B 38 32.169 35.152 -1.322 1.00 37.99 C ATOM 1046 CG GLN B 38 32.035 33.752 -0.729 1.00 39.14 C ATOM 1047 CD GLN B 38 30.753 33.490 0.055 1.00 41.82 C ATOM 1048 OE1 GLN B 38 29.684 34.030 -0.237 1.00 41.19 O ATOM 1049 NE2 GLN B 38 30.855 32.617 1.029 1.00 41.55 N ATOM 1050 N ILE B 39 34.331 36.370 0.647 1.00 36.97 N ATOM 1051 CA ILE B 39 35.399 36.166 1.639 1.00 36.58 C ATOM 1052 C ILE B 39 35.092 36.975 2.894 1.00 37.17 C ATOM 1053 O ILE B 39 35.226 36.471 4.019 1.00 37.14 O ATOM 1054 CB ILE B 39 36.760 36.554 1.109 1.00 36.34 C ATOM 1055 CG1 ILE B 39 37.185 35.575 -0.004 1.00 37.82 C ATOM 1056 CG2 ILE B 39 37.821 36.498 2.225 1.00 38.11 C ATOM 1057 CD1 ILE B 39 38.327 36.069 -0.823 1.00 38.40 C ATOM 1058 N ARG B 40 34.649 38.217 2.700 1.00 37.73 N ATOM 1059 CA ARG B 40 34.244 39.047 3.848 1.00 37.06 C ATOM 1060 C ARG B 40 33.116 38.448 4.638 1.00 38.80 C ATOM 1061 O ARG B 40 33.157 38.427 5.875 1.00 39.56 O ATOM 1062 CB ARG B 40 33.902 40.473 3.393 1.00 37.82 C ATOM 1063 CG ARG B 40 35.094 41.259 2.868 1.00 34.92 C ATOM 1064 CD ARG B 40 34.638 42.606 2.312 1.00 36.83 C ATOM 1065 NE ARG B 40 35.809 43.462 2.137 1.00 31.91 N ATOM 1066 CZ ARG B 40 36.112 44.088 1.007 1.00 36.41 C ATOM 1067 NH1 ARG B 40 35.342 43.949 -0.079 1.00 34.31 N ATOM 1068 NH2 ARG B 40 37.190 44.855 0.966 1.00 34.95 N ATOM 1069 N HIS B 41 32.087 37.975 3.940 1.00 38.49 N ATOM 1070 CA HIS B 41 30.998 37.263 4.577 1.00 39.31 C ATOM 1071 C HIS B 41 31.474 35.985 5.286 1.00 38.64 C ATOM 1072 O HIS B 41 31.179 35.761 6.462 1.00 38.48 O ATOM 1073 CB HIS B 41 29.934 36.917 3.537 1.00 38.54 C ATOM 1074 CG HIS B 41 28.774 36.157 4.095 1.00 42.14 C ATOM 1075 ND1 HIS B 41 28.639 34.792 3.960 1.00 42.22 N ATOM 1076 CD2 HIS B 41 27.702 36.575 4.807 1.00 41.69 C ATOM 1077 CE1 HIS B 41 27.527 34.406 4.558 1.00 45.06 C ATOM 1078 NE2 HIS B 41 26.941 35.466 5.081 1.00 44.60 N ATOM 1079 N GLU B 42 32.188 35.144 4.555 1.00 38.69 N ATOM 1080 CA GLU B 42 32.539 33.830 5.060 1.00 38.49 C ATOM 1081 C GLU B 42 33.498 33.912 6.245 1.00 37.64 C ATOM 1082 O GLU B 42 33.383 33.132 7.179 1.00 38.68 O ATOM 1083 CB GLU B 42 33.160 32.974 3.974 1.00 37.89 C ATOM 1084 CG GLU B 42 33.211 31.520 4.360 1.00 38.33 C ATOM 1085 CD GLU B 42 33.398 30.629 3.183 1.00 41.15 C ATOM 1086 OE1 GLU B 42 33.071 31.080 2.046 1.00 38.66 O ATOM 1087 OE2 GLU B 42 33.835 29.467 3.399 1.00 39.85 O ATOM 1088 N SER B 43 34.421 34.860 6.205 1.00 37.37 N ATOM 1089 CA SER B 43 35.397 34.952 7.253 1.00 36.86 C ATOM 1090 C SER B 43 34.913 35.722 8.464 1.00 36.46 C ATOM 1091 O SER B 43 35.308 35.382 9.586 1.00 36.62 O ATOM 1092 CB SER B 43 36.725 35.518 6.760 1.00 37.56 C ATOM 1093 OG SER B 43 36.620 36.884 6.365 1.00 34.69 O ATOM 1094 N GLY B 44 34.084 36.742 8.255 1.00 35.18 N ATOM 1095 CA GLY B 44 33.808 37.688 9.341 1.00 35.89 C ATOM 1096 C GLY B 44 34.892 38.738 9.544 1.00 34.81 C ATOM 1097 O GLY B 44 34.707 39.694 10.289 1.00 35.28 O ATOM 1098 N ALA B 45 36.010 38.614 8.830 1.00 35.94 N ATOM 1099 CA ALA B 45 37.077 39.577 8.951 1.00 33.96 C ATOM 1100 C ALA B 45 36.824 40.868 8.197 1.00 34.35 C ATOM 1101 O ALA B 45 36.135 40.903 7.152 1.00 34.38 O ATOM 1102 CB ALA B 45 38.390 38.955 8.490 1.00 34.47 C ATOM 1103 N SER B 46 37.363 41.950 8.744 1.00 33.62 N ATOM 1104 CA SER B 46 37.389 43.177 7.989 1.00 35.84 C ATOM 1105 C SER B 46 38.617 43.061 7.075 1.00 35.40 C ATOM 1106 O SER B 46 39.692 42.759 7.534 1.00 36.87 O ATOM 1107 CB SER B 46 37.446 44.370 8.943 1.00 36.90 C ATOM 1108 OG SER B 46 37.385 45.564 8.195 1.00 41.71 O ATOM 1109 N ILE B 47 38.425 43.202 5.771 1.00 35.42 N ATOM 1110 CA ILE B 47 39.504 43.073 4.804 1.00 35.39 C ATOM 1111 C ILE B 47 39.556 44.287 3.900 1.00 36.91 C ATOM 1112 O ILE B 47 38.543 44.709 3.341 1.00 36.30 O ATOM 1113 CB ILE B 47 39.251 41.848 3.929 1.00 35.28 C ATOM 1114 CG1 ILE B 47 38.932 40.607 4.807 1.00 31.99 C ATOM 1115 CG2 ILE B 47 40.399 41.623 2.903 1.00 33.60 C ATOM 1116 CD1 ILE B 47 38.420 39.415 3.968 1.00 35.69 C ATOM 