HEADER CARBOHYDRATE BINDING MODULE 01-MAR-04 1UXZ TITLE CARBOHYDRATE BINDING MODULE (CBM6CM-2) FROM CELLVIBRIO TITLE 2 MIXTUS LICHENASE 5A COMPND MOL_ID: 1; COMPND 2 MOLECULE: CELLULASE B; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: CARBOHYDRATE BINDING MODULE, RESIDUES 493-622; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: CELLVIBRIO MIXTUS; SOURCE 3 ORGANISM_TAXID: 39650; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS CARBOHYDRATE BINDING MODULE, CBM6, MIXTED BETA1, 3-1, 4 KEYWDS 2 LINKED GLUCAN EXPDTA X-RAY DIFFRACTION AUTHOR M.CZJZEK,V.M.R.PIRES,J.HENSHAW,J.A.M.PRATES,D.BOLAM, AUTHOR 2 B.HENRISSAT,H.J.GILBERT REVDAT 3 24-FEB-09 1UXZ 1 VERSN REVDAT 2 13-MAY-04 1UXZ 1 JRNL REVDAT 1 11-MAR-04 1UXZ 0 JRNL AUTH V.M.R.PIRES,J.HENSHAW,J.A.M.PRATES,D.BOLAM, JRNL AUTH 2 L.M.A.FERREIRA,C.M.G.A.FONTES,B.HENRISSAT,A.PLANAS, JRNL AUTH 3 H.J.GILBERT,M.CZJZEK JRNL TITL THE CRYSTAL STRUCTURE OF THE FAMILY 6 CARBOHYDRATE JRNL TITL 2 BINDING MODULE FROM CELLVIBRIO MIXTUS JRNL TITL 3 ENDOGLUCANASE 5A IN COMPLEX WITH OLIGOSACCHARIDES JRNL TITL 4 REVEALS TWO DISTINCT BINDING SITES WITH DIFFERENT JRNL TITL 5 LIGAND SPECIFICITIES JRNL REF J.BIOL.CHEM. V. 279 21560 2004 JRNL REFN ISSN 0021-9258 JRNL PMID 15010454 JRNL DOI 10.1074/JBC.M401599200 REMARK 2 REMARK 2 RESOLUTION. 1.4 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.1.19 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) : 1.40 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 33.52 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 3 NUMBER OF REFLECTIONS : 67276 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) : 0.162 REMARK 3 R VALUE (WORKING SET) : 0.161 REMARK 3 FREE R VALUE : 0.178 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 3577 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) : 1.40 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.44 REMARK 3 REFLECTION IN BIN (WORKING SET) : 4877 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 BIN R VALUE (WORKING SET) : 0.1840 REMARK 3 BIN FREE R VALUE SET COUNT : 240 REMARK 3 BIN FREE R VALUE : 0.2080 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1944 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 391 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 13.36 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.67000 REMARK 3 B22 (A**2) : 0.33000 REMARK 3 B33 (A**2) : -0.99000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.046 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.047 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.027 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 0.651 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.969 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.960 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1992 ; 0.010 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): 1668 ; 0.002 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2720 ; 1.323 ; 1.887 REMARK 3 BOND ANGLES OTHERS (DEGREES): 3892 ; 0.748 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 260 ; 6.413 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): NULL ; NULL ; NULL REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 296 ; 0.078 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2308 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 390 ; 0.010 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 280 ; 0.179 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): 2020 ; 0.263 ; 0.200 REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): 1241 ; 0.083 ; 0.200 REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 266 ; 0.190 ; 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): 7 ; 0.109 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): 39 ; 0.324 ; 0.200 REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 32 ; 0.239 ; 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): 1276 ; 0.809 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2034 ; 1.511 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 716 ; 2.188 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 686 ; 3.418 ; 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 : NULL 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: HYDROGENS HAVE BEEN ADDED IN THE REMARK 3 RIDING POSITIONS REMARK 4 REMARK 4 1UXZ COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 02-MAR-04. REMARK 100 THE PDBE ID CODE IS EBI-14690. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 15-JUN-02 REMARK 200 TEMPERATURE (KELVIN) : 100.0 REMARK 200 PH : 7.00 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ESRF REMARK 200 BEAMLINE : ID14-1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.934 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : NULL REMARK 200 DETECTOR MANUFACTURER : NULL REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM REMARK 200 DATA SCALING SOFTWARE : CCP4 (SCALA) REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 70856 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.400 REMARK 200 RESOLUTION RANGE LOW (A) : 33.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.8 REMARK 200 DATA REDUNDANCY : 4.900 REMARK 200 R MERGE (I) : 0.05500 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 9.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.40 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.45 REMARK 200 COMPLETENESS FOR SHELL (%) : 97.7 REMARK 200 DATA REDUNDANCY IN SHELL : 3.20 REMARK 200 R MERGE FOR SHELL (I) : 0.18900 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 3.200 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: AMORE REMARK 200 STARTING MODEL: PDB ENTRY 1NAE REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 62.7 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.3 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 11% PEG 6000, 2.0 M NACL REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 31.55500 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 42.69500 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 33.47800 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 42.69500 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 31.55500 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 33.47800 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 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 350 REMARK 350 GENERATING THE BIOMOLECULE REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PQS REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PQS REMARK 350 APPLY THE FOLLOWING TO CHAINS: B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 2108 - O HOH A 2112 2.17 REMARK 500 O HOH B 2096 - O HOH B 2135 2.15 REMARK 500 O HOH B 2119 - O HOH B 2197 2.07 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 REMARK 500 O HOH A 2040 O HOH B 2102 2664 2.18 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASP B 10 32.39 -93.68 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1UY0 RELATED DB: PDB REMARK 900 CARBOHYDRATE BINDING MODULE (CBM6CM-2) FROM REMARK 900 CELLVIBRIO MIXTUS LICHENASE 5A IN COMPLEX REMARK 900 WITH GLC-1,3-GLC-1,4-GLC-1,3-GLC REMARK 900 RELATED ID: 1UYX RELATED DB: PDB REMARK 900 CARBOHYDRATE BINDING MODULE (CBM6CM-2) FROM REMARK 900 CELLVIBRIO MIXTUS LICHENASE 5A IN COMPLEX REMARK 900 WITH CELLOBIOSE REMARK 900 RELATED ID: 1UYY RELATED DB: PDB REMARK 900 CARBOHYDRATE BINDING MODULE (CBM6CM-2) FROM REMARK 900 CELLVIBRIO MIXTUS LICHENASE 5A IN COMPLEX REMARK 900 WITH CELLOTRIOSE REMARK 900 RELATED ID: 1UYZ RELATED DB: PDB REMARK 900 CARBOHYDRATE BINDING MODULE (CBM6CM-2) FROM REMARK 900 CELLVIBRIO MIXTUS LICHENASE 5A IN COMPLEX REMARK 900 WITH XYLOTETRAOSE REMARK 900 RELATED ID: 1UZ0 RELATED DB: PDB REMARK 900 CARBOHYDRATE BINDING MODULE (CBM6CM-2) FROM REMARK 900 CELLVIBRIO MIXTUS LICHENASE 5A IN COMPLEX REMARK 900 WITH GLC-4GLC-3GLC-4GLC DBREF 1UXZ A 1 1 PDB 1UXZ 1UXZ 1 1 DBREF 1UXZ A 2 131 UNP O07653 O07653 493 622 DBREF 1UXZ B 1 1 PDB 1UXZ 1UXZ 1 1 DBREF 1UXZ B 2 131 UNP O07653 O07653 493 622 SEQRES 1 A 131 MET VAL ILE ALA THR ILE GLN ALA GLU ASP HIS SER GLN SEQRES 2 A 131 GLN SER GLY THR GLN GLN GLU THR THR THR ASP THR GLY SEQRES 3 A 131 GLY GLY LYS ASN VAL GLY TYR ILE ASP ALA GLY ASP TRP SEQRES 4 A 131 LEU SER TYR ALA GLY THR PRO VAL ASN ILE PRO SER SER SEQRES 5 A 131 GLY SER TYR LEU ILE GLU TYR ARG VAL ALA SER GLN ASN SEQRES 6 A 131 GLY GLY GLY SER LEU THR PHE GLU GLU ALA GLY GLY ALA SEQRES 7 A 131 PRO VAL HIS GLY THR ILE ALA ILE PRO ALA THR GLY GLY SEQRES 8 A 131 TRP GLN THR TRP THR THR ILE GLN HIS THR VAL ASN LEU SEQRES 9 A 131 SER ALA GLY SER HIS GLN PHE GLY ILE LYS ALA ASN ALA SEQRES 10 A 131 GLY GLY TRP ASN LEU ASN TRP ILE ARG ILE ASN LYS THR SEQRES 11 A 131 HIS SEQRES 1 B 131 MET VAL ILE ALA THR ILE GLN ALA GLU ASP HIS SER GLN SEQRES 2 B 131 GLN SER GLY THR GLN GLN GLU THR THR THR ASP THR GLY SEQRES 3 B 131 GLY GLY LYS ASN VAL GLY TYR ILE ASP ALA GLY ASP TRP SEQRES 4 B 131 LEU SER TYR ALA GLY THR PRO VAL ASN ILE PRO SER SER SEQRES 5 B 131 GLY SER TYR LEU ILE GLU TYR ARG VAL ALA SER GLN ASN SEQRES 6 B 131 GLY GLY GLY SER LEU THR PHE GLU GLU ALA GLY GLY ALA SEQRES 7 B 131 PRO VAL HIS GLY THR ILE ALA ILE PRO ALA THR GLY GLY SEQRES 8 B 131 TRP GLN THR TRP THR THR ILE GLN HIS THR VAL ASN LEU SEQRES 9 B 131 SER ALA GLY SER HIS GLN PHE GLY ILE LYS ALA ASN ALA SEQRES 10 B 131 GLY GLY TRP ASN LEU ASN TRP ILE ARG ILE ASN LYS THR SEQRES 11 B 131 HIS FORMUL 3 HOH *391(H2 O1) HELIX 1 1 GLU A 9 HIS A 11 5 3 HELIX 2 2 GLU B 9 HIS B 11 5 3 SHEET 1 AA 4 VAL A 2 GLN A 7 0 SHEET 2 AA 4 ASN A 121 LYS A 129 -1 O ILE A 125 N ILE A 6 SHEET 3 AA 4 GLY A 53 ALA A 62 -1 O LEU A 56 N ASN A 128 SHEET 4 AA 4 TRP A 95 LEU A 104 -1 O THR A 96 N VAL