1117 N LYS B 48 40.759 44.781 3.701 1.00 36.81 N ATOM 1118 CA LYS B 48 40.998 45.964 2.882 1.00 39.31 C ATOM 1119 C LYS B 48 42.074 45.561 1.931 1.00 38.02 C ATOM 1120 O LYS B 48 43.068 45.024 2.343 1.00 39.43 O ATOM 1121 CB LYS B 48 41.498 47.112 3.762 1.00 39.66 C ATOM 1122 CG LYS B 48 42.123 48.319 3.019 1.00 44.68 C ATOM 1123 CD LYS B 48 42.077 49.557 3.897 1.00 50.36 C ATOM 1124 CE LYS B 48 43.312 50.451 3.733 1.00 53.43 C ATOM 1125 NZ LYS B 48 44.474 50.066 4.629 1.00 56.00 N ATOM 1126 N ILE B 49 41.797 45.671 0.647 1.00 37.08 N ATOM 1127 CA ILE B 49 42.793 45.382 -0.358 1.00 35.38 C ATOM 1128 C ILE B 49 43.216 46.759 -0.881 1.00 36.15 C ATOM 1129 O ILE B 49 42.432 47.475 -1.530 1.00 35.14 O ATOM 1130 CB ILE B 49 42.234 44.576 -1.549 1.00 35.81 C ATOM 1131 CG1 ILE B 49 41.524 43.309 -1.062 1.00 37.88 C ATOM 1132 CG2 ILE B 49 43.381 44.244 -2.465 1.00 34.65 C ATOM 1133 CD1 ILE B 49 40.467 42.779 -2.083 1.00 42.27 C ATOM 1134 N ASP B 50 44.422 47.184 -0.559 1.00 36.34 N ATOM 1135 CA ASP B 50 44.873 48.487 -1.094 1.00 37.32 C ATOM 1136 C ASP B 50 44.892 48.580 -2.608 1.00 37.57 C ATOM 1137 O ASP B 50 45.057 47.603 -3.301 1.00 37.60 O ATOM 1138 CB ASP B 50 46.244 48.844 -0.574 1.00 37.13 C ATOM 1139 CG ASP B 50 46.231 49.113 0.900 1.00 39.74 C ATOM 1140 OD1 ASP B 50 45.124 49.219 1.501 1.00 45.70 O ATOM 1141 OD2 ASP B 50 47.320 49.206 1.476 1.00 45.45 O ATOM 1142 N GLU B 51 44.767 49.797 -3.112 1.00 39.64 N ATOM 1143 CA GLU B 51 44.880 50.037 -4.531 1.00 41.89 C ATOM 1144 C GLU B 51 46.298 49.751 -5.004 1.00 42.75 C ATOM 1145 O GLU B 51 47.233 49.761 -4.195 1.00 42.82 O ATOM 1146 CB GLU B 51 44.501 51.481 -4.809 1.00 42.19 C ATOM 1147 CG GLU B 51 43.002 51.682 -4.663 1.00 45.80 C ATOM 1148 CD GLU B 51 42.230 50.879 -5.701 1.00 48.72 C ATOM 1149 OE1 GLU B 51 42.198 51.307 -6.876 1.00 50.24 O ATOM 1150 OE2 GLU B 51 41.668 49.822 -5.363 1.00 52.03 O ATOM 1151 N PRO B 52 46.464 49.433 -6.294 1.00 44.25 N ATOM 1152 CA PRO B 52 47.856 49.312 -6.690 1.00 45.40 C ATOM 1153 C PRO B 52 48.584 50.656 -6.449 1.00 45.68 C ATOM 1154 O PRO B 52 48.051 51.710 -6.803 1.00 47.16 O ATOM 1155 CB PRO B 52 47.793 48.913 -8.170 1.00 45.70 C ATOM 1156 CG PRO B 52 46.355 49.073 -8.594 1.00 45.39 C ATOM 1157 CD PRO B 52 45.507 49.141 -7.378 1.00 43.95 C ATOM 1158 N LEU B 53 49.733 50.612 -5.765 1.00 45.09 N ATOM 1159 CA LEU B 53 50.666 51.747 -5.700 1.00 44.28 C ATOM 1160 C LEU B 53 51.654 51.706 -6.872 1.00 42.80 C ATOM 1161 O LEU B 53 51.977 50.644 -7.411 1.00 43.42 O ATOM 1162 CB LEU B 53 51.406 51.786 -4.358 1.00 44.14 C ATOM 1163 CG LEU B 53 50.637 52.330 -3.133 1.00 46.46 C ATOM 1164 CD1 LEU B 53 49.158 51.859 -3.074 1.00 48.76 C ATOM 1165 CD2 LEU B 53 51.360 52.018 -1.794 1.00 46.29 C ATOM 1166 N GLU B 54 52.075 52.890 -7.309 1.00 41.44 N ATOM 1167 CA GLU B 54 53.088 53.007 -8.358 1.00 39.47 C ATOM 1168 C GLU B 54 54.435 52.481 -7.831 1.00 37.24 C ATOM 1169 O GLU B 54 54.898 52.903 -6.750 1.00 36.44 O ATOM 1170 CB GLU B 54 53.183 54.450 -8.833 1.00 39.25 C ATOM 1171 CG GLU B 54 54.461 54.795 -9.593 1.00 40.76 C ATOM 1172 CD GLU B 54 54.416 56.153 -10.271 1.00 41.02 C ATOM 1173 OE1 GLU B 54 54.994 57.130 -9.734 1.00 43.56 O ATOM 1174 OE2 GLU B 54 53.815 56.234 -11.361 1.00 42.64 O ATOM 1175 N GLY B 55 55.020 51.537 -8.577 1.00 33.80 N ATOM 1176 CA GLY B 55 56.353 51.050 -8.283 1.00 30.72 C ATOM 1177 C GLY B 55 56.294 49.790 -7.439 1.00 29.20 C ATOM 1178 O GLY B 55 57.310 49.210 -7.114 1.00 27.78 O ATOM 1179 N SER B 56 55.099 49.347 -7.083 1.00 28.92 N ATOM 1180 CA SER B 56 54.983 48.096 -6.367 1.00 29.23 C ATOM 1181 C SER B 56 54.434 46.980 -7.270 1.00 29.87 C ATOM 1182 O SER B 56 53.474 47.197 -8.019 1.00 28.71 O ATOM 1183 CB SER B 56 54.044 48.242 -5.189 1.00 29.08 C ATOM 1184 OG SER B 56 53.990 47.035 -4.423 1.00 29.67 O ATOM 1185 N GLU B 57 54.996 45.790 -7.125 1.00 29.07 N ATOM 1186 CA GLU B 57 54.483 44.616 -7.819 1.00 30.41 C ATOM 1187 C GLU B 57 53.385 43.915 -7.026 1.00 30.22 C ATOM 