A 61 SHEET 1 AB 5 GLN A 13 SER A 15 0 SHEET 2 AB 5 TRP A 39 SER A 41 -1 O TRP A 39 N SER A 15 SHEET 3 AB 5 PHE A 111 ALA A 117 -1 O ILE A 113 N LEU A 40 SHEET 4 AB 5 GLY A 68 GLU A 74 -1 O SER A 69 N ASN A 116 SHEET 5 AB 5 VAL A 80 ILE A 86 -1 N HIS A 81 O PHE A 72 SHEET 1 AC 2 GLN A 18 THR A 21 0 SHEET 2 AC 2 LYS A 29 GLY A 32 -1 O ASN A 30 N GLU A 20 SHEET 1 AD 2 VAL A 47 ILE A 49 0 SHEET 2 AD 2 GLY A 107 HIS A 109 -1 O GLY A 107 N ILE A 49 SHEET 1 BA 4 VAL B 2 GLN B 7 0 SHEET 2 BA 4 ASN B 121 LYS B 129 -1 O ILE B 125 N ILE B 6 SHEET 3 BA 4 GLY B 53 ALA B 62 -1 O LEU B 56 N ASN B 128 SHEET 4 BA 4 TRP B 95 LEU B 104 -1 O THR B 96 N VAL B 61 SHEET 1 BB 5 GLN B 13 SER B 15 0 SHEET 2 BB 5 TRP B 39 SER B 41 -1 O TRP B 39 N SER B 15 SHEET 3 BB 5 PHE B 111 ALA B 117 -1 O ILE B 113 N LEU B 40 SHEET 4 BB 5 GLY B 68 GLU B 74 -1 O SER B 69 N ASN B 116 SHEET 5 BB 5 VAL B 80 ILE B 86 -1 N HIS B 81 O PHE B 72 SHEET 1 BC 2 GLN B 18 THR B 21 0 SHEET 2 BC 2 LYS B 29 GLY B 32 -1 O ASN B 30 N GLU B 20 SHEET 1 BD 2 VAL B 47 ILE B 49 0 SHEET 2 BD 2 GLY B 107 HIS B 109 -1 O GLY B 107 N ILE B 49 CISPEP 1 ALA A 78 PRO A 79 0 -5.40 CISPEP 2 ALA B 78 PRO B 79 0 -5.97 CRYST1 63.110 66.956 85.390 90.00 90.00 90.00 P 21 21 21 8 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 0.015845 0.000000 0.000000 0.00000 SCALE2 0.000000 0.014935 0.000000 0.00000 SCALE3 0.000000 0.000000 0.011711 0.00000 MTRIX1 1 -0.085490 -0.995990 0.026220 83.88921 1 MTRIX2 1 0.996160 -0.085940 -0.016610 -11.37161 1 MTRIX3 1 0.018790 0.024700 0.999520 -22.91246 1 ATOM 1 N MET A 1 70.327 27.865 20.222 1.00 27.22 N ATOM 2 CA MET A 1 69.079 27.361 20.853 1.00 25.71 C ATOM 3 C MET A 1 67.865 28.009 20.210 1.00 22.82 C ATOM 4 O MET A 1 67.785 29.227 20.072 1.00 21.01 O ATOM 5 CB MET A 1 69.050 27.625 22.351 1.00 27.78 C ATOM 6 CG MET A 1 68.137 26.658 23.114 1.00 31.33 C ATOM 7 SD MET A 1 66.969 27.521 24.186 1.00 41.98 S ATOM 8 CE MET A 1 65.664 26.267 24.382 1.00 40.83 C ATOM 9 N VAL A 2 66.915 27.172 19.842 1.00 19.12 N ATOM 10 CA VAL A 2 65.781 27.601 19.033 1.00 18.01 C ATOM 11 C VAL A 2 64.704 28.203 19.925 1.00 16.51 C ATOM 12 O VAL A 2 64.219 27.570 20.870 1.00 18.18 O ATOM 13 CB VAL A 2 65.208 26.426 18.235 1.00 17.64 C ATOM 14 CG1 VAL A 2 63.967 26.854 17.445 1.00 18.93 C ATOM 15 CG2 VAL A 2 66.267 25.840 17.310 1.00 19.97 C ATOM 16 N ILE A 3 64.329 29.444 19.639 1.00 13.62 N ATOM 17 CA ILE A 3 63.266 30.140 20.353 1.00 13.56 C ATOM 18 C ILE A 3 61.923 29.785 19.743 1.00 12.58 C ATOM 19 O ILE A 3 60.959 29.494 20.451 1.00 13.20 O ATOM 20 CB ILE A 3 63.493 31.682 20.303 1.00 13.75 C ATOM 21 CG1 ILE A 3 64.788 32.080 21.019 1.00 15.46 C ATOM 22 CG2 ILE A 3 62.305 32.438 20.884 1.00 15.06 C ATOM 23 CD1 ILE A 3 64.798 31.745 22.504 1.00 17.88 C ATOM 24 N ALA A 4 61.849 29.843 18.427 1.00 11.69 N ATOM 25 CA ALA A 4 60.633 29.510 17.713 1.00 11.34 C ATOM 26 C ALA A 4 60.911 29.138 16.285 1.00 11.24 C ATOM 27 O ALA A 4 61.798 29.715 15.662 1.00 11.80 O ATOM 28 CB ALA A 4 59.662 30.681 17.735 1.00 12.23 C ATOM 29 N THR A 5 60.121 28.218 15.754 1.00 11.30 N ATOM 30 CA THR A 5 59.965 28.044 14.322 1.00 12.40 C ATOM 31 C THR A 5 58.554 28.438 13.959 1.00 12.19 C ATOM 32 O THR A 5 57.597 27.980 14.594 1.00 12.24 O ATOM 33 CB THR A 5 60.199 26.595 13.887 1.00 13.38 C ATOM 34 OG1 THR A 5 61.521 26.189 14.255 1.00 14.48 O ATOM 35 CG2 THR A 5 60.125 26.473 12.342 1.00 15.24 C ATOM 36 N ILE A 6 58.414 29.273 12.942 1.00 11.54 N ATOM 37 CA ILE A 6 57.115 29.759 12.486 1.00 11.91 C ATOM 38 C ILE A 6 56.983 29.387 11.028 1.00 11.67 C ATOM 39 O ILE A 6 57.767 29.826 10.194 1.00 11.83 O ATOM 40 CB ILE A 6 57.040 31.296 12.657 1.00 12.45 C ATOM 41 CG1 ILE A 6 57.086 31.688 14.135 1.00 14.85 C ATOM 42 CG2 ILE A 6 55.777 31.857 12.037 1.00 13.99 C ATOM 43 CD1 ILE A 6 57.235 33.193 14.360 1.00 18.39 C ATOM 44 N GLN A 7 56.021 28.547 10.703 1.00 11.24 N ATOM 45 CA GLN A 7 55.741 28.239 9.317 1.00 11.00 C ATOM 46 C GLN A 7 55.156 29.474 8.632 1.00 11.34 C ATOM 47 O GLN A 7 54.283 30.147 9.173 1.00 11.58 O ATOM 48 CB GLN A 7 54.791 27.050 9.207 1.00 11.65 C ATOM 49 CG GLN A 7 55.381 25.751 9.672 1.00 12.59 C ATOM 50 CD GLN A 7 56.566 25.294 8.867 1.00 11.17 C ATOM 51 OE1 GLN A 7 56.612 25.495 7.660 1.00 12.73 O ATOM 52 NE2 GLN A 7 57.548 24.703 9.538 1.00 14.81 N ATOM 53 N ALA A 8 55.651 29.783 7.441 1.00 10.72 N ATOM 54 CA ALA A 8 55.268 31.042 6.786 1.00 11.18 C ATOM 55 C ALA A 8 53.776 31.148 6.553 1.00 11.63 C ATOM 56 O ALA A 8 53.180 32.228 6.652 1.00 11.96 O ATOM 57 CB ALA A 8 56.009 31.213 5.488 1.00 11.59 C ATOM 58 N GLU A 9 53.170 30.004 6.277 1.00 11.66 N ATOM 59 CA GLU A 9 51.745 29.890 6.006 1.00 12.85 C ATOM 60 C GLU A 9 50.854 30.052 7.228 1.00 13.14 C ATOM 61 O GLU A 9 49.627 30.135 7.078 1.00 14.76 O ATOM 62 CB GLU A 9 51.449 28.528 5.353 1.00 13.63 C ATOM 63 CG GLU A 9 51.772 27.268 6.172 1.00 14.17 C ATOM 64 CD GLU A 9 53.189 26.729 5.989 1.00 14.90 C ATOM 65 OE1 GLU A 9 54.103 27.507 5.739 1.00 15.33 O ATOM 66 OE2 GLU A 9 53.405 25.496 6.082 1.00 19.18 O ATOM 67 N ASP A 10 51.440 30.063 8.423 1.00 12.53 N ATOM 68 CA ASP A 10 50.688 30.183 9.681 1.00 12.42 C ATOM 69 C ASP A 10 50.549 31.633 10.159 1.00 12.22 C ATOM 70 O ASP A 10 50.400 31.904 11.351 1.00 13.40 O ATOM 71 CB ASP A 10 51.321 29.305 10.774 1.00 12.21 C ATOM 72 CG ASP A 10 51.094 27.836 10.568 1.00 13.87 C ATOM 73 OD1 ASP A 10 50.249 27.438 9.738 1.00 16.31 O ATOM 74 OD2 ASP A 10 51.760 26.998 11.198 1.00 13.48 O ATOM 75 N HIS A 11 50.532 32.549 9.206 1.00 12.26 N ATOM 76 CA HIS A 11 50.252 33.946 9.478 1.00 12.26 C ATOM 77 C HIS A 11 48.828 34.199 9.942 1.00 12.64 C ATOM 78 O HIS A 11 47.899 33.476 9.568 1.00 13.45 O ATOM 79 CB HIS A 11 50.542 34.796 8.234 1.00 12.81 C ATOM 80 CG HIS A 11 49.887 34.315 6.976 1.00 11.86 C ATOM 81 ND1 HIS A 11 48.540 34.465 6.717 1.00 13.69 N ATOM 82 CD2 HIS A 11 50.410 33.699 5.887 1.00 13.87 C ATOM 83 CE1 HIS A 11 48.270 33.963 5.519 1.00 13.18 C ATOM 84 NE2 HIS A 11 49.389 33.502 4.991 1.00 14.19 N ATOM 85 N SER A 12 48.661 35.201 10.786 1.00 12.48 N ATOM 86 CA SER A 12 47.342 35.627 11.236 1.00 12.71 C ATOM 87 C SER A 12 46.726 36.688 10.345 1.00 13.88 C ATOM 88 O SER A 12 45.507 36.885 10.373 1.00 14.90 O ATOM 89 CB SER A 12 47.419 36.105 12.683 1.00 13.06 C ATOM 90 OG SER A 12 48.351 37.147 12.844 1.00 13.77 O ATOM 91 N GLN A 13 47.551 37.371 9.562 1.00 12.92 N ATOM 92 CA GLN A 13 47.070 38.311 8.546 1.00 13.40 C ATOM 93 C GLN A 13 48.129 38.366 7.464 1.00 12.93 C ATOM 94 O GLN A 13 49.298 38.097 7.730 1.00 11.85 O ATOM 95 CB GLN A 13 46.853 39.702 9.140 1.00 14.44 C ATOM 96 CG GLN A 13 46.015 40.648 8.301 1.00 18.57 C ATOM 97 CD GLN A 13 45.725 41.967 9.010 1.00 21.69 C ATOM 98 OE1 GLN A 13 46.404 42.342 9.963 1.00 24.62 O ATOM 99 NE2 GLN A 13 44.739 42.682 8.514 1.00 24.92 N ATOM 100 N GLN A 14 47.743 38.715 6.248 1.00 12.18 N ATOM 101 CA GLN A 14 48.696 38.874 5.165 1.00 12.33 C ATOM 102 C GLN A 14 48.170 39.861 4.151 1.00 12.53 C ATOM 103 O GLN A 14 46.973 40.191 4.153 1.00 13.48 O ATOM 104 CB GLN A 14 48.988 37.527 4.490 1.00 11.99 C ATOM 105 CG GLN A 14 47.831 36.947 3.640 1.00 12.75 C ATOM 106 CD GLN A 14 47.769 37.558 2.256 1.00 13.92 C ATOM 107 OE1 GLN A 14 48.791 37.680 1.598 1.00 13.04 O ATOM 108 NE2 GLN A 14 46.571 37.952 1.816 1.00 13.64 N ATOM 109 N SER A 15 49.044 40.311 3.264 1.00 11.86 N ATOM 110 CA SER A 15 48.640 41.126 2.127 1.00 11.54 C ATOM 111 C SER A 15 49.428 40.711 0.893 1.00 11.51 C ATOM 112 O SER A 15 50.658 40.711 0.890 1.00 11.41 O ATOM 113 CB SER A 15 48.902 42.596 2.416 1.00 12.25 C ATOM 114 OG SER A 15 48.407 43.428 1.359 1.00 12.09 O ATOM 115 N GLY A 16 48.690 40.381 -0.174 1.00 11.17 N ATOM 116 CA GLY A 16 49.251 40.218 -1.494 1.00 11.19 C ATOM 117 C GLY A 16 49.810 38.867 -1.903 1.00 11.41 C ATOM 118 O GLY A 16 50.290 38.741 -3.013 1.00 11.31 O ATOM 119 N THR A 17 49.729 37.866 -1.041 1.00 11.69 N ATOM 120 CA THR A 17 50.418 36.595 -1.275 1.00 11.77 C ATOM 121 C THR A 17 49.411 35.463 -1.357 1.00 12.92 C ATOM 122 O THR A 17 48.227 35.639 -1.102 1.00 13.42 O ATOM 123 CB THR A 17 51.452 36.319 -0.154 1.00 11.48 C ATOM 124 OG1 THR A 17 50.778 35.962 1.063 1.00 13.33 O ATOM 125 CG2 THR A 17 52.321 37.535 0.138 1.00 11.91 C ATOM 126 N GLN A 18 49.924 34.277 -1.676 1.00 14.24 N ATOM 127 CA GLN A 18 49.112 33.077 -1.787 1.00 16.46 C ATOM 128 C GLN A 18 49.938 31.885 -1.328 1.00 15.75 C ATOM 129 O GLN A 18 51.131 31.836 -1.549 1.00 16.53 O ATOM 130 CB GLN A 18 48.671 32.902 -3.242 1.00 18.50 C ATOM 131 CG GLN A 18 47.969 31.626 -3.573 1.00 22.11 C ATOM 132 CD GLN A 18 47.529 31.592 -5.012 1.00 25.64 C ATOM 133 OE1 GLN A 18 46.506 32.176 -5.357 1.00 30.38 O ATOM 134 NE2 GLN A 18 48.305 30.925 -5.861 1.00 29.31 N ATOM 135 N GLN A 19 49.288 30.919 -0.701 1.00 15.71 N ATOM 136 CA GLN A 19 49.947 29.700 -0.259 1.00 16.06 C ATOM 137 C GLN A 19 49.921 28.635 -1.333 1.00 15.64 C ATOM 138 O GLN A 19 49.069 28.636 -2.224 1.00 16.85 O ATOM 139 CB GLN A 19 49.264 29.169 0.989 1.00 16.43 C ATOM 140 CG GLN A 19 49.353 30.149 2.130 1.00 17.68 C ATOM 141 CD GLN A 19 48.647 29.705 3.383 1.00 19.32 C ATOM 142 OE1 GLN A 19 48.434 30.524 4.306 1.00 23.15 O ATOM 143 NE2 GLN A 19 48.297 28.427 3.457 1.00 18.04 N ATOM 144 N GLU A 20 50.878 27.727 -1.253 1.00 15.06 N ATOM 145 CA GLU A 20 50.956 26.604 -2.181 1.00 16.32 C ATOM 146 C GLU A 20 51.696 25.455 -1.524 1.00 16.53 C ATOM 147 O GLU A 20 52.392 25.633 -0.529 1.00 16.05 O ATOM 148 CB GLU A 20 51.659 27.036 -3.464 1.00 16.90 C ATOM 149 CG GLU A 20 53.112 27.474 -3.277 1.00 18.50 C ATOM 150 CD GLU A 20 53.676 28.256 -4.464 1.00 21.05 C ATOM 151 OE1 GLU A 20 53.039 28.309 -5.547 1.00 25.45 O ATOM 152 OE2 GLU A 20 54.761 28.846 -4.327 1.00 20.66 O ATOM 153 N