1188 O GLU B 57 52.823 42.915 -7.502 1.00 31.00 O ATOM 1189 CB GLU B 57 55.608 43.597 -8.065 1.00 32.16 C ATOM 1190 CG GLU B 57 56.709 44.100 -8.983 1.00 36.75 C ATOM 1191 CD GLU B 57 56.148 44.559 -10.320 1.00 44.89 C ATOM 1192 OE1 GLU B 57 55.261 43.851 -10.863 1.00 47.58 O ATOM 1193 OE2 GLU B 57 56.579 45.636 -10.820 1.00 48.96 O ATOM 1194 N ASP B 58 53.092 44.426 -5.830 1.00 28.44 N ATOM 1195 CA ASP B 58 52.149 43.779 -4.950 1.00 30.53 C ATOM 1196 C ASP B 58 51.029 44.655 -4.504 1.00 29.79 C ATOM 1197 O ASP B 58 51.125 45.871 -4.539 1.00 30.88 O ATOM 1198 CB ASP B 58 52.911 43.242 -3.739 1.00 31.19 C ATOM 1199 CG ASP B 58 54.096 42.392 -4.167 1.00 34.16 C ATOM 1200 OD1 ASP B 58 53.869 41.264 -4.650 1.00 39.02 O ATOM 1201 OD2 ASP B 58 55.227 42.883 -4.049 1.00 38.29 O ATOM 1202 N ARG B 59 49.985 44.034 -3.998 1.00 30.22 N ATOM 1203 CA ARG B 59 48.977 44.809 -3.289 1.00 31.60 C ATOM 1204 C ARG B 59 48.873 44.300 -1.862 1.00 32.44 C ATOM 1205 O ARG B 59 49.009 43.112 -1.600 1.00 33.21 O ATOM 1206 CB ARG B 59 47.657 44.672 -4.000 1.00 31.22 C ATOM 1207 CG ARG B 59 47.749 45.558 -5.293 1.00 35.07 C ATOM 1208 CD ARG B 59 46.625 45.357 -6.157 1.00 39.32 C ATOM 1209 NE ARG B 59 45.471 46.016 -5.570 1.00 39.70 N ATOM 1210 CZ ARG B 59 44.294 45.972 -6.149 1.00 36.08 C ATOM 1211 NH1 ARG B 59 44.195 45.339 -7.300 1.00 34.93 N ATOM 1212 NH2 ARG B 59 43.263 46.589 -5.617 1.00 32.98 N ATOM 1213 N ILE B 60 48.662 45.236 -0.953 1.00 31.91 N ATOM 1214 CA ILE B 60 48.644 44.858 0.435 1.00 33.29 C ATOM 1215 C ILE B 60 47.227 44.597 0.823 1.00 33.41 C ATOM 1216 O ILE B 60 46.352 45.380 0.518 1.00 34.67 O ATOM 1217 CB ILE B 60 49.246 46.004 1.277 1.00 33.39 C ATOM 1218 CG1 ILE B 60 50.716 46.172 0.874 1.00 35.30 C ATOM 1219 CG2 ILE B 60 49.036 45.679 2.814 1.00 34.33 C ATOM 1220 CD1 ILE B 60 51.368 47.427 1.371 1.00 43.07 C ATOM 1221 N ILE B 61 47.009 43.512 1.544 1.00 32.69 N ATOM 1222 CA ILE B 61 45.695 43.207 2.060 1.00 33.42 C ATOM 1223 C ILE B 61 45.808 43.293 3.555 1.00 33.24 C ATOM 1224 O ILE B 61 46.733 42.731 4.118 1.00 33.26 O ATOM 1225 CB ILE B 61 45.285 41.824 1.705 1.00 31.59 C ATOM 1226 CG1 ILE B 61 45.320 41.699 0.157 1.00 35.02 C ATOM 1227 CG2 ILE B 61 43.880 41.568 2.214 1.00 35.42 C ATOM 1228 CD1 ILE B 61 45.383 40.212 -0.267 1.00 37.50 C ATOM 1229 N THR B 62 44.890 44.018 4.167 1.00 33.22 N ATOM 1230 CA THR B 62 44.897 44.117 5.616 1.00 34.12 C ATOM 1231 C THR B 62 43.670 43.424 6.110 1.00 33.51 C ATOM 1232 O THR B 62 42.580 43.681 5.637 1.00 35.65 O ATOM 1233 CB THR B 62 44.799 45.602 6.043 1.00 34.90 C ATOM 1234 OG1 THR B 62 45.850 46.319 5.428 1.00 34.77 O ATOM 1235 CG2 THR B 62 44.935 45.740 7.555 1.00 35.07 C ATOM 1236 N ILE B 63 43.835 42.572 7.109 1.00 32.78 N ATOM 1237 CA ILE B 63 42.763 41.759 7.568 1.00 32.94 C ATOM 1238 C ILE B 63 42.662 41.978 9.060 1.00 32.71 C ATOM 1239 O ILE B 63 43.624 41.770 9.757 1.00 32.14 O ATOM 1240 CB ILE B 63 43.113 40.273 7.344 1.00 32.92 C ATOM 1241 CG1 ILE B 63 43.572 40.081 5.880 1.00 33.02 C ATOM 1242 CG2 ILE B 63 41.881 39.351 7.719 1.00 31.31 C ATOM 1243 CD1 ILE B 63 44.145 38.686 5.620 1.00 32.71 C ATOM 1244 N THR B 64 41.466 42.266 9.523 1.00 32.87 N ATOM 1245 CA THR B 64 41.275 42.566 10.919 1.00 33.08 C ATOM 1246 C THR B 64 40.187 41.679 11.462 1.00 32.84 C ATOM 1247 O THR B 64 39.126 41.542 10.842 1.00 33.90 O ATOM 1248 CB THR B 64 40.876 44.040 11.100 1.00 33.05 C ATOM 1249 OG1 THR B 64 41.937 44.875 10.613 1.00 36.25 O ATOM 1250 CG2 THR B 64 40.726 44.381 12.562 1.00 30.53 C ATOM 1251 N GLY B 65 40.428 41.136 12.642 1.00 31.35 N ATOM 1252 CA GLY B 65 39.518 40.253 13.278 1.00 31.53 C ATOM 1253 C GLY B 65 40.216 39.441 14.345 1.00 32.66 C ATOM 1254 O GLY B 65 41.338 39.743 14.765 1.00 31.62 O ATOM 1255 N THR B 66 39.539 38.404 14.805 1.00 33.05 N ATOM 1256 CA THR B 66 40.165 37.485 15.748 1.00 33.59 C ATOM 1257 C THR B 66 41.194 36.686 14.962 1.00 34.12 C ATOM 1258 O THR B 66 41.186 36.737 13.721 1.00 33.46 O ATOM 1259 CB THR B 66 39.149 36.534 16.392 1.00 33.24 C ATOM 1260 OG1 THR B 66 38.582 35.687 15.387 1.00 33.59 O ATOM 1261 CG2 THR B 66 38.056 37.307 17.104 1.00 33.95 C ATOM 1262 N GLN B 67 42.084 35.976 15.663 1.00 34.32 N ATOM 1263 CA GLN B 67 43.123 35.189 14.980 1.00 35.73 C ATOM 1264 C GLN B 67 42.449 34.226 13.998 1.00 35.05 C ATOM 1265 O GLN B 67 42.885 34.070 12.843 1.00 34.90 O ATOM 1266 CB GLN B 67 43.941 34.368 16.006 1.00 35.75 C ATOM 1267 CG GLN B 67 45.013 33.494 15.327 1.00 36.17 C ATOM 1268 CD GLN B 67 45.814 32.602 16.307 1.00 38.16 C ATOM 1269 OE1 GLN B 67 45.371 32.302 17.433 1.00 41.47 O ATOM 1270 NE2 GLN B 67 46.993 32.171 15.868 1.00 40.49 N ATOM 1271 N ASP B 68 41.380 33.589 14.469 1.00 34.87 N ATOM 1272 CA ASP B 68 40.654 32.621 13.664 1.00 35.65 C ATOM 1273 C ASP B 68 39.995 33.281 12.473 1.00 34.77 C ATOM 1274 O ASP B 68 40.035 32.741 11.380 1.00 33.62 O ATOM 1275 CB ASP B 68 39.610 31.887 14.500 1.00 36.24 C ATOM 1276 CG ASP B 68 40.235 30.948 15.538 1.00 40.73 C ATOM 1277 OD1 ASP B 68 41.342 30.390 15.290 1.00 45.69 O ATOM 1278 OD2 ASP B 68 39.621 30.791 16.617 1.00 44.06 O ATOM 1279 N GLN B 69 39.377 34.441 12.669 1.00 32.83 N ATOM 1280 CA GLN B 69 38.809 35.149 11.520 1.00 33.20 C ATOM 1281 C GLN B 69 39.872 35.536 10.519 1.00 32.94 C ATOM 1282 O GLN B 69 39.692 35.386 9.318 1.00 32.68 O ATOM 1283 CB GLN B 69 38.028 36.393 11.959 1.00 32.57 C ATOM 1284 CG GLN B 69 36.748 36.081 12.634 1.00 33.84 C ATOM 1285 CD GLN B 69 36.122 37.328 13.181 1.00 37.89 C ATOM 1286 OE1 GLN B 69 36.831 38.275 13.540 1.00 32.51 O ATOM 1287 NE2 GLN B 69 34.792 37.329 13.311 1.00 37.50 N ATOM 1288 N ILE B 70 41.006 36.025 10.991 1.00 32.55 N ATOM 1289 CA ILE B 70 42.069 36.432 10.072 1.00 32.45 C ATOM 1290 C ILE B 70 42.630 35.225 9.326 1.00 31.98 C ATOM 1291 O ILE B 70 42.834 35.285 8.107 1.00 31.29 O ATOM 1292 CB ILE B 70 43.212 37.095 10.828 1.00 32.52 C ATOM 1293 CG1 ILE B 70 42.777 38.470 11.298 1.00 33.38 C ATOM 1294 CG2 ILE B 70 44.489 37.205 9.935 1.00 35.50 C ATOM 1295 CD1 ILE B 70 43.849 39.098 12.223 1.00 36.02 C ATOM 1296 N GLN B 71 42.809 34.118 10.028 1.00 32.92 N ATOM 1297 CA GLN B 71 43.396 32.934 9.413 1.00 33.42 C ATOM 1298 C GLN B 71 42.496 32.404 8.316 1.00 34.07 C ATOM 1299 O GLN B 71 42.981 32.018 7.232 1.00 33.68 O ATOM 1300 CB GLN B 71 43.611 31.854 10.426 1.00 33.97 C ATOM 1301 CG GLN B 71 44.780 32.100 11.351 1.00 39.30 C ATOM 1302 CD GLN B 71 44.874 31.035 12.434 1.00 43.07 C ATOM 1303 OE1 GLN B 71 43.916 30.291 12.686 1.00 47.34 O ATOM 1304 NE2 GLN B 71 46.018 30.971 13.099 1.00 46.99 N ATOM 1305 N ASN B 72 41.206 32.354 8.625 1.00 33.54 N ATOM 1306 CA ASN B 72 40.197 31.909 7.656 1.00 33.76 C ATOM 1307 C ASN B 72 40.219 32.845 6.452 1.00 34.03 C ATOM 1308 O ASN B 72 40.276 32.382 5.323 1.00 34.78 O ATOM 1309 CB ASN B 72 38.812 31.876 8.292 1.00 34.55 C ATOM 1310 CG ASN B 72 37.700 31.451 7.287 1.00 37.96 C ATOM 1311 OD1 ASN B 72 36.613 32.049 7.266 1.00 39.86 O ATOM 1312 ND2 ASN B 72 37.989 30.444 6.447 1.00 35.19 N ATOM 1313 N ALA B 73 40.172 34.147 6.687 1.00 34.29 N ATOM 1314 CA ALA B 73 40.270 35.114 5.608 1.00 34.51 C ATOM 1315 C ALA B 73 41.510 34.921 4.808 1.00 34.33 C ATOM 1316 O ALA B 73 41.448 34.960 3.568 1.00 34.99 O ATOM 1317 CB ALA B 73 40.177 36.586 6.136 1.00 34.44 C ATOM 1318 N GLN B 74 42.638 34.700 5.482 1.00 35.04 N ATOM 1319 CA GLN B 74 43.926 34.605 4.777 1.00 37.34 C ATOM 1320 C GLN B 74 43.860 33.347 3.892 1.00 35.91 C ATOM 1321 O GLN B 74 44.280 33.328 2.737 1.00 35.07 O ATOM 1322 CB GLN B 74 45.040 34.389 5.768 1.00 38.87 C ATOM 1323 CG GLN B 74 45.631 35.603 6.365 1.00 45.01 C ATOM 1324 CD GLN B 74 46.843 35.234 7.159 1.00 49.90 C ATOM 1325 OE1 GLN B 74 47.962 35.336 6.658 1.00 53.27 O ATOM 1326 NE2 GLN B 74 46.630 34.710 8.386 1.00 52.11 N ATOM 1327 N TYR B 75 43.221 32.327 4.418 1.00 35.00 N ATOM 1328 CA TYR B 75 43.111 31.098 3.636 1.00 33.91 C ATOM 1329 C TYR B 75 42.258 31.333 2.396 1.00 33.96 C ATOM 1330 O TYR B 75 