THR A 21 51.529 24.246 -2.052 1.00 16.74 N ATOM 154 CA THR A 21 52.268 23.096 -1.562 1.00 17.73 C ATOM 155 C THR A 21 53.749 23.272 -1.860 1.00 16.73 C ATOM 156 O THR A 21 54.121 23.763 -2.917 1.00 17.04 O ATOM 157 CB THR A 21 51.720 21.803 -2.213 1.00 18.31 C ATOM 158 OG1 THR A 21 50.351 21.644 -1.825 1.00 22.59 O ATOM 159 CG2 THR A 21 52.417 20.564 -1.661 1.00 20.67 C ATOM 160 N THR A 22 54.598 22.905 -0.905 1.00 16.52 N ATOM 161 CA THR A 22 56.025 22.895 -1.137 1.00 16.51 C ATOM 162 C THR A 22 56.566 21.474 -1.220 1.00 16.72 C ATOM 163 O THR A 22 56.057 20.577 -0.557 1.00 17.95 O ATOM 164 CB THR A 22 56.796 23.699 -0.043 1.00 16.27 C ATOM 165 OG1 THR A 22 58.187 23.738 -0.367 1.00 15.87 O ATOM 166 CG2 THR A 22 56.736 23.034 1.323 1.00 16.39 C ATOM 167 N THR A 23 57.601 21.290 -2.028 1.00 17.17 N ATOM 168 CA THR A 23 58.313 20.014 -2.067 1.00 18.14 C ATOM 169 C THR A 23 59.600 20.064 -1.272 1.00 18.18 C ATOM 170 O THR A 23 60.412 19.153 -1.326 1.00 19.11 O ATOM 171 CB THR A 23 58.614 19.614 -3.501 1.00 18.55 C ATOM 172 OG1 THR A 23 59.280 20.690 -4.164 1.00 20.05 O ATOM 173 CG2 THR A 23 57.319 19.377 -4.294 1.00 19.87 C ATOM 174 N ASP A 24 59.799 21.115 -0.490 1.00 17.31 N ATOM 175 CA ASP A 24 60.934 21.157 0.407 1.00 17.40 C ATOM 176 C ASP A 24 60.832 20.012 1.407 1.00 18.39 C ATOM 177 O ASP A 24 59.764 19.458 1.615 1.00 18.27 O ATOM 178 CB ASP A 24 60.953 22.506 1.142 1.00 16.49 C ATOM 179 CG ASP A 24 62.265 22.805 1.805 1.00 17.35 C ATOM 180 OD1 ASP A 24 63.313 22.179 1.493 1.00 15.61 O ATOM 181 OD2 ASP A 24 62.335 23.673 2.704 1.00 13.72 O ATOM 182 N THR A 25 61.950 19.681 2.031 1.00 19.69 N ATOM 183 CA THR A 25 61.998 18.718 3.128 1.00 21.50 C ATOM 184 C THR A 25 60.921 18.999 4.158 1.00 21.66 C ATOM 185 O THR A 25 60.774 20.137 4.611 1.00 22.36 O ATOM 186 CB THR A 25 63.359 18.819 3.799 1.00 22.10 C ATOM 187 OG1 THR A 25 64.383 18.690 2.811 1.00 24.27 O ATOM 188 CG2 THR A 25 63.600 17.655 4.767 1.00 23.72 C ATOM 189 N GLY A 26 60.183 17.969 4.544 1.00 22.28 N ATOM 190 CA GLY A 26 59.106 18.107 5.504 1.00 22.05 C ATOM 191 C GLY A 26 57.754 18.403 4.878 1.00 21.85 C ATOM 192 O GLY A 26 56.731 18.309 5.559 1.00 23.42 O ATOM 193 N GLY A 27 57.740 18.758 3.593 1.00 21.34 N ATOM 194 CA GLY A 27 56.507 19.058 2.892 1.00 20.21 C ATOM 195 C GLY A 27 55.745 20.225 3.494 1.00 19.24 C ATOM 196 O GLY A 27 56.340 21.145 4.042 1.00 19.09 O ATOM 197 N GLY A 28 54.428 20.183 3.409 1.00 18.22 N ATOM 198 CA GLY A 28 53.591 21.248 3.917 1.00 17.61 C ATOM 199 C GLY A 28 53.389 22.300 2.845 1.00 16.75 C ATOM 200 O GLY A 28 53.179 21.980 1.678 1.00 17.36 O ATOM 201 N LYS A 29 53.476 23.571 3.255 1.00 15.52 N ATOM 202 CA LYS A 29 53.168 24.697 2.378 1.00 14.88 C ATOM 203 C LYS A 29 54.231 25.775 2.411 1.00 13.60 C ATOM 204 O LYS A 29 55.011 25.858 3.340 1.00 13.18 O ATOM 205 CB LYS A 29 51.841 25.325 2.786 1.00 15.59 C ATOM 206 CG LYS A 29 50.660 24.369 2.629 1.00 17.80 C ATOM 207 CD LYS A 29 49.383 25.033 3.050 1.00 22.62 C ATOM 208 CE LYS A 29 48.215 24.059 2.990 1.00 25.75 C ATOM 209 NZ LYS A 29 47.070 24.545 3.804 1.00 29.51 N ATOM 210 N ASN A 30 54.262 26.588 1.374 1.00 12.51 N ATOM 211 CA ASN A 30 55.051 27.815 1.390 1.00 11.98 C ATOM 212 C ASN A 30 54.154 28.969 0.964 1.00 11.80 C ATOM 213 O ASN A 30 53.082 28.781 0.403 1.00 12.48 O ATOM 214 CB ASN A 30 56.317 27.709 0.520 1.00 12.28 C ATOM 215 CG ASN A 30 56.035 27.687 -0.961 1.00 13.74 C ATOM 216 OD1 ASN A 30 55.887 28.748 -1.618 1.00 15.42 O ATOM 217 ND2 ASN A 30 55.981 26.495 -1.519 1.00 11.74 N ATOM 218 N VAL A 31 54.598 30.178 1.275 1.00 11.30 N ATOM 219 CA VAL A 31 53.983 31.388 0.762 1.00 11.18 C ATOM 220 C VAL A 31 54.697 31.775 -0.513 1.00 11.44 C ATOM 221 O VAL A 31 55.917 31.708 -0.595 1.00 11.24 O ATOM 222 CB VAL A 31 54.061 32.515 1.798 1.00 11.61 C ATOM 223 CG1 VAL A 31 53.515 33.839 1.233 1.00 11.92 C ATOM 224 CG2 VAL A 31 53.281 32.131 3.014 1.00 12.62 C ATOM 225 N GLY A 32 53.920 32.154 -1.520 1.00 11.41 N ATOM 226 CA GLY A 32 54.459 32.617 -2.780 1.00 11.54 C ATOM 227 C GLY A 32 53.696 33.819 -3.308 1.00 11.13 C ATOM 228 O GLY A 32 52.879 34.433 -2.615 1.00 11.58 O ATOM 229 N TYR A 33 53.997 34.153 -4.553 1.00 11.62 N ATOM 230 CA TYR A 33 53.477 35.355 -5.210 1.00 12.00 C ATOM 231 C TYR A 33 53.736 36.600 -4.377 1.00 11.97 C ATOM 232 O TYR A 33 52.846 37.427 -4.130 1.00 11.30 O ATOM 233 CB TYR A 33 52.004 35.188 -5.602 1.00 13.24 C ATOM 234 CG TYR A 33 51.875 34.121 -6.661 1.00 16.01 C ATOM 235 CD1 TYR A 33 51.681 32.784 -6.321 1.00 17.00 C ATOM 236 CD2 TYR A 33 52.046 34.429 -7.999 1.00 18.73 C ATOM 237 CE1 TYR A 33 51.603 31.798 -7.307 1.00 18.67 C ATOM 238 CE2 TYR A 33 51.973 33.445 -8.983 1.00 20.68 C ATOM 239 CZ TYR A 33 51.752 32.144 -8.621 1.00 21.26 C ATOM 240 OH TYR A 33 51.678 31.174 -9.615 1.00 25.55 O ATOM 241 N ILE A 34 54.989 36.725 -3.979 1.00 11.68 N ATOM 242 CA ILE A 34 55.470 37.829 -3.145 1.00 11.65 C ATOM 243 C ILE A 34 56.029 38.946 -4.031 1.00 12.00 C ATOM 244 O ILE A 34 56.817 38.720 -4.940 1.00 12.65 O ATOM 245 CB ILE A 34 56.548 37.327 -2.142 1.00 11.83 C ATOM 246 CG1 ILE A 34 55.972 36.196 -1.286 1.00 12.19 C ATOM 247 CG2 ILE A 34 57.006 38.495 -1.263 1.00 12.50 C ATOM 248 CD1 ILE A 34 56.927 35.595 -0.273 1.00 11.87 C ATOM 249 N ASP A 35 55.608 40.169 -3.739 1.00 11.55 N ATOM 250 CA ASP A 35 55.994 41.363 -4.469 1.00 11.95 C ATOM 251 C ASP A 35 56.221 42.492 -3.485 1.00 11.35 C ATOM 252 O ASP A 35 55.769 42.431 -2.349 1.00 11.55 O ATOM 253 CB ASP A 35 54.900 41.812 -5.421 1.00 12.02 C ATOM 254 CG ASP A 35 54.425 40.721 -6.312 1.00 12.29 C ATOM 255 OD1 ASP A 35 54.894 40.662 -7.461 1.00 13.50 O ATOM 256 OD2 ASP A 35 53.575 39.907 -5.954 1.00 13.16 O ATOM 257 N ALA A 36 56.870 43.553 -3.952 1.00 12.36 N ATOM 258 CA ALA A 36 57.078 44.761 -3.153 1.00 12.67 C ATOM 259 C ALA A 36 55.768 45.276 -2.575 1.00 12.84 C ATOM 260 O ALA A 36 54.794 45.475 -3.310 1.00 12.86 O ATOM 261 CB ALA A 36 57.724 45.828 -4.011 1.00 12.99 C ATOM 262 N GLY A 37 55.742 45.478 -1.261 1.00 12.04 N ATOM 263 CA GLY A 37 54.577 45.934 -0.532 1.00 11.83 C ATOM 264 C GLY A 37 53.841 44.845 0.213 1.00 11.67 C ATOM 265 O GLY A 37 53.117 45.121 1.161 1.00 12.50 O ATOM 266 N ASP A 38 54.009 43.602 -0.237 1.00 11.51 N ATOM 267 CA ASP A 38 53.333 42.475 0.378 1.00 11.33 C ATOM 268 C ASP A 38 53.902 42.219 1.772 1.00 10.54 C ATOM 269 O ASP A 38 55.019 42.601 2.073 1.00 11.21 O ATOM 270 CB ASP A 38 53.513 41.209 -0.453 1.00 10.90 C ATOM 271 CG ASP A 38 52.775 41.245 -1.789 1.00 12.16 C ATOM 272 OD1 ASP A 38 51.963 42.188 -2.031 1.00 12.22 O ATOM 273 OD2 ASP A 38 52.961 40.345 -2.647 1.00 11.20 O ATOM 274 N TRP A 39 53.106 41.594 2.615 1.00 9.72 N ATOM 275 CA TRP A 39 53.514 41.362 3.988 1.00 10.49 C ATOM 276 C TRP A 39 52.779 40.221 4.628 1.00 10.19 C ATOM 277 O TRP A 39 51.740 39.764 4.170 1.00 10.60 O ATOM 278 CB TRP A 39 53.364 42.636 4.830 1.00 11.44 C ATOM 279 CG TRP A 39 52.039 43.302 4.866 1.00 12.07 C ATOM 280 CD1 TRP A 39 51.660 44.387 4.137 1.00 12.86 C ATOM 281 CD2 TRP A 39 50.948 43.000 5.744 1.00 12.08 C ATOM 282 NE1 TRP A 39 50.389 44.754 4.497 1.00 12.51 N ATOM 283 CE2 TRP A 39 49.917 43.928 5.471 1.00 12.78 C ATOM 284 CE3 TRP A 39 50.718 42.016 6.709 1.00 13.71 C ATOM 285 CZ2 TRP A 39 48.697 43.924 6.152 1.00 13.59 C ATOM 286 CZ3 TRP A 39 49.504 42.003 7.379 1.00 14.25 C ATOM 287 CH2 TRP A 39 48.500 42.949 7.082 1.00 15.10 C ATOM 288 N LEU A 40 53.366 39.738 5.718 1.00 10.20 N ATOM 289 CA LEU A 40 52.879 38.619 6.485 1.00 10.26 C ATOM 290 C LEU A 40 52.948 39.004 7.953 1.00 10.14 C ATOM 291 O LEU A 40 53.982 39.496 8.417 1.00 11.25 O ATOM 292 CB LEU A 40 53.793 37.422 6.250 1.00 10.64 C ATOM 293 CG LEU A 40 53.896 36.930 4.811 1.00 11.47 C ATOM 294 CD1 LEU A 40 55.101 36.003 4.619 1.00 13.21 C ATOM 295 CD2 LEU A 40 52.644 36.198 4.378 1.00 14.02 C ATOM 296 N SER A 41 51.865 38.844 8.692 1.00 10.05 N ATOM 297 CA SER A 41 51.862 39.121 10.113 1.00 10.42 C ATOM 298 C SER A 41 51.706 37.830 10.885 1.00 10.27 C ATOM 299 O SER A 41 50.864 37.013 10.551 1.00 10.90 O ATOM 300 CB SER A 41 50.706 40.043 10.480 1.00 10.87 C ATOM 301 OG SER A 41 50.635 40.176 11.884 1.00 12.38 O ATOM 302 N TYR A 42 52.508 37.688 11.937 1.00 10.81 N ATOM 303 CA TYR A 42 52.434 36.578 12.880 1.00 10.84 C ATOM 304 C TYR A 42 51.995 37.077 14.246 1.00 11.43 C ATOM 305 O TYR A 42 52.300 36.476 15.279 1.00 11.25 O ATOM 306 CB TYR A 42 53.766 35.804 12.908 1.00 10.35 C ATOM 307 CG TYR A 42 54.111 35.346 11.518 1.00 9.60 C ATOM 308 CD1 TYR A 42 54.889 36.121 10.690 1.00 10.09 C ATOM 309 CD2 TYR A 42 53.531 34.207 10.986 1.00 10.29 C ATOM 310 CE1 TYR A 42 55.145 35.750 9.378 1.00 10.22 C ATOM 311 CE2 TYR A 42 53.775 33.818 9.694 1.00 10.09 C ATOM 312 CZ TYR A 42 54.577 34.606 8.881 1.00 10.02 C ATOM 313 OH TYR A 42 54.777 34.251 7.577 1.00 11.22 O ATOM 314 N ALA A 43 51.223 38.162 14.268 1.00 11.38 N ATOM 315 CA ALA A 43 50.774 38.750 15.521 1.00 11.83 C ATOM 316 C ALA A 43 49.895 37.812 16.331 1.00 12.14 C ATOM 317 O ALA A 43 49.857 37.918 17.552 1.00 13.58 O ATOM 318 CB ALA A 43 50.036 40.041 15.250 1.00 12.96 C ATOM 319 N GLY A 44 49.210 36.886 15.678 1.00 11.97 N ATOM 320 CA GLY A 44 48.361 35.926 16.377 1.00 12.42 C ATOM 321 C GLY A 44 49.119 34.927 17.229 1.00 12.65 C ATOM 322 O GLY A 44 48.532 34.310 18.113 1.00 13.59 O ATOM 323 N THR A 45 50.409 34.741 16.954 1.00 11.93 N ATOM 324 CA THR A 45 51.270 33.826 17.693 1.00 11.17 C ATOM 325 C THR A 45 52.462 34.591 18.247 1.00 11.15 C ATOM 326 O THR A 45 53.555 34.525 17.686 1.00 11.28 O ATOM 327 CB THR A 45 51.761 32.690 16.783 1.00 11.63 C ATOM 328 OG1 THR A 45 52.316 33.237 15.572 1.00 12.11 O ATOM 329 CG2 THR A 45 50.634 31.758 16.345 1.00 11.73 C ATOM 330 N PRO A 46 52.281 35.313 