42.599 30.896 1.303 1.00 35.61 O ATOM 1331 CB TYR B 75 42.524 29.935 4.483 1.00 34.05 C ATOM 1332 CG TYR B 75 42.078 28.822 3.560 1.00 34.58 C ATOM 1333 CD1 TYR B 75 43.017 27.968 3.003 1.00 34.43 C ATOM 1334 CD2 TYR B 75 40.731 28.704 3.172 1.00 35.81 C ATOM 1335 CE1 TYR B 75 42.630 26.980 2.108 1.00 37.99 C ATOM 1336 CE2 TYR B 75 40.333 27.737 2.302 1.00 33.64 C ATOM 1337 CZ TYR B 75 41.301 26.881 1.775 1.00 36.35 C ATOM 1338 OH TYR B 75 40.982 25.913 0.894 1.00 37.65 O ATOM 1339 N LEU B 76 41.102 31.949 2.582 1.00 33.15 N ATOM 1340 CA LEU B 76 40.155 32.131 1.490 1.00 33.59 C ATOM 1341 C LEU B 76 40.765 33.040 0.464 1.00 35.35 C ATOM 1342 O LEU B 76 40.557 32.912 -0.732 1.00 34.30 O ATOM 1343 CB LEU B 76 38.854 32.706 2.024 1.00 32.73 C ATOM 1344 CG LEU B 76 38.044 31.771 2.944 1.00 34.42 C ATOM 1345 CD1 LEU B 76 36.924 32.506 3.670 1.00 37.44 C ATOM 1346 CD2 LEU B 76 37.518 30.500 2.174 1.00 34.82 C ATOM 1347 N LEU B 77 41.534 34.012 0.935 1.00 33.96 N ATOM 1348 CA LEU B 77 42.098 34.954 0.012 1.00 36.30 C ATOM 1349 C LEU B 77 43.075 34.283 -0.892 1.00 37.04 C ATOM 1350 O LEU B 77 43.009 34.430 -2.125 1.00 39.05 O ATOM 1351 CB LEU B 77 42.752 36.111 0.802 1.00 35.61 C ATOM 1352 CG LEU B 77 41.818 37.185 1.321 1.00 38.79 C ATOM 1353 CD1 LEU B 77 42.580 37.969 2.428 1.00 36.51 C ATOM 1354 CD2 LEU B 77 41.230 38.164 0.256 1.00 38.68 C ATOM 1355 N GLN B 78 43.964 33.491 -0.342 1.00 37.38 N ATOM 1356 CA GLN B 78 44.951 32.928 -1.184 1.00 37.30 C ATOM 1357 C GLN B 78 44.359 31.822 -2.037 1.00 35.89 C ATOM 1358 O GLN B 78 44.784 31.614 -3.140 1.00 36.73 O ATOM 1359 CB GLN B 78 46.119 32.416 -0.394 1.00 38.17 C ATOM 1360 CG GLN B 78 45.774 31.396 0.601 1.00 40.32 C ATOM 1361 CD GLN B 78 45.758 30.047 -0.025 1.00 44.30 C ATOM 1362 OE1 GLN B 78 46.485 29.797 -1.021 1.00 45.65 O ATOM 1363 NE2 GLN B 78 44.957 29.133 0.546 1.00 42.65 N ATOM 1364 N ASN B 79 43.393 31.119 -1.495 1.00 34.06 N ATOM 1365 CA ASN B 79 42.753 30.052 -2.252 1.00 33.70 C ATOM 1366 C ASN B 79 42.006 30.616 -3.449 1.00 33.21 C ATOM 1367 O ASN B 79 41.721 29.948 -4.418 1.00 31.88 O ATOM 1368 CB ASN B 79 41.788 29.404 -1.288 1.00 34.22 C ATOM 1369 CG ASN B 79 41.004 28.297 -1.919 1.00 34.33 C ATOM 1370 OD1 ASN B 79 39.822 28.365 -1.944 1.00 34.10 O ATOM 1371 ND2 ASN B 79 41.669 27.298 -2.445 1.00 31.77 N ATOM 1372 N SER B 80 41.642 31.874 -3.366 1.00 34.34 N ATOM 1373 CA SER B 80 40.936 32.543 -4.449 1.00 34.41 C ATOM 1374 C SER B 80 41.730 32.538 -5.730 1.00 35.00 C ATOM 1375 O SER B 80 41.172 32.502 -6.834 1.00 34.49 O ATOM 1376 CB SER B 80 40.697 33.997 -4.050 1.00 35.83 C ATOM 1377 OG SER B 80 39.733 34.016 -3.089 1.00 38.87 O ATOM 1378 N VAL B 81 43.058 32.528 -5.583 1.00 33.09 N ATOM 1379 CA VAL B 81 43.959 32.607 -6.701 1.00 34.15 C ATOM 1380 C VAL B 81 43.853 31.358 -7.576 1.00 32.26 C ATOM 1381 O VAL B 81 44.266 31.324 -8.740 1.00 31.95 O ATOM 1382 CB VAL B 81 45.420 32.824 -6.162 1.00 35.11 C ATOM 1383 CG1 VAL B 81 46.402 32.899 -7.324 1.00 40.04 C ATOM 1384 CG2 VAL B 81 45.448 34.134 -5.372 1.00 37.93 C ATOM 1385 N LYS B 82 43.310 30.293 -7.004 1.00 30.39 N ATOM 1386 CA LYS B 82 43.005 29.140 -7.806 1.00 30.09 C ATOM 1387 C LYS B 82 42.141 29.494 -9.013 1.00 29.29 C ATOM 1388 O LYS B 82 42.155 28.817 -10.005 1.00 30.50 O ATOM 1389 CB LYS B 82 42.278 28.117 -6.902 1.00 29.80 C ATOM 1390 CG LYS B 82 43.149 27.343 -6.007 1.00 37.36 C ATOM 1391 CD LYS B 82 42.726 25.882 -6.196 1.00 42.17 C ATOM 1392 CE LYS B 82 42.534 25.179 -4.884 1.00 46.07 C ATOM 1393 NZ LYS B 82 41.843 23.879 -5.095 1.00 38.06 N ATOM 1394 N GLN B 83 41.362 30.557 -8.898 1.00 29.27 N ATOM 1395 CA GLN B 83 40.428 30.960 -9.918 1.00 31.28 C ATOM 1396 C GLN B 83 41.014 32.041 -10.807 1.00 31.16 C ATOM 1397 O GLN B 83 40.325 32.657 -11.608 1.00 32.95 O ATOM 1398 CB GLN B 83 39.099 31.438 -9.315 1.00 30.90 C ATOM 1399 CG GLN B 83 37.946 30.631 -9.737 1.00 34.86 C ATOM 1400 CD GLN B 83 36.660 31.041 -9.040 1.00 33.63 C ATOM 1401 OE1 GLN B 83 