19.345 1.00 11.07 N ATOM 331 CA PRO A 46 53.410 36.036 19.932 1.00 11.28 C ATOM 332 C PRO A 46 54.503 35.080 20.351 1.00 11.40 C ATOM 333 O PRO A 46 54.215 33.944 20.769 1.00 11.85 O ATOM 334 CB PRO A 46 52.799 36.759 21.141 1.00 11.24 C ATOM 335 CG PRO A 46 51.348 36.774 20.841 1.00 12.37 C ATOM 336 CD PRO A 46 51.043 35.506 20.123 1.00 12.06 C ATOM 337 N VAL A 47 55.738 35.532 20.228 1.00 11.05 N ATOM 338 CA VAL A 47 56.918 34.749 20.561 1.00 11.12 C ATOM 339 C VAL A 47 57.601 35.411 21.739 1.00 11.09 C ATOM 340 O VAL A 47 57.746 36.634 21.777 1.00 11.75 O ATOM 341 CB VAL A 47 57.867 34.668 19.361 1.00 12.11 C ATOM 342 CG1 VAL A 47 59.225 34.104 19.770 1.00 12.15 C ATOM 343 CG2 VAL A 47 57.243 33.833 18.278 1.00 13.54 C ATOM 344 N ASN A 48 58.012 34.622 22.720 1.00 11.77 N ATOM 345 CA ASN A 48 58.647 35.154 23.906 1.00 12.84 C ATOM 346 C ASN A 48 60.149 35.201 23.725 1.00 12.99 C ATOM 347 O ASN A 48 60.780 34.199 23.401 1.00 14.34 O ATOM 348 CB ASN A 48 58.289 34.337 25.155 1.00 13.66 C ATOM 349 CG ASN A 48 58.647 35.067 26.430 1.00 18.27 C ATOM 350 OD1 ASN A 48 59.738 34.910 26.939 1.00 24.32 O ATOM 351 ND2 ASN A 48 57.731 35.888 26.916 1.00 26.90 N ATOM 352 N ILE A 49 60.718 36.384 23.911 1.00 12.88 N ATOM 353 CA ILE A 49 62.150 36.584 23.835 1.00 13.38 C ATOM 354 C ILE A 49 62.659 36.657 25.269 1.00 13.88 C ATOM 355 O ILE A 49 62.267 37.550 26.019 1.00 14.55 O ATOM 356 CB ILE A 49 62.448 37.870 23.044 1.00 13.29 C ATOM 357 CG1 ILE A 49 61.962 37.740 21.583 1.00 12.96 C ATOM 358 CG2 ILE A 49 63.923 38.219 23.087 1.00 13.53 C ATOM 359 CD1 ILE A 49 62.505 36.557 20.812 1.00 13.01 C ATOM 360 N PRO A 50 63.493 35.707 25.675 1.00 14.60 N ATOM 361 CA PRO A 50 63.815 35.589 27.106 1.00 15.52 C ATOM 362 C PRO A 50 64.730 36.674 27.663 1.00 16.73 C ATOM 363 O PRO A 50 64.699 36.949 28.861 1.00 18.25 O ATOM 364 CB PRO A 50 64.488 34.220 27.183 1.00 16.16 C ATOM 365 CG PRO A 50 65.075 34.013 25.851 1.00 15.95 C ATOM 366 CD PRO A 50 64.110 34.632 24.887 1.00 14.10 C ATOM 367 N SER A 51 65.530 37.300 26.810 1.00 16.50 N ATOM 368 CA SER A 51 66.496 38.284 27.262 1.00 16.93 C ATOM 369 C SER A 51 66.852 39.215 26.111 1.00 16.16 C ATOM 370 O SER A 51 66.858 38.814 24.946 1.00 15.89 O ATOM 371 CB SER A 51 67.746 37.593 27.778 1.00 18.05 C ATOM 372 OG SER A 51 68.343 36.785 26.790 1.00 21.13 O ATOM 373 N SER A 52 67.134 40.468 26.430 1.00 15.13 N ATOM 374 CA SER A 52 67.498 41.437 25.413 1.00 15.83 C ATOM 375 C SER A 52 68.870 41.114 24.866 1.00 15.36 C ATOM 376 O SER A 52 69.802 40.811 25.610 1.00 17.37 O ATOM 377 CB SER A 52 67.481 42.850 25.976 1.00 16.11 C ATOM 378 OG SER A 52 66.193 43.174 26.462 1.00 18.26 O ATOM 379 N GLY A 53 69.000 41.163 23.555 1.00 13.77 N ATOM 380 CA GLY A 53 70.255 40.908 22.907 1.00 13.34 C ATOM 381 C GLY A 53 70.126 40.382 21.502 1.00 12.81 C ATOM 382 O GLY A 53 69.093 40.520 20.836 1.00 13.11 O ATOM 383 N SER A 54 71.191 39.753 21.053 1.00 13.13 N ATOM 384 CA SER A 54 71.330 39.310 19.688 1.00 12.95 C ATOM 385 C SER A 54 70.609 37.987 19.471 1.00 12.78 C ATOM 386 O SER A 54 70.755 37.050 20.258 1.00 13.91 O ATOM 387 CB SER A 54 72.791 39.134 19.340 1.00 14.59 C ATOM 388 OG SER A 54 72.930 38.977 17.955 1.00 18.80 O ATOM 389 N TYR A 55 69.829 37.931 18.396 1.00 11.90 N ATOM 390 CA TYR A 55 69.148 36.723 17.937 1.00 11.72 C ATOM 391 C TYR A 55 69.452 36.520 16.469 1.00 11.87 C ATOM 392 O TYR A 55 69.566 37.478 15.703 1.00 12.75 O ATOM 393 CB TYR A 55 67.636 36.804 18.167 1.00 11.93 C ATOM 394 CG TYR A 55 67.345 36.753 19.630 1.00 11.87 C ATOM 395 CD1 TYR A 55 67.464 37.875 20.432 1.00 11.42 C ATOM 396 CD2 TYR A 55 67.001 35.555 20.233 1.00 12.44 C ATOM 397 CE1 TYR A 55 67.267 37.823 21.796 1.00 12.09 C ATOM 398 CE2 TYR A 55 66.795 35.482 21.599 1.00 12.70 C ATOM 399 CZ TYR A 55 66.931 36.609 22.373 1.00 12.85 C ATOM 400 OH TYR A 55 66.733 36.490 23.726 1.00 14.85 O ATOM 401 N LEU A 56 69.609 35.265 16.074 1.00 12.04 N ATOM 402 CA LEU A 56 69.836 34.875 14.695 1.00 12.08 C ATOM 403 C LEU A 56 68.500 34.458 14.092 1.00 11.50 C ATOM 404 O LEU A 56 67.846 33.530 14.583 1.00 12.00 O ATOM 405 CB LEU A 56 70.820 33.699 14.607 1.00 13.25 C ATOM 406 CG LEU A 56 71.156 33.223 13.190 1.00 15.59 C ATOM 407 CD1 LEU A 56 72.162 34.149 12.546 1.00 16.78 C ATOM 408 CD2 LEU A 56 71.656 31.774 13.174 1.00 18.80 C ATOM 409 N ILE A 57 68.094 35.137 13.037 1.00 10.90 N ATOM 410 CA ILE A 57 66.856 34.834 12.347 1.00 10.96 C ATOM 411 C ILE A 57 67.187 34.146 11.046 1.00 10.68 C ATOM 412 O ILE A 57 67.979 34.648 10.252 1.00 11.07 O ATOM 413 CB ILE A 57 65.996 36.100 12.064 1.00 10.68 C ATOM 414 CG1 ILE A 57 66.045 37.117 13.218 1.00 11.41 C ATOM 415 CG2 ILE A 57 64.570 35.672 11.744 1.00 11.98 C ATOM 416 CD1 ILE A 57 65.528 36.608 14.545 1.00 11.37 C ATOM 417 N GLU A 58 66.571 32.986 10.843 1.00 10.40 N ATOM 418 CA GLU A 58 66.733 32.180 9.638 1.00 10.63 C ATOM 419 C GLU A 58 65.464 32.163 8.806 1.00 10.07 C ATOM 420 O GLU A 58 64.366 32.142 9.353 1.00 10.53 O ATOM 421 CB GLU A 58 67.056 30.738 10.005 1.00 11.21 C ATOM 422 CG GLU A 58 68.386 30.549 10.707 1.00 13.18 C ATOM 423 CD GLU A 58 68.557 29.127 11.176 1.00 15.64 C ATOM 424 OE1 GLU A 58 69.430 28.414 10.634 1.00 20.66 O ATOM 425 OE2 GLU A 58 67.815 28.723 12.079 1.00 17.43 O ATOM 426 N TYR A 59 65.618 32.144 7.499 1.00 9.65 N ATOM 427 CA TYR A 59 64.511 32.126 6.560 1.00 10.16 C ATOM 428 C TYR A 59 64.749 31.013 5.561 1.00 10.31 C ATOM 429 O TYR A 59 65.825 30.941 4.971 1.00 11.08 O ATOM 430 CB TYR A 59 64.370 33.462 5.805 1.00 10.79 C ATOM 431 CG TYR A 59 64.352 34.686 6.697 1.00 10.68 C ATOM 432 CD1 TYR A 59 65.535 35.265 7.126 1.00 10.98 C ATOM 433 CD2 TYR A 59 63.166 35.220 7.155 1.00 11.34 C ATOM 434 CE1 TYR A 59 65.541 36.369 7.948 1.00 11.16 C ATOM 435 CE2 TYR A 59 63.163 36.318 8.000 1.00 11.60 C ATOM 436 CZ TYR A 59 64.346 36.886 8.383 1.00 11.81 C ATOM 437 OH TYR A 59 64.360 37.983 9.222 1.00 12.08 O ATOM 438 N ARG A 60 63.754 30.165 5.368 1.00 10.28 N ATOM 439 CA ARG A 60 63.839 29.081 4.389 1.00 10.96 C ATOM 440 C ARG A 60 63.188 29.581 3.121 1.00 10.84 C ATOM 441 O ARG A 60 61.991 29.769 3.090 1.00 10.51 O ATOM 442 CB ARG A 60 63.135 27.851 4.942 1.00 11.03 C ATOM 443 CG ARG A 60 63.294 26.579 4.093 1.00 11.43 C ATOM 444 CD ARG A 60 64.721 26.095 4.021 1.00 12.88 C ATOM 445 NE ARG A 60 64.813 24.791 3.356 1.00 13.28 N ATOM 446 CZ ARG A 60 65.963 24.187 3.087 1.00 14.46 C ATOM 447 NH1 ARG A 60 67.120 24.717 3.434 1.00 14.68 N ATOM 448 NH2 ARG A 60 65.928 23.007 2.477 1.00 16.30 N ATOM 449 N VAL A 61 63.996 29.829 2.092 1.00 11.02 N ATOM 450 CA VAL A 61 63.576 30.593 0.928 1.00 11.34 C ATOM 451 C VAL A 61 63.924 29.898 -0.379 1.00 11.62 C ATOM 452 O VAL A 61 64.816 29.043 -0.438 1.00 12.43 O ATOM 453 CB VAL A 61 64.226 31.994 0.904 1.00 11.39 C ATOM 454 CG1 VAL A 61 63.701 32.836 2.070 1.00 11.74 C ATOM 455 CG2 VAL A 61 65.759 31.922 0.907 1.00 11.79 C ATOM 456 N ALA A 62 63.191 30.245 -1.416 1.00 11.47 N ATOM 457 CA ALA A 62 63.473 29.779 -2.784 1.00 12.29 C ATOM 458 C ALA A 62 63.260 30.959 -3.703 1.00 13.22 C ATOM 459 O ALA A 62 62.386 31.795 -3.476 1.00 13.05 O ATOM 460 CB ALA A 62 62.548 28.625 -3.170 1.00 12.99 C ATOM 461 N SER A 63 64.052 31.062 -4.757 1.00 13.99 N ATOM 462 CA SER A 63 63.906 32.180 -5.679 1.00 14.42 C ATOM 463 C SER A 63 64.468 31.806 -7.050 1.00 15.31 C ATOM 464 O SER A 63 65.618 31.423 -7.158 1.00 15.84 O ATOM 465 CB SER A 63 64.633 33.404 -5.121 1.00 14.41 C ATOM 466 OG SER A 63 64.621 34.469 -6.041 1.00 15.11 O ATOM 467 N GLN A 64 63.647 31.924 -8.081 1.00 17.39 N ATOM 468 CA GLN A 64 64.101 31.572 -9.424 1.00 19.41 C ATOM 469 C GLN A 64 65.219 32.494 -9.899 1.00 20.05 C ATOM 470 O GLN A 64 66.253 32.023 -10.380 1.00 21.17 O ATOM 471 CB GLN A 64 62.928 31.601 -10.397 1.00 20.11 C ATOM 472 CG GLN A 64 63.309 31.281 -11.837 1.00 23.85 C ATOM 473 CD GLN A 64 63.716 29.843 -12.010 1.00 29.61 C ATOM 474 OE1 GLN A 64 62.934 28.937 -11.717 1.00 34.76 O ATOM 475 NE2 GLN A 64 64.936 29.621 -12.479 1.00 33.76 N ATOM 476 N ASN A 65 65.031 33.799 -9.751 1.00 19.99 N ATOM 477 CA ASN A 65 65.922 34.789 -10.369 1.00 21.08 C ATOM 478 C ASN A 65 66.643 35.737 -9.421 1.00 20.24 C ATOM 479 O ASN A 65 67.438 36.566 -9.861 1.00 20.37 O ATOM 480 CB ASN A 65 65.130 35.608 -11.380 1.00 21.70 C ATOM 481 CG ASN A 65 64.536 34.747 -12.467 1.00 24.28 C ATOM 482 OD1 ASN A 65 65.255 34.008 -13.141 1.00 28.99 O ATOM 483 ND2 ASN A 65 63.223 34.791 -12.609 1.00 28.27 N ATOM 484 N GLY A 66 66.385 35.631 -8.120 1.00 18.56 N ATOM 485 CA GLY A 66 67.013 36.514 -7.156 1.00 17.90 C ATOM 486 C GLY A 66 66.404 37.905 -7.171 1.00 16.96 C ATOM 487 O GLY A 66 65.353 38.140 -7.770 1.00 17.87 O ATOM 488 N GLY A 67 67.057 38.826 -6.474 1.00 16.39 N ATOM 489 CA GLY A 67 66.637 40.215 -6.465 1.00 16.19 C ATOM 490 C GLY A 67 65.723 40.631 -5.327 1.00 15.45 C ATOM 491 O GLY A 67 65.436 41.812 -5.178 1.00 16.79 O ATOM 492 N GLY A 68 65.239 39.676 -4.546 1.00 14.76 N ATOM 493 CA GLY A 68 64.301 39.966 -3.478 1.00 13.58 C ATOM 494 C GLY A 68 64.973 40.478 -2.222 1.00 12.98 C ATOM 495 O GLY A 68 66.158 40.319 -2.004 1.00 13.03 O ATOM 496 N SER A 69 64.158 41.045 -1.352 1.00 12.29 N ATOM 497 CA SER A 69 64.607 41.438 -0.024 1.00 12.09 C ATOM 498 C SER A 69 63.397 41.555 0.889 1.00 11.53 C ATOM 499 O SER A 69 62.258 41.790 0.428 1.00 11.94 O ATOM 500 CB SER A 69 65.395 42.751 -0.074 1.00 12.57 C ATOM 501 OG SER A 69 64.612 43.769 -0.652 1.00 14.55 O ATOM 502 N LEU A 70 63.642 41.372 2.180 1.00 10.98 N ATOM 503 CA LEU A 70 62.606 41.530 3.173 1.00 11.15 C ATOM 504 C LEU A 70 63.083 42.294 4.388 1.00 11.41 C ATOM 505 O LEU A 70 64.294 42.415 4.640 1.00 11.75 O ATOM 506 CB LEU A 70 62.033 40.170 3.591 1.00 11.83 C ATOM 507 CG LEU