36.693 31.413 -7.917 1.00 36.23 O ATOM 1402 NE2 GLN B 83 35.572 31.049 -9.740 1.00 39.17 N ATOM 1403 N TYR B 84 42.305 32.277 -10.658 1.00 31.91 N ATOM 1404 CA TYR B 84 42.990 33.309 -11.455 1.00 32.01 C ATOM 1405 C TYR B 84 42.859 32.934 -12.867 1.00 30.47 C ATOM 1406 O TYR B 84 43.001 31.735 -13.262 1.00 29.87 O ATOM 1407 CB TYR B 84 44.479 33.403 -11.041 1.00 32.62 C ATOM 1408 CG TYR B 84 45.303 34.350 -11.887 1.00 33.32 C ATOM 1409 CD1 TYR B 84 44.937 35.687 -12.050 1.00 31.76 C ATOM 1410 CD2 TYR B 84 46.478 33.915 -12.446 1.00 32.42 C ATOM 1411 CE1 TYR B 84 45.766 36.560 -12.821 1.00 32.89 C ATOM 1412 CE2 TYR B 84 47.294 34.729 -13.208 1.00 29.94 C ATOM 1413 CZ TYR B 84 46.943 36.070 -13.374 1.00 37.20 C ATOM 1414 OH TYR B 84 47.752 36.869 -14.156 1.00 37.78 O ATOM 1415 N SER B 85 42.583 33.940 -13.675 1.00 30.99 N ATOM 1416 CA SER B 85 42.263 33.683 -15.067 1.00 32.86 C ATOM 1417 C SER B 85 43.515 33.627 -15.913 1.00 33.59 C ATOM 1418 O SER B 85 43.429 33.301 -17.087 1.00 35.31 O ATOM 1419 CB SER B 85 41.344 34.794 -15.596 1.00 33.45 C ATOM 1420 OG SER B 85 41.970 36.049 -15.471 1.00 33.31 O ATOM 1421 N GLY B 86 44.641 34.083 -15.370 1.00 33.52 N ATOM 1422 CA GLY B 86 45.864 34.132 -16.170 1.00 34.77 C ATOM 1423 C GLY B 86 46.804 32.972 -15.910 1.00 34.64 C ATOM 1424 O GLY B 86 46.425 31.959 -15.321 1.00 35.46 O ATOM 1425 N LYS B 87 48.036 33.143 -16.346 1.00 34.61 N ATOM 1426 CA LYS B 87 49.036 32.112 -16.204 1.00 36.68 C ATOM 1427 C LYS B 87 49.780 32.341 -14.903 1.00 37.47 C ATOM 1428 O LYS B 87 50.017 33.489 -14.482 1.00 37.34 O ATOM 1429 CB LYS B 87 49.948 32.093 -17.431 1.00 36.47 C ATOM 1430 CG LYS B 87 49.208 31.506 -18.673 1.00 39.31 C ATOM 1431 CD LYS B 87 50.155 30.782 -19.594 1.00 41.11 C ATOM 1432 CE LYS B 87 49.637 30.762 -21.036 1.00 40.93 C ATOM 1433 NZ LYS B 87 50.752 30.309 -21.964 1.00 43.96 N ATOM 1434 N PHE B 88 50.098 31.253 -14.209 1.00 38.63 N ATOM 1435 CA PHE B 88 50.698 31.398 -12.885 1.00 39.90 C ATOM 1436 C PHE B 88 52.195 31.539 -13.071 1.00 40.33 C ATOM 1437 O PHE B 88 52.892 32.014 -12.198 1.00 41.17 O ATOM 1438 CB PHE B 88 50.374 30.200 -11.998 1.00 40.84 C ATOM 1439 CG PHE B 88 48.910 30.033 -11.728 1.00 43.05 C ATOM 1440 CD1 PHE B 88 48.326 30.664 -10.661 1.00 46.65 C ATOM 1441 CD2 PHE B 88 48.118 29.250 -12.562 1.00 46.63 C ATOM 1442 CE1 PHE B 88 46.950 30.520 -10.407 1.00 46.38 C ATOM 1443 CE2 PHE B 88 46.736 29.101 -12.312 1.00 48.80 C ATOM 1444 CZ PHE B 88 46.170 29.728 -11.242 1.00 43.76 C ATOM 1445 N PHE B 89 52.662 31.115 -14.232 1.00 39.52 N ATOM 1446 CA PHE B 89 54.014 31.326 -14.672 1.00 40.09 C ATOM 1447 C PHE B 89 53.988 31.241 -16.207 1.00 40.41 C ATOM 1448 O PHE B 89 54.996 31.464 -16.932 1.00 42.71 O ATOM 1449 CB PHE B 89 54.928 30.265 -14.037 1.00 39.61 C ATOM 1450 CG PHE B 89 54.554 28.846 -14.409 1.00 40.11 C ATOM 1451 CD1 PHE B 89 55.220 28.193 -15.426 1.00 39.52 C ATOM 1452 CD2 PHE B 89 53.516 28.180 -13.747 1.00 38.46 C ATOM 1453 CE1 PHE B 89 54.877 26.871 -15.787 1.00 40.46 C ATOM 1454 CE2 PHE B 89 53.163 26.864 -14.115 1.00 41.06 C ATOM 1455 CZ PHE B 89 53.841 26.221 -15.118 1.00 37.12 C ATOM 1456 OXT PHE B 89 52.942 30.943 -16.818 1.00 40.07 O TER 1457 PHE B 89 HETATM 1458 O HOH C 7 65.288 46.219 31.883 1.00 23.26 O HETATM 1459 O HOH C 8 64.024 41.702 36.477 1.00 24.23 O HETATM 1460 O HOH C 9 57.021 47.555 30.522 1.00 29.65 O HETATM 1461 O HOH C 10 61.028 45.482 35.257 0.50 28.10 O HETATM 1462 O HOH C 11 58.980 49.478 29.661 1.00 27.16 O HETATM 1463 O HOH C 12 61.960 51.517 31.796 1.00 33.17 O HETATM 1464 O HOH C 13 54.991 49.109 26.775 1.00 38.88 O HETATM 1465 O HOH C 14 57.956 51.891 30.303 1.00 43.18 O HETATM 1466 O HOH C 15 62.174 51.211 28.205 1.00 33.04 O HETATM 1467 O HOH C 16 64.307 33.353 28.767 1.00 36.31 O HETATM 1468 O HOH C 17 61.620 35.789 35.745 1.00 38.78 O HETATM 1469 O HOH C 18 63.647 45.269 35.369 0.50 26.16 O HETATM 1470 O HOH C 19 59.657 37.835 38.126 1.00 34.72 O HETATM 1471 O HOH C 20 55.032 49.812 31.176 1.00 40.62 O HETATM 1472 O HOH C 21 65.810 51.067 28.976 1.00 41.05 O HETATM 1473 O HOH C 22 55.587 37.297 33.934 1.00 44.66 O HETATM 1474 O HOH C 23 63.249 53.209 25.400 1.00 39.52 O HETATM 1475 O HOH C 24 61.084 48.857 18.752 1.00 49.99 O HETATM 1476 O HOH C 25 67.954 53.006 25.344 1.00 46.52 O HETATM 1477 O HOH C 26 62.463 50.629 18.102 1.00 46.08 O HETATM 1478 O HOH C 27 64.711 52.545 30.711 1.00 49.62 O HETATM 1479 O HOH D 7 38.567 34.713 -10.937 1.00 27.31 O HETATM 1480 O HOH D 28 44.752 41.238 -11.330 1.00 35.12 O HETATM 1481 O HOH D 55 44.244 45.669 -13.252 1.00 39.96 O HETATM 1482 O HOH D 69 34.073 54.434 -3.597 1.00 38.31 O HETATM 1483 O HOH D 83 32.379 50.716 -8.488 1.00 33.12 O HETATM 1484 O HOH D 85 34.125 55.912 -0.739 1.00 41.52 O HETATM 1485 O HOH D 87 37.804 51.056 -6.181 1.00 42.77 O HETATM 1486 O HOH D 90 32.325 46.359 -12.512 1.00 41.02 O HETATM 1487 O HOH D 103 40.263 53.299 -1.857 1.00 54.76 O HETATM 1488 O HOH D 125 28.410 53.259 6.310 1.00 41.06 O HETATM 1489 O HOH A 90 57.953 46.330 22.430 1.00 25.90 O HETATM 1490 O HOH A 91 61.366 47.078 16.896 1.00 25.05 O HETATM 1491 O HOH A 92 57.103 41.561 1.852 1.00 21.90 O HETATM 1492 O HOH A 93 52.120 45.581 19.586 1.00 35.56 O HETATM 1493 O HOH A 94 59.723 38.987 1.951 1.00 30.07 O HETATM 1494 O HOH A 95 52.671 38.615 2.683 1.00 30.00 O HETATM 1495 O HOH A 96 65.261 47.479 20.289 1.00 32.32 O HETATM 1496 O HOH A 97 56.157 46.674 14.644 1.00 30.08 O HETATM 1497 O HOH A 98 56.568 36.906 31.514 1.00 34.86 O HETATM 1498 O HOH A 99 61.074 50.286 14.096 1.00 31.89 O HETATM 1499 O HOH A 100 69.792 44.534 26.373 1.00 33.29 O HETATM 1500 O HOH A 101 61.834 45.003 0.347 1.00 30.91 O HETATM 1501 O HOH A 102 45.914 42.336 25.270 1.00 43.47 O HETATM 1502 O HOH A 103 63.733 40.568 3.545 1.00 42.91 O HETATM 1503 O HOH A 104 52.226 43.780 31.398 1.00 46.63 O HETATM 1504 O HOH A 105 49.783 33.937 30.478 1.00 40.58 O HETATM 1505 O HOH A 106 55.198 48.391 24.123 1.00 33.25 O HETATM 1506 O HOH A 107 64.454 45.567 13.592 1.00 32.39 O HETATM 1507 O HOH A 108 60.493 33.042 35.401 1.00 38.18 O HETATM 1508 O HOH A 109 47.818 34.963 23.177 1.00 44.06 O HETATM 1509 O HOH A 110 47.935 43.819 24.166 1.00 28.56 O HETATM 1510 O HOH A 111 63.757 34.726 33.936 1.00 45.09 O HETATM 1511 O HOH A 112 63.986 47.515 15.694 1.00 36.70 O HETATM 1512 O HOH A 113 64.941 37.855 8.520 1.00 32.48 O HETATM 1513 O HOH A 114 47.334 35.637 17.529 1.00 38.19 O HETATM 1514 O HOH A 115 68.031 47.253 28.566 1.00 40.42 O HETATM 1515 O HOH A 116 45.141 35.706 19.088 1.00 38.22 O HETATM 1516 O HOH A 117 67.366 37.251 29.710 1.00 39.08 O HETATM 1517 O HOH A 118 68.192 49.216 26.803 1.00 36.92 O HETATM 1518 O HOH A 119 54.115 33.774 15.541 1.00 59.43 O HETATM 1519 O HOH A 120 47.541 46.314 22.681 1.00 41.18 O HETATM 1520 O HOH A 121 55.654 34.515 33.987 1.00 46.43 O HETATM 1521 O HOH A 122 53.835 39.764 30.700 1.00 35.22 O HETATM 1522 O HOH A 123 57.874 33.960 34.900 1.00 49.62 O HETATM 1523 O HOH A 124 67.270 35.854 27.163 1.00 44.10 O HETATM 1524 O HOH A 125 43.749 41.955 23.673 1.00 44.57 O HETATM 1525 O HOH A 126 60.919 32.026 37.460 1.00 54.18 O HETATM 1526 O HOH A 127 57.838 30.942 38.207 1.00 39.08 O HETATM 1527 O HOH A 128 49.576 30.724 29.088 1.00 42.95 O HETATM 1528 O HOH A 129 65.373 45.920 8.679 1.00 44.28 O HETATM 1529 O HOH A 130 49.053 33.990 18.955 1.00 44.16 O HETATM 1530 O HOH A 131 49.447 27.393 30.260 1.00 50.14 O HETATM 1531 O HOH A 132 55.369 46.738 28.206 1.00 34.09 O HETATM 1532 O HOH B 90 35.883 44.134 4.824 1.00 29.72 O HETATM 1533 O HOH B 91 45.286 47.080 3.018 1.00 30.28 O HETATM 1534 O HOH B 92 39.376 46.581 -0.120 1.00 28.21 O HETATM 1535 O HOH B 93 32.502 43.380 -0.524 1.00 31.24 O HETATM 1536 O HOH B 94 54.459 50.316 -10.733 1.00 34.32 O HETATM 1537 O HOH B 95 49.151 49.975 0.068 1.00 34.31 O HETATM 1538 O HOH B 96 53.030 39.320 -2.841 1.00 27.77 O HETATM 1539 O HOH B 97 37.915 34.867 -8.232 1.00 27.12 O HETATM 