A 70 62.916 39.206 4.393 1.00 12.66 C ATOM 508 CD1 LEU A 70 63.000 39.570 5.890 1.00 12.01 C ATOM 509 CD2 LEU A 70 62.393 37.789 4.257 1.00 12.23 C ATOM 510 N THR A 71 62.100 42.781 5.130 1.00 10.55 N ATOM 511 CA THR A 71 62.296 43.439 6.410 1.00 11.42 C ATOM 512 C THR A 71 61.591 42.594 7.466 1.00 10.94 C ATOM 513 O THR A 71 60.436 42.212 7.286 1.00 11.91 O ATOM 514 CB THR A 71 61.702 44.858 6.364 1.00 11.75 C ATOM 515 OG1 THR A 71 62.447 45.669 5.430 1.00 13.02 O ATOM 516 CG2 THR A 71 61.862 45.567 7.687 1.00 13.33 C ATOM 517 N PHE A 72 62.309 42.258 8.531 1.00 10.35 N ATOM 518 CA PHE A 72 61.779 41.582 9.705 1.00 9.95 C ATOM 519 C PHE A 72 61.499 42.648 10.739 1.00 10.29 C ATOM 520 O PHE A 72 62.373 43.483 11.055 1.00 10.27 O ATOM 521 CB PHE A 72 62.821 40.581 10.213 1.00 9.91 C ATOM 522 CG PHE A 72 62.383 39.750 11.385 1.00 10.04 C ATOM 523 CD1 PHE A 72 61.279 38.918 11.296 1.00 11.31 C ATOM 524 CD2 PHE A 72 63.116 39.737 12.553 1.00 10.89 C ATOM 525 CE1 PHE A 72 60.904 38.102 12.377 1.00 12.95 C ATOM 526 CE2 PHE A 72 62.728 38.955 13.640 1.00 12.23 C ATOM 527 CZ PHE A 72 61.628 38.140 13.540 1.00 12.44 C ATOM 528 N GLU A 73 60.288 42.669 11.255 1.00 10.85 N ATOM 529 CA GLU A 73 59.837 43.788 12.070 1.00 11.43 C ATOM 530 C GLU A 73 58.827 43.328 13.077 1.00 11.48 C ATOM 531 O GLU A 73 58.378 42.180 13.072 1.00 10.99 O ATOM 532 CB GLU A 73 59.222 44.892 11.184 1.00 12.67 C ATOM 533 CG GLU A 73 58.086 44.437 10.297 1.00 14.94 C ATOM 534 CD GLU A 73 57.659 45.453 9.264 1.00 19.63 C ATOM 535 OE1 GLU A 73 58.510 46.253 8.822 1.00 22.87 O ATOM 536 OE2 GLU A 73 56.475 45.419 8.876 1.00 21.86 O ATOM 537 N GLU A 74 58.447 44.233 13.960 1.00 11.61 N ATOM 538 CA GLU A 74 57.304 44.030 14.798 1.00 13.21 C ATOM 539 C GLU A 74 56.072 44.250 13.923 1.00 14.03 C ATOM 540 O GLU A 74 56.067 45.156 13.074 1.00 14.92 O ATOM 541 CB GLU A 74 57.380 45.010 15.978 1.00 13.87 C ATOM 542 CG GLU A 74 56.740 44.548 17.271 1.00 16.29 C ATOM 543 CD GLU A 74 57.400 43.336 17.901 1.00 16.43 C ATOM 544 OE1 GLU A 74 58.499 42.870 17.494 1.00 17.28 O ATOM 545 OE2 GLU A 74 56.798 42.864 18.866 1.00 17.20 O ATOM 546 N ALA A 75 55.048 43.420 14.090 1.00 15.87 N ATOM 547 CA ALA A 75 53.825 43.557 13.315 1.00 16.99 C ATOM 548 C ALA A 75 53.315 45.002 13.413 1.00 18.55 C ATOM 549 O ALA A 75 53.258 45.561 14.504 1.00 18.86 O ATOM 550 CB ALA A 75 52.766 42.579 13.816 1.00 17.54 C ATOM 551 N GLY A 76 52.993 45.593 12.268 1.00 20.04 N ATOM 552 CA GLY A 76 52.606 46.997 12.202 1.00 21.02 C ATOM 553 C GLY A 76 53.715 47.894 11.678 1.00 21.82 C ATOM 554 O GLY A 76 53.470 49.050 11.301 1.00 22.85 O ATOM 555 N GLY A 77 54.952 47.401 11.664 1.00 21.59 N ATOM 556 CA GLY A 77 56.067 48.125 11.085 1.00 21.66 C ATOM 557 C GLY A 77 57.004 48.872 12.015 1.00 21.24 C ATOM 558 O GLY A 77 57.952 49.493 11.529 1.00 22.71 O ATOM 559 N ALA A 78 56.782 48.828 13.322 1.00 19.91 N ATOM 560 CA ALA A 78 57.672 49.498 14.267 1.00 19.89 C ATOM 561 C ALA A 78 57.744 48.774 15.619 1.00 18.41 C ATOM 562 O ALA A 78 56.703 48.424 16.168 1.00 19.87 O ATOM 563 CB ALA A 78 57.211 50.944 14.458 1.00 20.87 C ATOM 564 N PRO A 79 58.934 48.513 16.167 1.00 17.13 N ATOM 565 CA PRO A 79 60.220 48.770 15.515 1.00 16.08 C ATOM 566 C PRO A 79 60.540 47.773 14.423 1.00 14.54 C ATOM 567 O PRO A 79 59.988 46.668 14.372 1.00 15.38 O ATOM 568 CB PRO A 79 61.222 48.585 16.645 1.00 16.67 C ATOM 569 CG PRO A 79 60.580 47.610 17.536 1.00 18.07 C ATOM 570 CD PRO A 79 59.131 47.950 17.505 1.00 17.40 C ATOM 571 N VAL A 80 61.419 48.172 13.533 1.00 12.93 N ATOM 572 CA VAL A 80 62.025 47.291 12.559 1.00 12.53 C ATOM 573 C VAL A 80 63.239 46.632 13.186 1.00 11.79 C ATOM 574 O VAL A 80 64.051 47.283 13.849 1.00 12.66 O ATOM 575 CB VAL A 80 62.429 48.057 11.282 1.00 12.87 C ATOM 576 CG1 VAL A 80 63.254 47.194 10.360 1.00 13.67 C ATOM 577 CG2 VAL A 80 61.186 48.550 10.576 1.00 14.49 C ATOM 578 N HIS A 81 63.384 45.326 12.971 1.00 11.05 N ATOM 579 CA HIS A 81 64.501 44.552 13.509 1.00 10.65 C ATOM 580 C HIS A 81 65.659 44.375 12.526 1.00 10.77 C ATOM 581 O HIS A 81 66.822 44.467 12.908 1.00 11.48 O ATOM 582 CB HIS A 81 64.002 43.188 13.981 1.00 10.77 C ATOM 583 CG HIS A 81 62.819 43.267 14.888 1.00 11.40 C ATOM 584 ND1 HIS A 81 62.797 44.062 16.007 1.00 12.04 N ATOM 585 CD2 HIS A 81 61.634 42.613 14.860 1.00 11.56 C ATOM 586 CE1 HIS A 81 61.639 43.910 16.624 1.00 11.51 C ATOM 587 NE2 HIS A 81 60.910 43.039 15.946 1.00 12.46 N ATOM 588 N GLY A 82 65.376 44.118 11.268 1.00 10.59 N ATOM 589 CA GLY A 82 66.453 43.934 10.316 1.00 11.02 C ATOM 590 C GLY A 82 65.982 43.719 8.917 1.00 11.55 C ATOM 591 O GLY A 82 64.789 43.614 8.681 1.00 12.47 O ATOM 592 N THR A 83 66.923 43.672 7.993 1.00 10.92 N ATOM 593 CA THR A 83 66.660 43.453 6.570 1.00 11.23 C ATOM 594 C THR A 83 67.612 42.393 6.051 1.00 10.71 C ATOM 595 O THR A 83 68.695 42.186 6.605 1.00 11.54 O ATOM 596 CB THR A 83 66.847 44.742 5.747 1.00 11.44 C ATOM 597 OG1 THR A 83 68.190 45.237 5.903 1.00 11.76 O ATOM 598 CG2 THR A 83 65.900 45.852 6.179 1.00 12.02 C ATOM 599 N ILE A 84 67.215 41.738 4.970 1.00 10.46 N ATOM 600 CA ILE A 84 68.031 40.700 4.376 1.00 10.95 C ATOM 601 C ILE A 84 67.715 40.564 2.887 1.00 11.20 C ATOM 602 O ILE A 84 66.566 40.640 2.451 1.00 11.66 O ATOM 603 CB ILE A 84 67.836 39.346 5.151 1.00 11.24 C ATOM 604 CG1 ILE A 84 68.884 38.335 4.727 1.00 12.54 C ATOM 605 CG2 ILE A 84 66.438 38.788 4.952 1.00 12.80 C ATOM 606 CD1 ILE A 84 68.859 37.080 5.562 1.00 13.52 C ATOM 607 N ALA A 85 68.774 40.390 2.112 1.00 12.48 N ATOM 608 CA ALA A 85 68.676 40.103 0.696 1.00 13.70 C ATOM 609 C ALA A 85 68.434 38.604 0.479 1.00 13.94 C ATOM 610 O ALA A 85 68.975 37.753 1.178 1.00 14.31 O ATOM 611 CB ALA A 85 69.945 40.515 -0.005 1.00 14.67 C ATOM 612 N ILE A 86 67.632 38.295 -0.526 1.00 14.19 N ATOM 613 CA ILE A 86 67.269 36.927 -0.814 1.00 14.92 C ATOM 614 C ILE A 86 67.891 36.518 -2.144 1.00 15.46 C ATOM 615 O ILE A 86 67.518 37.039 -3.191 1.00 15.59 O ATOM 616 CB ILE A 86 65.769 36.807 -0.820 1.00 15.30 C ATOM 617 CG1 ILE A 86 65.246 37.312 0.545 1.00 17.74 C ATOM 618 CG2 ILE A 86 65.366 35.378 -1.107 1.00 15.87 C ATOM 619 CD1 ILE A 86 63.892 37.757 0.527 1.00 18.99 C ATOM 620 N PRO A 87 68.827 35.570 -2.092 1.00 16.80 N ATOM 621 CA PRO A 87 69.592 35.174 -3.272 1.00 17.08 C ATOM 622 C PRO A 87 68.769 34.313 -4.218 1.00 16.93 C ATOM 623 O PRO A 87 67.797 33.705 -3.804 1.00 16.72 O ATOM 624 CB PRO A 87 70.705 34.330 -2.665 1.00 17.83 C ATOM 625 CG PRO A 87 70.066 33.675 -1.504 1.00 18.71 C ATOM 626 CD PRO A 87 69.175 34.738 -0.925 1.00 17.04 C ATOM 627 N ALA A 88 69.157 34.257 -5.486 1.00 17.22 N ATOM 628 CA ALA A 88 68.627 33.240 -6.376 1.00 17.84 C ATOM 629 C ALA A 88 69.044 31.859 -5.870 1.00 18.10 C ATOM 630 O ALA A 88 70.159 31.682 -5.380 1.00 18.74 O ATOM 631 CB ALA A 88 69.131 33.450 -7.800 1.00 18.20 C ATOM 632 N THR A 89 68.117 30.912 -5.947 1.00 18.57 N ATOM 633 CA THR A 89 68.381 29.509 -5.646 1.00 19.92 C ATOM 634 C THR A 89 68.271 28.633 -6.896 1.00 21.25 C ATOM 635 O THR A 89 68.565 27.448 -6.830 1.00 24.14 O ATOM 636 CB THR A 89 67.413 28.991 -4.571 1.00 19.72 C ATOM 637 OG1 THR A 89 66.073 29.019 -5.066 1.00 17.31 O ATOM 638 CG2 THR A 89 67.419 29.882 -3.348 1.00 19.79 C ATOM 639 N GLY A 90 67.805 29.206 -7.996 1.00 22.48 N ATOM 640 CA GLY A 90 67.710 28.500 -9.268 1.00 23.08 C ATOM 641 C GLY A 90 66.350 27.902 -9.539 1.00 22.79 C ATOM 642 O GLY A 90 66.099 27.360 -10.617 1.00 24.57 O ATOM 643 N GLY A 91 65.439 28.000 -8.577 1.00 20.73 N ATOM 644 CA GLY A 91 64.100 27.517 -8.811 1.00 19.06 C ATOM 645 C GLY A 91 63.142 27.876 -7.699 1.00 18.01 C ATOM 646 O GLY A 91 63.560 28.114 -6.567 1.00 16.91 O ATOM 647 N TRP A 92 61.863 27.865 -8.030 1.00 16.53 N ATOM 648 CA TRP A 92 60.795 28.216 -7.093 1.00 16.34 C ATOM 649 C TRP A 92 60.621 27.186 -5.991 1.00 16.02 C ATOM 650 O TRP A 92 60.016 27.464 -4.960 1.00 15.15 O ATOM 651 CB TRP A 92 59.470 28.374 -7.844 1.00 15.81 C ATOM 652 CG TRP A 92 59.416 29.584 -8.727 1.00 17.07 C ATOM 653 CD1 TRP A 92 59.237 29.612 -10.086 1.00 18.91 C ATOM 654 CD2 TRP A 92 59.518 30.949 -8.314 1.00 16.46 C ATOM 655 NE1 TRP A 92 59.227 30.911 -10.533 1.00 19.69 N ATOM 656 CE2 TRP A 92 59.399 31.751 -9.464 1.00 18.41 C ATOM 657 CE3 TRP A 92 59.706 31.583 -7.075 1.00 16.72 C ATOM 658 CZ2 TRP A 92 59.450 33.142 -9.412 1.00 19.41 C ATOM 659 CZ3 TRP A 92 59.762 32.956 -7.033 1.00 17.77 C ATOM 660 CH2 TRP A 92 59.630 33.718 -8.186 1.00 18.68 C ATOM 661 N GLN A 93 61.118 25.968 -6.215 1.00 15.66 N ATOM 662 CA GLN A 93 61.111 24.942 -5.183 1.00 15.81 C ATOM 663 C GLN A 93 62.507 24.378 -4.948 1.00 15.82 C ATOM 664 O GLN A 93 62.658 23.209 -4.578 1.00 16.57 O ATOM 665 CB GLN A 93 60.114 23.831 -5.507 1.00 15.69 C ATOM 666 CG GLN A 93 58.675 24.303 -5.511 1.00 15.54 C ATOM 667 CD GLN A 93 58.127 24.651 -4.115 1.00 14.41 C ATOM 668 OE1 GLN A 93 58.525 24.072 -3.122 1.00 14.23 O ATOM 669 NE2 GLN A 93 57.182 25.591 -4.068 1.00 15.66 N ATOM 670 N THR A 94 63.526 25.212 -5.143 1.00 15.52 N ATOM 671 CA THR A 94 64.894 24.890 -4.774 1.00 16.40 C ATOM 672 C THR A 94 65.195 25.756 -3.554 1.00 15.40 C ATOM 673 O THR A 94 65.262 26.977 -3.664 1.00 16.14 O ATOM 674 CB THR A 94 65.855 25.163 -5.918 1.00 16.91 C ATOM 675 OG1 THR A 94 65.473 24.372 -7.066 1.00 19.38 O ATOM 676 CG2 THR A 94 67.255 24.707 -5.549 1.00 19.36 C ATOM 677 N TRP A 95 65.317 25.105 -2.407 1.00 14.84 N ATOM 678 CA TRP A 95 65.281 25.766 -1.104 1.00 14.50 C ATOM 679 C TRP A 95 66.642 25.907 -0.479 1.00 14.95 C ATOM 680 O TRP A 95 67.506 25.027 -0.607 1.00 15.87 O ATOM 681 CB TRP A 95 64.346 24.995 -0.169 1.00 14.77 C ATOM 682 CG TRP A 95 62.968 25.037 -0.668 1.00 13.52 C ATOM 683 CD1 TRP A 95 62.347 24.129 -1.483 1.00 13.89 C ATOM 684 CD2 TRP A 95 62.016 26.079 -0.446 1.00 11.95 C ATOM 685 NE1 TRP A 95 61.079 24.549 -1.781 1.00 13.74 N ATOM 686 CE2 TRP A 95 60.852 25.756 -1.163 1.00 12.85 C ATOM 687 CE3 TRP A 95 62.042 27.274 0.280 1.00 11.71 C ATOM 688 CZ2 TRP A 95 59.726 26.566 -1.163 1.00 12.94 C ATOM 689 CZ3 TRP A 95 60.931 28.080 0.271 1.00 12.63 C ATOM 690 CH2 TRP A 95 59.786 27.727 -0.437 1.00 13.45 C ATOM 691 N THR A 96 66.856 27.022 0.205 1.00 13.75 N ATOM 692 CA THR A 96 68.050 27.242 1.001 1.00 14.87 C ATOM 693 C THR A 96 67.676 28.034 2.245 1.00 13.66 C ATOM 694 O THR A 96 66.616 28.666 2.299 1.00 14.20 O ATOM 695 CB THR A 96 69.083 27.987 0.161 1.00 15.24 C ATOM 696 OG1 THR A 96 70.378 27.897 0.771 1.00 19.30 O ATOM 697 CG2 THR A 96 68.776 29.465 0.062 1.00 16.70 C ATOM 698 N THR A 97 68.531 28.003 3.244 1.00 13.40 N ATOM 699 CA THR A 97 68.304 28.740 4.484 1.00 12.74 C ATOM 700 C THR A 97 69.278 29.897 4.529 1.00 13.32 C ATOM 701 O THR A 97 70.486 29.699 4.394 1.00 14.75 O ATOM 702 CB THR A 97 68.500 27.830 5.679 1.00 13.37 C ATOM 703 OG1 THR A 97 67.567 26.750 5.574 1.00 13.85 O ATOM 704 CG2 THR A 97 68.167 28.545 6.984 1.00 14.32 C ATOM 705 N ILE A 98 68.753 31.116 4.653 1.00 12.21 N ATOM 706 CA ILE A 98 69.567 32.325 4.833 1.00 12.25 C ATOM 707 C ILE A 98 69.361 32.862 6.246 1.00 11.68 C ATOM 708 O ILE A 98 68.434 32.449 6.953 1.00 11.24 O ATOM 709 CB ILE A 98 69.207 33.393 3.777 1.00 12.69 C ATOM 710 CG1 ILE A 98 67.754 33.859 3.920 1.00 13.24 C ATOM 711 CG2 ILE A 98 69.486 32.864 2.364 1.00 14.39 C ATOM 712 CD1 ILE A 98 67.358 34.983 2.992 1.00 13.27 C ATOM 713 N GLN A 99 70.230 33.751 6.679 1.00 11.90 N ATOM 714 CA GLN A 99 70.191 34.223 8.048 1.00 12.67 C ATOM 715 C GLN A 99 70.807 35.584 8.222 1.00 12.30 C ATOM 716 O GLN A 99 71.645 36.015 7.433 1.00 11.91 O ATOM 717 CB GLN A 99 70.882 33.224 8.976 1.00 13.81 C ATOM 718 CG GLN A 99 72.359 33.075 8.716 1.00 16.82 C ATOM 719 CD GLN A 99 72.635 32.352 7.420 1.00 24.29 C ATOM 720 OE1 GLN A 99 72.179 31.217 7.220 1.00 29.41 O ATOM 721 NE2 GLN A 99 73.363 33.008 6.520 1.00 28.88 N ATOM 722 N HIS A 100 70.374 36.249 9.286 1.00 11.82 N ATOM 723 CA HIS A 100 71.004 37.473 9.769 1.00 11.83 C ATOM 724 C HIS A 100 70.783 37.613 11.251 1.00 12.01 C ATOM 725 O HIS A 100 70.023 36.845 11.828 1.00 12.92 O ATOM 726 CB HIS A 100 70.508 38.707 9.045 1.00 12.41 C ATOM 727 CG HIS A 100 69.069 39.097 9.266 1.00 11.94 C ATOM 728 ND1 HIS A 100 67.991 38.243 9.375 1.00 14.90 N ATOM 729 CD2 HIS A 100 68.535 40.336 9.277 1.00 10.81 C ATOM 730 CE1 HIS A 100 66.874 38.951 9.505 1.00 9.56 C ATOM 731 NE2 HIS A 100 67.186 40.222 9.446 1.00 16.11 N ATOM 732 N THR A 101 71.467 38.564 11.880 1.00 11.97 N ATOM 733 CA THR A 101 71.280 38.854 13.289 1.00 12.84 C ATOM 734 C THR A 101 70.536 40.155 13.475 1.00 12.75 C ATOM 735 O THR A 101 70.655 41.112 12.675 1.00 14.09 O ATOM 736 CB THR A 101 72.601 38.942 14.045 1.00 13.06 C ATOM 737 OG1 THR A 101 73.393 39.998 13.489 1.00 16.50 O ATOM 738 CG2 THR A 101 73.378 37.643 13.910 1.00 14.06 C ATOM 739 N VAL A 102 69.778 40.196 14.548 1.00 11.70 N ATOM 740 CA VAL A 102 69.064 41.386 14.961 1.00 11.78 C ATOM 741 C VAL A 102 69.183 41.502 16.469 1.00 12.00 C ATOM 742 O VAL A 102 69.469 40.509 17.146 1.00 12.96 O ATOM 743 CB VAL A 102 67.580 41.319 14.568 1.00 12.40 C ATOM 744 CG1 VAL A 102 67.420 41.146 13.060 1.00 12.72 C ATOM 745 CG2 VAL A 102 66.847 40.194 15.311 1.00 12.45 C ATOM 746 N ASN A 103 68.951 42.695 17.000 1.00 11.67 N ATOM 747 CA ASN A 103 68.747 42.881 18.427 1.00 11.75 C ATOM 748 C ASN A 103 67.265 42.825 18.722 1.00 12.33 C ATOM 749 O ASN A 103 66.470 43.432 18.001 1.00 13.22 O ATOM 750 CB ASN A 103 69.302 44.238 18.871 1.00 11.71 C ATOM 751 CG ASN A 103 69.028 44.526 20.316 1.00 12.64 C ATOM 752 OD1 ASN A 103 68.215 45.417 20.654 1.00 16.33 O ATOM 753 ND2 ASN A 103 69.631 43.763 21.166 1.00 12.73 N ATOM 754 N LEU A 104 66.871 42.094 19.763 1.00 12.01 N ATOM 755 CA LEU A 104 65.491 42.052 20.219 1.00 12.28 C ATOM 756 C LEU A 104 65.452 42.341 21.703 1.00 13.13 C ATOM 757 O LEU A 104 66.284 41.850 22.454 1.00 13.78 O ATOM 758 CB LEU A 104 64.863 40.684 19.957 1.00 12.39 C ATOM 759 CG LEU A 104 64.761 40.262 18.493 1.00 11.57 C ATOM 760 CD1 LEU A 104 64.278 38.818 18.408 1.00 11.94 C ATOM 761 CD2 LEU A 104 63.840 41.170 17.731 1.00 13.14 C ATOM 762 N SER A 105 64.464 43.103 22.121 1.00 14.21 N ATOM 763 CA SER A 105 64.216 43.336 23.530 1.00 14.90 C ATOM 764 C SER A 105 63.526 42.140 24.161 1.00 15.45 C ATOM 765 O SER A 105 62.762 41.416 23.528 1.00 15.41 O ATOM 766 CB SER A 105 63.340 44.575 23.707 1.00 15.34 C ATOM 767 OG SER A 105 62.110 44.430 23.029 1.00 19.44 O ATOM 768 N ALA A 106 63.783 41.936 25.445 1.00 15.58 N ATOM 769 CA ALA A 106 63.112 40.875 26.183 1.00 15.70 C ATOM 770 C ALA A 106 61.607 41.111 26.222 1.00 15.98 C ATOM 771 O ALA A 106 61.141 42.247 26.303 1.00 17.43 O ATOM 772 CB ALA A 106 63.637 40.812 27.601 1.00 16.01 C ATOM 773 N GLY A 107 60.854 40.016 26.199 1.00 15.71 N ATOM 774 CA GLY A 107 59.413 40.055 26.360 1.00 15.74 C ATOM 775 C GLY A 107 58.683 39.446 25.184 1.00 15.22 C ATOM 776 O GLY A 107 59.283 38.799 24.334 1.00 14.23 O ATOM 777 N SER A 108 57.380 39.677 25.135 1.00 14.53 N ATOM 778 CA SER A 108 56.520 39.109 24.122 1.00 14.73 C ATOM 779 C SER A 108 56.561 39.970 22.863 1.00 14.72 C ATOM 780 O SER A 108 56.378 41.195 22.930 1.00 17.23 O ATOM 781 CB SER A 108 55.098 39.004 24.644 1.00 14.69 C ATOM 782 OG SER A 108 54.295 38.283 23.741 1.00 17.07 O ATOM 783 N HIS A 109 56.848 39.349 21.730 1.00 13.09 N ATOM 784 CA HIS A 109 56.919 40.012 20.442 1.00 12.76 C ATOM 785 C HIS A 109 55.876 39.478 19.488 1.00 12.34 C ATOM 786 O HIS A 109 55.573 38.284 19.478 1.00 13.17 O ATOM 787 CB HIS A 109 58.289 39.785 19.796 1.00 12.86 C ATOM 788 CG HIS A 109 59.376 40.629 20.364 1.00 12.58 C ATOM 789 ND1 HIS A 109 59.856 41.738 19.706 1.00 14.51 N ATOM 790 CD2 HIS A 109 60.070 40.545 21.524 1.00 12.91 C ATOM 791 CE1 HIS A 109 60.814 42.292 20.430 1.00 15.10 C ATOM 792 NE2 HIS A 109 60.956 41.597 21.543 1.00 15.28 N ATOM 793 N GLN A 110 55.340 40.348 18.657 1.00 12.02 N ATOM 794 CA GLN A 110 54.493 39.969 17.549 1.00 12.12 C ATOM 795 C GLN A 110 55.250 40.352 16.300 1.00 12.08 C ATOM 796 O GLN A 110 55.506 41.535 16.075 1.00 14.24 O ATOM 797 CB GLN A 110 53.185 40.737 17.652 1.00 12.76 C ATOM 798 CG GLN A 110 52.339 40.268 18.830 1.00 14.94 C ATOM 799 CD GLN A 110 51.149 41.144 19.108 1.00 20.34 C ATOM 800 OE1 GLN A 110 51.294 42.236 19.657 1.00 25.32 O ATOM 801 NE2 GLN A 110 49.971 40.660 18.765 1.00 24.03 N ATOM 802 N PHE A 111 55.678 39.372 15.523 1.00 10.39 N ATOM 803 CA PHE A 111 56.549 39.615 14.398 1.00 10.54 C ATOM 804 C PHE A 111 55.785 39.740 13.096 1.00 10.34 C ATOM 805 O PHE A 111 54.695 39.185 12.941 1.00 11.14 O ATOM 806 CB PHE A 111 57.575 38.484 14.285 1.00 10.83 C ATOM 807 CG PHE A 111 58.567 38.450 15.415 1.00 10.83 C ATOM 808 CD1 PHE A 111 58.690 37.321 16.216 1.00 13.61 C ATOM 809 CD2 PHE A 111 59.398 39.529 15.664 1.00 11.52 C ATOM 810 CE1 PHE A 111 59.638 37.285 17.244 1.00 13.52 C ATOM 811 CE2 PHE A 111 60.321 39.487 16.694 1.00 11.92 C ATOM 812 CZ PHE A 111 60.449 38.357 17.471 1.00 13.79 C ATOM 813 N GLY A 112 56.385 40.423 12.141 1.00 10.98 N ATOM 814 CA GLY A 112 55.891 40.506 10.785 1.00 11.29 C ATOM 815 C GLY A 112 57.038 40.537 9.790 1.00 11.06 C ATOM 816 O GLY A 112 58.188 40.813 10.162 1.00 11.30 O ATOM 817 N ILE A 113 56.729 40.242 8.537 1.00 11.17 N ATOM 818 CA ILE A 113 57.680 40.297 7.433 1.00 11.46 C ATOM 819 C ILE A 113 57.086 41.183 6.362 1.00 11.38 C ATOM 820 O ILE A 113 55.935 41.004 5.989 1.00 11.75 O ATOM 821 CB ILE A 113 57.945 38.898 6.884 1.00 12.32 C ATOM 822 CG1 ILE A 113 58.756 38.109 7.914 1.00 15.98 C ATOM 823 CG2 ILE A 113 58.719 38.954 5.569 1.00 13.49 C ATOM 824 CD1 ILE A 113 58.932 36.681 7.603 1.00 19.19 C ATOM 825 N LYS A 114 57.869 42.134 5.875 1.00 11.49 N ATOM 826 CA LYS A 114 57.476 43.018 4.774 1.00 12.75 C ATOM 827 C LYS A 114 58.410 42.756 3.610 1.00 12.14 C ATOM 828 O LYS A 114 59.613 42.767 3.770 1.00 11.91 O ATOM 829 CB LYS A 114 57.564 44.491 5.220 1.00 13.70 C ATOM 830 CG LYS A 114 57.420 45.541 4.109 1.00 18.07 C ATOM 831 CD LYS A 114 56.010 45.625 3.573 1.00 23.39 C ATOM 832 CE LYS A 114 55.645 47.008 3.020 1.00 26.93 C ATOM 833 NZ LYS A 114 56.754 48.002 2.957 1.00 29.25 N ATOM 834 N ALA A 115 57.849 42.487 2.432 1.00 11.69 N ATOM 835 CA ALA A 115 58.637 42.319 1.228 1.00 12.04 C ATOM 836 C ALA A 115 58.991 43.686 0.652 1.00 12.98 C ATOM 837 O ALA A 115 58.115 44.464 0.285 1.00 13.08 O ATOM 838 CB ALA A 115 57.847 41.502 0.207 1.00 12.09 C ATOM 839 N ASN A 116 60.276 43.966 0.568 1.00 12.61 N ATOM 840 CA ASN A 116 60.730 45.203 -0.068 1.00 13.45 C ATOM 841 C ASN A 116 60.883 45.044 -1.577 1.00 14.33 C ATOM 842 O ASN A 116 60.755 46.012 -2.343 1.00 16.05 O ATOM 843 CB ASN A 116 62.030 45.637 0.576 1.00 13.15 C ATOM 844 CG ASN A 116 61.904 45.815 2.077 1.00 14.46 C ATOM 845 OD1 ASN A 116 61.174 46.700 2.563 1.00 19.71 O ATOM 846 ND2 ASN A 116 62.610 45.005 2.812 1.00 12.81 N ATOM 847 N ALA A 117 61.150 43.820 -2.002 1.00 14.52 N ATOM 848 CA ALA A 117 61.228 43.454 -3.414 1.00 14.50 C ATOM 849 C ALA A 117 60.854 41.992 -3.471 1.00 14.16 C ATOM 850 O ALA A 117 61.241 41.231 -2.577 1.00 14.49 O ATOM 851 CB ALA A 117 62.611 43.649 -3.943 1.00 15.17 C ATOM 852 N GLY A 118 60.099 41.599 -4.480 1.00 14.20 N ATOM 853 CA GLY A 118 59.614 40.241 -4.597 1.00 14.77 C ATOM 854 C GLY A 118 60.554 39.301 -5.314 1.00 14.27 C ATOM 855 O GLY A 118 61.756 39.552 -5.397 1.00 14.33 O ATOM 856 N GLY A 119 59.991 38.196 -5.807 1.00 13.98 N ATOM 857 CA GLY A 119 60.742 37.206 -6.556 1.00 14.58 C ATOM 858 C GLY A 119 61.194 35.979 -5.784 1.00 13.70 C ATOM 859 O GLY A 119 62.082 35.243 -6.225 1.00 14.83 O ATOM 860 N TRP A 120 60.590 35.760 -4.613 1.00 13.09 N ATOM 861 CA TRP A 120 60.996 34.671 -3.723 1.00 12.99 C ATOM 862 C TRP A 120 59.772 34.055 -3.047 1.00 12.22 C ATOM 863 O TRP A 120 58.710 34.669 -2.971 1.00 12.40 O ATOM 864 CB TRP A 120 61.997 35.167 -2.665 1.00 13.25 C ATOM 865 CG TRP A 120 61.566 36.415 -1.956 1.00 11.97 C ATOM 866 CD1 TRP A 120 61.619 37.678 -2.454 1.00 13.27 C ATOM 867 CD2 TRP A 120 60.982 36.532 -0.650 1.00 10.96 C ATOM 868 NE1 TRP A 120 61.132 38.569 -1.538 1.00 12.91 N ATOM 869 CE2 TRP A 120 60.727 37.898 -0.418 1.00 12.14 C ATOM 870 CE3 TRP A 120 60.685 35.627 0.370 1.00 12.08 C ATOM 871 CZ2 TRP A 120 60.174 38.370 0.762 1.00 12.24 C ATOM 872 CZ3 TRP A 120 60.136 36.107 1.543 1.00 12.73 C ATOM 873 CH2 TRP A 120 59.892 37.468 1.730 1.00 13.52 C ATOM 874 N ASN A 121 59.965 32.828 -2.562 1.00 11.37 N ATOM 875 CA ASN A 121 59.003 32.070 -1.779 1.00 11.16 C ATOM 876 C ASN A 121 59.565 31.860 -0.375 1.00 10.88 C ATOM 877 O ASN A 121 60.777 31.871 -0.174 1.00 10.74 O ATOM 878 CB ASN A 121 58.790 30.680 -2.388 1.00 11.93 C ATOM 879 CG ASN A 121 58.096 30.704 -3.734 1.00 11.86 C ATOM 880 OD1 ASN A 121 58.228 29.745 -4.554 1.00 16.06 O ATOM 881 ND2 ASN A 121 57.326 31.718 -3.973 1.00 10.11 N ATOM 882 N LEU A 122 58.686 31.629 0.595 1.00 10.55 N ATOM 883 CA LEU A 122 59.071 31.487 1.999 1.00 9.94 C ATOM 884 C LEU A 122 58.383 30.274 2.610 1.00 10.05 C ATOM 885 O LEU A 122 57.169 30.184 2.574 1.00 10.23 O ATOM 886 CB LEU A 122 58.693 32.760 2.787 1.00 10.01 C ATOM 887 CG LEU A 122 59.167 32.798 4.240 1.00 10.26 C ATOM 888 CD1 LEU A 122 60.665 32.825 4.392 1.00 11.59 C ATOM 889 CD2 LEU A 122 58.536 33.979 4.966 1.00 10.83 C ATOM 890 N ASN A 123 59.168 29.354 3.167 1.00 9.95 N ATOM 891 CA ASN A 123 58.630 28.137 3.778 1.00 10.60 C ATOM 892 C ASN A 123 58.388 28.313 5.279 1.00 10.29 C ATOM 893 O ASN A 123 57.320 27.958 5.786 1.00 10.53 O ATOM 894 CB ASN A 123 59.566 26.954 3.481 1.00 11.27 C ATOM 895 CG ASN A 123 58.994 25.612 3.869 1.00 11.18 C ATOM 896 OD1 ASN A 123 57.876 25.504 4.337 1.00 12.59 O ATOM 897 ND2 ASN A 123 59.799 24.559 3.690 1.00 12.82 N ATOM 898 N TRP A 124 59.389 28.836 5.973 1.00 9.78 N ATOM 899 CA TRP A 124 59.355 29.021 7.416 1.00 10.30 C ATOM 900 C TRP A 124 60.451 29.999 7.822 1.00 10.37 C ATOM 901 O TRP A 124 61.336 30.336 7.024 1.00 10.21 O ATOM 902 CB TRP A 124 59.485 27.683 8.172 1.00 11.22 C ATOM 903 CG TRP A 124 60.592 26.765 7.764 1.00 11.61 C ATOM 904 CD1 TRP A 124 60.442 25.622 7.051 1.00 12.56 C ATOM 905 CD2 TRP A 124 61.975 26.850 8.111 1.00 12.03 C ATOM 906 NE1 TRP A 124 61.654 24.998 6.896 1.00 12.91 N ATOM 907 CE2 TRP A 124 62.617 25.719 7.545 1.00 12.82 C ATOM 908 CE3 TRP A 124 62.754 27.765 8.831 1.00 12.44 C ATOM 909 CZ2 TRP A 124 63.994 25.489 7.667 1.00 13.52 C ATOM 910 CZ3 TRP A 124 64.143 27.528 8.958 1.00 14.41 C ATOM 911 CH2 TRP A 124 64.739 26.403 8.363 1.00 14.22 C ATOM 912 N ILE A 125 60.343 30.445 9.066 1.00 10.78 N ATOM 913 CA ILE A 125 61.256 31.364 9.740 1.00 11.98 C ATOM 914 C ILE A 125 61.642 30.702 11.050 1.00 11.97 C ATOM 915 O ILE A 125 60.821 30.018 11.668 1.00 12.20 O ATOM 916 CB ILE A 125 60.541 32.731 10.055 1.00 14.35 C ATOM 917 CG1 ILE A 125 59.890 33.330 8.796 1.00 17.01 C ATOM 918 CG2 ILE A 125 61.482 33.720 10.707 1.00 17.39 C ATOM 919 CD1 ILE A 125 58.361 33.394 8.906 1.00 21.62 C ATOM 920 N ARG A 126 62.873 30.889 11.484 1.00 11.04 N ATOM 921 CA ARG A 126 63.304 30.375 12.772 1.00 11.44 C ATOM 922 C ARG A 126 64.087 31.417 13.522 1.00 11.24 C ATOM 923 O ARG A 126 64.950 32.078 12.958 1.00 11.82 O ATOM 924 CB ARG A 126 64.116 29.113 12.570 1.00 12.32 C ATOM 925 CG ARG A 126 64.408 28.352 13.850 1.00 15.43 C ATOM 926 CD ARG A 126 65.050 26.993 13.685 1.00 19.33 C ATOM 927 NE ARG A 126 64.430 26.093 12.722 1.00 25.71 N ATOM 928 CZ ARG A 126 65.124 25.384 11.806 1.00 30.09 C ATOM 929 NH1 ARG A 126 66.439 25.519 11.682 1.00 31.41 N ATOM 930 NH2 ARG A 126 64.492 24.571 10.976 1.00 33.02 N ATOM 931 N ILE A 127 63.766 31.589 14.795 1.00 11.50 N ATOM 932 CA ILE A 127 64.417 32.546 15.678 1.00 11.78 C ATOM 933 C ILE A 127 65.270 31.766 16.643 1.00 12.28 C ATOM 934 O ILE A 127 64.784 30.820 17.281 1.00 12.08 O ATOM 935 CB ILE A 127 63.375 33.384 16.433 1.00 11.79 C ATOM 936 CG1 ILE A 127 62.518 34.138 15.422 1.00 13.26 C ATOM 937 CG2 ILE A 127 64.045 34.329 17.420 1.00 12.39 C ATOM 938 CD1 ILE A 127 61.352 34.824 16.005 1.00 18.48 C ATOM 939 N ASN A 128 66.538 32.146 16.736 1.00 12.66 N ATOM 940 CA ASN A 128 67.532 31.437 17.549 1.00 14.08 C ATOM 941 C ASN A 128 68.256 32.376 18.491 1.00 15.36 C ATOM 942 O ASN A 128 68.582 33.501 18.130 1.00 13.71 O ATOM 943 CB ASN A 128 68.598 30.785 16.656 1.00 14.44 C ATOM 944 CG ASN A 128 68.022 29.917 15.583 1.00 16.28 C ATOM 945 OD1 ASN A 128 67.779 28.718 15.804 1.00 18.75 O ATOM 946 ND2 ASN A 128 67.824 30.480 14.397 1.00 16.50 N ATOM 947 N LYS A 129 68.538 31.903 19.702 1.00 18.28 N ATOM 948 CA LYS A 129 69.489 32.564 20.578 1.00 21.46 C ATOM 949 C LYS A 129 70.857 32.553 19.914 1.00 23.24 C ATOM 950 O LYS A 129 71.138 31.720 19.037 1.00 23.86 O ATOM 951 CB LYS A 129 69.614 31.804 21.902 1.00 22.48 C ATOM 952 CG LYS A 129 68.380 31.773 22.752 1.00 25.42 C ATOM 953 CD LYS A 129 68.690 31.145 24.117 1.00 29.11 C ATOM 954 CE LYS A 129 67.504 31.236 25.057 1.00 31.09 C ATOM 955 NZ LYS A 129 67.934 31.142 26.491 1.00 33.23 N ATOM 956 N THR A 130 71.674 33.534 20.273 1.00 25.42 N ATOM 957 CA THR A 130 73.091 33.516 19.946 1.00 27.17 C ATOM 958 C THR A 130 73.912 33.399 21.220 1.00 30.26 C ATOM 959 O THR A 130 74.858 32.619 21.275 1.00 31.73 O ATOM 960 CB THR A 130 73.503 34.820 19.287 1.00 26.86 C ATOM 961 OG1 THR A 130 73.288 35.882 20.223 1.00 26.17 O ATOM 962 CG2 THR A 130 72.625 35.180 18.098 1.00 24.86 C ATOM 963 N HIS A 131 73.535 34.216 22.210 1.00 32.99 N ATOM 964 CA HIS A 131 74.358 34.544 23.375 1.00 34.84 C ATOM 965 C HIS A 131 73.614 34.238 24.676 1.00 35.14 C ATOM 966 O HIS A 131 72.490 33.733 24.662 1.00 35.75 O ATOM 967 CB HIS A 131 74.731 36.032 23.334 1.00 35.64 C ATOM 968 CG HIS A 131 75.789 36.367 22.324 1.00 38.17 C ATOM 969 ND1 HIS A 131 77.106 35.979 22.467 1.00 41.26 N ATOM 970 CD2 HIS A 131 75.728 37.058 21.160 1.00 40.32 C ATOM 971 CE1 HIS A 131 77.806 36.409 21.431 1.00 41.57 C ATOM 972 NE2 HIS A 131 76.992 37.065 20.622 1.00 42.24 N TER 973 HIS A 131 ATOM 974 N MET A 1 40.561 11.382 41.913 1.00 24.63 N ATOM 975 CA MET A 1 40.730 12.560 42.821 1.00 24.13 C ATOM 976 C MET A 1 41.469 13.694 42.111 1.00 21.28 C ATOM 977 O MET A 1 42.680 13.633 41.899 1.00 20.06 O ATOM 978 CB MET A 1 41.493 12.165 44.076 1.00 25.87 C ATOM 979 CG MET A 1 41.778 13.319 45.040 1.00 30.03 C ATOM 980 SD MET A 1 40.370 14.409 45.324 1.00 39.27 S ATOM 981 CE MET A 1 41.050 15.498 46.606 1.00 38.35 C ATOM 982 N VAL A 2 40.736 14.742 41.777 1.00 18.50 N ATOM 983 CA VAL A 2 41.262 15.830 40.964 1.00 16.94 C ATOM 984 C VAL A 2 42.038 16.812 41.815 1.00 16.16 C ATOM 985 O VAL A 2 41.512 17.385 42.769 1.00 16.47 O ATOM 986 CB VAL A 2 40.129 16.545 40.203 1.00 16.75 C ATOM 987 CG1 VAL A 2 40.660 17.744 39.434 1.00 17.22 C ATOM 988 CG2 VAL A 2 39.455 15.567 39.267 1.00 18.60 C ATOM 989 N ILE A 3 43.295 17.020 41.441 1.00 14.08 N ATOM 990 CA ILE A 3 44.148 18.003 42.063 1.00 13.99 C ATOM 991 C ILE A 3 43.945 19.377 41.434 1.00 13.43 C ATOM 992 O ILE A 3 43.854 20.377 42.144 1.00 13.93 O ATOM 993 CB ILE A 3 45.621 17.551 41.925 1.00 13.81 C ATOM 994 CG1 ILE A 3 45.865 16.239 42.680 1.00 15.36 C ATOM 995 CG2 ILE A 3 46.568 18.629 42.396 1.00 15.19 C ATOM 996 CD1 ILE A 3 45.598 16.292 44.163 1.00 17.42 C ATOM 997 N ALA A 4 43.919 19.430 40.107 1.00 12.71 N ATOM 998 CA ALA A 4 43.752 20.680 39.380 1.00 12.39 C ATOM 999 C ALA A 4 43.251 20.403 37.992 1.00 12.33 C ATOM 1000 O ALA A 4 43.642 19.424 37.365 1.00 13.43 O ATOM 1001 CB ALA A 4 45.075 21.459 39.294 1.00 12.90 C ATOM 1002 N THR A 5 42.389 21.286 37.513 1.00 11.43 N ATOM 1003 CA THR A 5 42.015 21.377 36.118 1.00 12.41 C ATOM 1004 C THR A 5 42.562 22.698 35.625 1.00 12.17 C ATOM 1005 O THR A 5 42.337 23.734 36.250 1.00 12.79 O ATOM 1006 CB THR A 5 40.506 21.370 36.000 1.00 12.98 C ATOM 1007 OG1 THR A 5 39.970 20.260 36.736 1.00 14.79 O ATOM 1008 CG2 THR A 5 40.072 21.188 34.559 1.00 15.21 C ATOM 1009 N ILE A 6 43.284 22.683 34.503 1.00 11.39 N ATOM 1010 CA ILE A 6 43.928 23.882 33.969 1.00 12.06 C ATOM 1011 C ILE A 6 43.521 24.006 32.512 1.00 11.35 C ATOM 1012 O ILE A 6 43.832 23.151 31.701 1.00 11.81 O ATOM 1013 CB ILE A 6 45.456 23.790 34.098 1.00 11.88 C ATOM 1014 CG1 ILE A 6 45.853 23.625 35.556 1.00 14.14 C ATOM 1015 CG2 ILE A 6 46.115 25.018 33.509 1.00 12.89 C ATOM 1016 CD1 ILE A 6 47.318 23.316 35.767 1.00 15.06 C ATOM 1017 N GLN A 7 42.799 25.071 32.181 1.00 11.99 N ATOM 1018 CA GLN A 7 42.501 25.376 30.801 1.00 12.42 C ATOM 1019 C GLN A 7 43.776 25.841 30.102 1.00 12.23 C ATOM 1020 O GLN A 7 44.518 26.656 30.629 1.00 12.41 O ATOM 1021 CB GLN A 7 41.414 26.440 30.708 1.00 12.60 C ATOM 1022 CG GLN A 7 40.061 25.954 31.225 1.00 14.04 C ATOM 1023 CD GLN A 7 39.506 24.795 30.447 1.00 13.90 C ATOM 1024 OE1 GLN A 7 39.706 24.705 29.234 1.00 14.02 O ATOM 1025 NE2 GLN A 7 38.813 23.898 31.124 1.00 16.79 N ATOM 1026 N ALA A 8 44.022 25.297 28.914 1.00 11.66 N ATOM 1027 CA ALA A 8 45.272 25.546 28.211 1.00 12.21 C ATOM 1028 C ALA A 8 45.498 27.029 27.961 1.00 11.66 C ATOM 1029 O ALA A 8 46.631 27.513 28.024 1.00 12.04 O ATOM 1030 CB ALA A 8 45.299 24.780 26.909 1.00 12.61 C ATOM 1031 N GLU A 9 44.405 27.742 27.708 1.00 11.83 N ATOM 1032 CA GLU A 9 44.413 29.169 27.394 1.00 12.65 C ATOM 1033 C GLU A 9 44.671 30.074 28.591 1.00 13.36 C