1540 O HOH B 98 32.438 43.418 -3.084 1.00 44.77 O HETATM 1541 O HOH B 99 39.944 49.933 -7.435 1.00 45.72 O HETATM 1542 O HOH B 100 34.802 36.796 -11.161 1.00 34.75 O HETATM 1543 O HOH B 101 40.555 33.322 17.417 1.00 38.69 O HETATM 1544 O HOH B 102 49.055 48.035 -1.942 1.00 32.87 O HETATM 1545 O HOH B 103 42.458 36.523 18.361 1.00 31.30 O HETATM 1546 O HOH B 104 33.393 40.812 7.152 1.00 38.76 O HETATM 1547 O HOH B 105 41.281 45.360 7.579 1.00 31.69 O HETATM 1548 O HOH B 106 45.915 44.414 -9.452 1.00 36.58 O HETATM 1549 O HOH B 107 57.381 41.831 -4.500 1.00 37.01 O HETATM 1550 O HOH B 108 56.310 45.585 -3.887 1.00 34.81 O HETATM 1551 O HOH B 109 30.462 40.606 2.252 1.00 38.14 O HETATM 1552 O HOH B 110 29.639 37.194 -3.544 1.00 36.21 O HETATM 1553 O HOH B 111 46.771 39.319 -14.444 1.00 49.03 O HETATM 1554 O HOH B 112 37.841 29.654 -0.925 1.00 39.35 O HETATM 1555 O HOH B 113 50.057 39.376 -16.039 1.00 53.45 O HETATM 1556 O HOH B 114 43.830 37.075 -16.918 1.00 38.86 O HETATM 1557 O HOH B 115 46.505 35.123 2.815 1.00 67.99 O HETATM 1558 O HOH B 116 43.866 23.038 -3.827 1.00 40.82 O HETATM 1559 O HOH B 117 39.877 37.725 -15.897 1.00 41.22 O HETATM 1560 O HOH B 118 52.176 41.115 -10.124 1.00 44.55 O HETATM 1561 O HOH B 119 36.362 34.269 15.871 1.00 45.20 O HETATM 1562 O HOH B 120 45.561 30.928 6.928 1.00 34.05 O HETATM 1563 O HOH B 121 40.441 29.977 11.104 1.00 42.36 O HETATM 1564 O HOH B 122 35.935 33.046 10.203 1.00 41.18 O HETATM 1565 O HOH B 123 35.162 35.756 -8.990 1.00 43.61 O HETATM 1566 O HOH B 124 46.990 46.086 -11.293 1.00 47.36 O HETATM 1567 O HOH B 125 55.303 40.011 0.725 1.00 39.55 O HETATM 1568 O HOH B 126 55.323 40.088 -6.144 1.00 37.07 O HETATM 1569 O HOH B 127 48.246 49.440 3.766 1.00 45.56 O HETATM 1570 O HOH B 128 30.467 37.664 8.531 1.00 47.43 O HETATM 1571 O HOH B 129 44.986 27.735 -1.687 1.00 34.71 O HETATM 1572 O HOH B 130 33.607 32.828 -4.449 1.00 39.42 O HETATM 1573 O HOH B 131 48.567 35.467 -17.700 1.00 43.52 O HETATM 1574 O HOH B 132 35.821 32.764 -12.164 1.00 33.22 O HETATM 1575 O HOH B 133 32.139 34.582 -4.953 1.00 45.00 O HETATM 1576 O HOH B 134 50.883 47.627 -6.694 1.00 33.63 O HETATM 1577 O HOH B 135 41.784 29.476 -12.627 1.00 44.37 O HETATM 1578 O HOH B 136 51.337 55.564 -6.108 1.00 51.34 O HETATM 1579 O HOH B 137 41.318 49.789 -0.715 1.00 38.28 O HETATM 1580 O HOH B 138 35.295 41.896 11.577 1.00 53.24 O HETATM 1581 O HOH B 139 33.723 43.244 6.027 1.00 41.96 O HETATM 1582 O HOH B 140 44.425 51.837 -1.291 1.00 43.46 O HETATM 1583 O HOH B 141 50.466 36.327 -13.882 1.00 49.63 O HETATM 1584 O HOH B 142 52.209 36.860 0.475 1.00 40.89 O HETATM 1585 O HOH B 143 54.177 37.071 -3.320 1.00 42.10 O HETATM 1586 O HOH B 144 40.627 51.182 1.921 1.00 50.90 O HETATM 1587 O HOH B 145 38.853 47.037 6.737 1.00 46.39 O HETATM 1588 O HOH B 146 27.589 39.484 2.586 1.00 47.86 O HETATM 1589 O HOH B 147 29.782 41.348 -11.708 1.00 57.61 O HETATM 1590 O HOH B 148 57.405 47.661 -9.574 1.00 44.40 O HETATM 1591 O HOH B 149 27.034 37.941 0.713 1.00 48.27 O HETATM 1592 O HOH B 150 36.937 47.188 4.667 1.00 45.17 O HETATM 1593 O HOH B 151 54.872 39.076 -8.781 1.00 55.03 O MASTER 348 0 0 7 6 0 0 6 1580 4 0 16 END
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89aa, >1J5K_2|Chain... *
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Ligand Name
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SSDNA
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Entry Information
PDB ID
1zzi
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Heterogeneous nuclear ribonucleoprotein K
Ligand Name
ssDNA
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
Kd=2.2uM
Release Year
2005
Protein/NA Sequence
Check fasta file
Primary Reference
Structure. (2005) 13, pp. 1055-1067
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):
P61978
Entrez Gene ID
NCBI Entrez Gene ID:
3190
ASD
Information of known allosteric effects of PDB entries
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