ATOM 1034 O GLU A 9 44.884 31.272 28.419 1.00 14.79 O ATOM 1035 CB GLU A 9 43.079 29.580 26.729 1.00 13.54 C ATOM 1036 CG GLU A 9 41.822 29.361 27.586 1.00 14.57 C ATOM 1037 CD GLU A 9 41.185 27.973 27.447 1.00 15.37 C ATOM 1038 OE1 GLU A 9 41.872 26.966 27.190 1.00 15.18 O ATOM 1039 OE2 GLU A 9 39.941 27.879 27.600 1.00 19.25 O ATOM 1040 N ASP A 10 44.677 29.510 29.796 1.00 13.06 N ATOM 1041 CA ASP A 10 44.876 30.281 31.025 1.00 13.39 C ATOM 1042 C ASP A 10 46.335 30.314 31.464 1.00 13.51 C ATOM 1043 O ASP A 10 46.658 30.401 32.655 1.00 15.53 O ATOM 1044 CB ASP A 10 43.988 29.720 32.138 1.00 14.05 C ATOM 1045 CG ASP A 10 42.522 30.036 31.948 1.00 15.95 C ATOM 1046 OD1 ASP A 10 42.174 30.887 31.092 1.00 18.31 O ATOM 1047 OD2 ASP A 10 41.647 29.456 32.619 1.00 16.22 O ATOM 1048 N HIS A 11 47.222 30.290 30.485 1.00 12.72 N ATOM 1049 CA HIS A 11 48.655 30.436 30.725 1.00 13.10 C ATOM 1050 C HIS A 11 49.004 31.844 31.171 1.00 13.50 C ATOM 1051 O HIS A 11 48.373 32.811 30.725 1.00 14.51 O ATOM 1052 CB HIS A 11 49.454 30.093 29.472 1.00 12.84 C ATOM 1053 CG HIS A 11 48.952 30.747 28.218 1.00 12.55 C ATOM 1054 ND1 HIS A 11 49.195 32.066 27.904 1.00 13.02 N ATOM 1055 CD2 HIS A 11 48.247 30.241 27.178 1.00 12.28 C ATOM 1056 CE1 HIS A 11 48.649 32.341 26.731 1.00 13.20 C ATOM 1057 NE2 HIS A 11 48.069 31.249 26.266 1.00 13.35 N ATOM 1058 N SER A 12 49.998 31.960 32.036 1.00 12.42 N ATOM 1059 CA SER A 12 50.517 33.265 32.433 1.00 12.95 C ATOM 1060 C SER A 12 51.599 33.770 31.489 1.00 13.92 C ATOM 1061 O SER A 12 51.898 34.958 31.463 1.00 14.46 O ATOM 1062 CB SER A 12 51.041 33.218 33.870 1.00 13.43 C ATOM 1063 OG SER A 12 51.975 32.174 34.053 1.00 13.65 O ATOM 1064 N GLN A 13 52.211 32.872 30.733 1.00 12.95 N ATOM 1065 CA GLN A 13 53.175 33.224 29.693 1.00 13.39 C ATOM 1066 C GLN A 13 53.133 32.121 28.652 1.00 12.92 C ATOM 1067 O GLN A 13 52.777 30.984 28.963 1.00 11.78 O ATOM 1068 CB GLN A 13 54.565 33.301 30.288 1.00 14.37 C ATOM 1069 CG GLN A 13 55.539 34.134 29.519 1.00 19.02 C ATOM 1070 CD GLN A 13 56.815 34.372 30.295 1.00 22.71 C ATOM 1071 OE1 GLN A 13 57.406 35.446 30.204 1.00 27.38 O ATOM 1072 NE2 GLN A 13 57.244 33.374 31.058 1.00 23.39 N ATOM 1073 N GLN A 14 53.484 32.431 27.421 1.00 12.50 N ATOM 1074 CA GLN A 14 53.565 31.420 26.377 1.00 12.13 C ATOM 1075 C GLN A 14 54.500 31.884 25.301 1.00 12.26 C ATOM 1076 O GLN A 14 54.864 33.062 25.255 1.00 12.69 O ATOM 1077 CB GLN A 14 52.197 31.125 25.782 1.00 11.77 C ATOM 1078 CG GLN A 14 51.586 32.284 24.960 1.00 11.71 C ATOM 1079 CD GLN A 14 52.107 32.316 23.545 1.00 11.22 C ATOM 1080 OE1 GLN A 14 52.227 31.290 22.899 1.00 11.63 O ATOM 1081 NE2 GLN A 14 52.451 33.509 23.065 1.00 12.63 N ATOM 1082 N SER A 15 54.884 30.974 24.426 1.00 11.11 N ATOM 1083 CA SER A 15 55.615 31.356 23.230 1.00 10.70 C ATOM 1084 C SER A 15 55.137 30.559 22.035 1.00 10.70 C ATOM 1085 O SER A 15 55.105 29.310 22.071 1.00 10.55 O ATOM 1086 CB SER A 15 57.109 31.141 23.431 1.00 11.15 C ATOM 1087 OG SER A 15 57.845 31.718 22.351 1.00 11.42 O ATOM 1088 N GLY A 16 54.815 31.270 20.954 1.00 10.41 N ATOM 1089 CA GLY A 16 54.595 30.673 19.661 1.00 10.06 C ATOM 1090 C GLY A 16 53.203 30.200 19.315 1.00 10.05 C ATOM 1091 O GLY A 16 52.986 29.723 18.202 1.00 10.45 O ATOM 1092 N THR A 17 52.270 30.307 20.249 1.00 10.60 N ATOM 1093 CA THR A 17 50.960 29.686 20.081 1.00 11.09 C ATOM 1094 C THR A 17 49.870 30.726 19.973 1.00 11.52 C ATOM 1095 O THR A 17 50.107 31.904 20.209 1.00 11.78 O ATOM 1096 CB THR A 17 50.657 28.693 21.216 1.00 11.00 C ATOM 1097 OG1 THR A 17 50.335 29.392 22.425 1.00 11.86 O ATOM 1098 CG2 THR A 17 51.849 27.764 21.545 1.00 11.67 C ATOM 1099 N GLN A 18 48.672 30.272 19.618 1.00 12.27 N ATOM 1100 CA GLN A 18 47.522 31.138 19.384 1.00 13.39 C ATOM 1101 C GLN A 18 46.298 30.560 20.047 1.00 13.79 C ATOM 1102 O GLN A 18 46.054 29.359 19.955 1.00 14.15 O ATOM 1103 CB GLN A 18 47.249 31.219 17.892 1.00 14.21 C ATOM 1104 CG GLN A 18 46.145 32.184 17.483 1.00 15.99 C ATOM 1105 CD GLN A 18 46.190 32.470 15.996 1.00 20.57 C ATOM 1106 OE1 GLN A 18 47.265 32.568 15.413 1.00 23.19 O ATOM 1107 NE2 GLN A 18 45.028 32.560 15.377 1.00 25.09 N ATOM 1108 N GLN A 19 45.496 31.395 20.683 1.00 14.53 N ATOM 1109 CA GLN A 19 44.226 30.956 21.245 1.00 15.42 C ATOM 1110 C GLN A 19 43.150 31.030 20.181 1.00 15.16 C ATOM 1111 O GLN A 19 43.175 31.919 19.333 1.00 16.59 O ATOM 1112 CB GLN A 19 43.844 31.829 22.428 1.00 16.21 C ATOM 1113 CG GLN A 19 44.841 31.676 23.567 1.00 18.35 C ATOM 1114 CD GLN A 19 44.461 32.404 24.823 1.00 20.90 C ATOM 1115 OE1 GLN A 19 45.303 32.590 25.713 1.00 23.30 O ATOM 1116 NE2 GLN A 19 43.199 32.786 24.936 1.00 20.45 N ATOM 1117 N GLU A 20 42.234 30.081 20.209 1.00 15.44 N ATOM 1118 CA GLU A 20 41.117 30.065 19.276 1.00 16.05 C ATOM 1119 C GLU A 20 39.917 29.443 19.948 1.00 16.57 C ATOM 1120 O GLU A 20 40.040 28.731 20.931 1.00 15.77 O ATOM 1121 CB GLU A 20 41.483 29.290 18.010 1.00 16.84 C ATOM 1122 CG GLU A 20 41.744 27.801 18.216 1.00 18.70 C ATOM 1123 CD GLU A 20 42.423 27.133 17.031 1.00 20.51 C ATOM 1124 OE1 GLU A 20 42.497 27.736 15.936 1.00 23.75 O ATOM 1125 OE2 GLU A 20 42.906 25.997 17.182 1.00 18.65 O ATOM 1126 N THR A 21 38.736 29.721 19.419 1.00 17.38 N ATOM 1127 CA THR A 21 37.530 29.095 19.899 1.00 18.13 C ATOM 1128 C THR A 21 37.568 27.590 19.658 1.00 17.34 C ATOM 1129 O THR A 21 38.026 27.138 18.611 1.00 18.08 O ATOM 1130 CB THR A 21 36.323 29.724 19.196 1.00 18.98 C ATOM 1131 OG1 THR A 21 36.294 31.115 19.514 1.00 22.47 O ATOM 1132 CG2 THR A 21 35.036 29.196 19.769 1.00 20.30 C ATOM 1133 N THR A 22 37.116 26.818 20.641 1.00 16.86 N ATOM 1134 CA THR A 22 36.972 25.381 20.464 1.00 16.89 C ATOM 1135 C THR A 22 35.506 24.973 20.386 1.00 18.12 C ATOM 1136 O THR A 22 34.655 25.604 21.014 1.00 19.03 O ATOM 1137 CB THR A 22 37.710 24.582 21.584 1.00 16.87 C ATOM 1138 OG1 THR A 22 37.658 23.194 21.262 1.00 16.57 O ATOM 1139 CG2 THR A 22 37.018 24.690 22.943 1.00 17.39 C ATOM 1140 N THR A 23 35.244 23.925 19.615 1.00 18.65 N ATOM 1141 CA THR A 23 33.924 23.308 19.567 1.00 19.65 C ATOM 1142 C THR A 23 33.881 22.010 20.371 1.00 19.76 C ATOM 1143 O THR A 23 32.906 21.257 20.324 1.00 21.11 O ATOM 1144 CB THR A 23 33.501 23.049 18.119 1.00 20.08 C ATOM 1145 OG1 THR A 23 34.489 22.243 17.475 1.00 21.28 O ATOM 1146 CG2 THR A 23 33.424 24.356 17.317 1.00 21.41 C ATOM 1147 N ASP A 24 34.926 21.745 21.154 1.00 19.00 N ATOM 1148 CA ASP A 24 34.889 20.634 22.094 1.00 18.45 C ATOM 1149 C ASP A 24 33.774 20.834 23.118 1.00 19.72 C ATOM 1150 O ASP A 24 33.312 21.942 23.333 1.00 20.06 O ATOM 1151 CB ASP A 24 36.238 20.516 22.812 1.00 17.71 C ATOM 1152 CG ASP A 24 36.428 19.189 23.486 1.00 17.41 C ATOM 1153 OD1 ASP A 24 35.710 18.198 23.198 1.00 17.36 O ATOM 1154 OD2 ASP A 24 37.316 19.049 24.353 1.00 15.39 O ATOM 1155 N THR A 25 33.355 19.742 23.741 1.00 21.61 N ATOM 1156 CA THR A 25 32.419 19.792 24.861 1.00 22.93 C ATOM 1157 C THR A 25 32.827 20.879 25.848 1.00 23.48 C ATOM 1158 O THR A 25 33.974 20.920 26.282 1.00 24.37 O ATOM 1159 CB THR A 25 32.415 18.442 25.585 1.00 23.36 C ATOM 1160 OG1 THR A 25 32.326 17.378 24.635 1.00 25.32 O ATOM 1161 CG2 THR A 25 31.170 18.288 26.444 1.00 24.41 C ATOM 1162 N GLY A 26 31.890 21.753 26.201 1.00 23.94 N ATOM 1163 CA GLY A 26 32.127 22.783 27.197 1.00 23.82 C ATOM 1164 C GLY A 26 32.524 24.115 26.598 1.00 23.51 C ATOM 1165 O GLY A 26 32.565 25.123 27.308 1.00 24.85 O ATOM 1166 N GLY A 27 32.822 24.122 25.297 1.00 22.31 N ATOM 1167 CA GLY A 27 33.163 25.333 24.584 1.00 21.23 C ATOM 1168 C GLY A 27 34.422 25.976 25.126 1.00 19.62 C ATOM 1169 O GLY A 27 35.313 25.298 25.656 1.00 19.23 O ATOM 1170 N GLY A 28 34.494 27.287 24.997 1.00 18.68 N ATOM 1171 CA GLY A 28 35.634 28.051 25.434 1.00 17.81 C ATOM 1172 C GLY A 28 36.675 28.103 24.334 1.00 17.16 C ATOM 1173 O GLY A 28 36.362 28.284 23.155 1.00 17.82 O ATOM 1174 N LYS A 29 37.934 27.958 24.737 1.00 16.72 N ATOM 1175 CA LYS A 29 39.057 28.139 23.833 1.00 15.62 C ATOM 1176 C LYS A 29 40.017 26.974 23.907 1.00 14.50 C ATOM 1177 O LYS A 29 40.038 26.224 24.869 1.00 14.13 O ATOM 1178 CB LYS A 29 39.810 29.402 24.177 1.00 16.33 C ATOM 1179 CG LYS A 29 38.954 30.651 24.108 1.00 19.11 C ATOM 1180 CD LYS A 29 39.724 31.888 24.504 1.00 23.31 C ATOM 1181 CE LYS A 29 38.818 33.122 24.474 1.00 26.16 C ATOM 1182 NZ LYS A 29 39.482 34.348 25.019 1.00 29.37 N ATOM 1183 N ASN A 30 40.813 26.826 22.861 1.00 13.28 N ATOM 1184 CA ASN A 30 41.966 25.938 22.898 1.00 12.43 C ATOM 1185 C ASN A 30 43.174 26.700 22.419 1.00 11.92 C ATOM 1186 O ASN A 30 43.065 27.789 21.873 1.00 12.77 O ATOM 1187 CB ASN A 30 41.737 24.665 22.075 1.00 12.57 C ATOM 1188 CG ASN A 30 41.700 24.915 20.577 1.00 13.90 C ATOM 1189 OD1 ASN A 30 42.753 24.902 19.893 1.00 16.58 O ATOM 1190 ND2 ASN A 30 40.513 25.071 20.036 1.00 11.96 N ATOM 1191 N VAL A 31 44.338 26.139 22.700 1.00 11.35 N ATOM 1192 CA VAL A 31 45.591 26.645 22.179 1.00 11.26 C ATOM 1193 C VAL A 31 45.904 25.851 20.924 1.00 11.37 C ATOM 1194 O VAL A 31 45.741 24.622 20.890 1.00 11.61 O ATOM 1195 CB VAL A 31 46.715 26.526 23.224 1.00 11.14 C ATOM 1196 CG1 VAL A 31 48.060 26.883 22.617 1.00 12.46 C ATOM 1197 CG2 VAL A 31 46.433 27.458 24.382 1.00 12.75 C ATOM 1198 N GLY A 32 46.323 26.566 19.885 1.00 11.13 N ATOM 1199 CA GLY A 32 46.712 25.981 18.619 1.00 11.44 C ATOM 1200 C GLY A 32 47.952 26.628 18.051 1.00 11.36 C ATOM 1201 O GLY A 32 48.659 27.386 18.725 1.00 11.57 O ATOM 1202 N TYR A 33 48.223 26.287 16.798 1.00 11.58 N ATOM 1203 CA TYR A 33 49.445 26.686 16.093 1.00 11.15 C ATOM 1204 C TYR A 33 50.685 26.354 16.921 1.00 10.78 C ATOM 1205 O TYR A 33 51.591 27.182 17.109 1.00 10.96 O ATOM 1206 CB TYR A 33 49.395 28.164 15.687 1.00 11.98 C ATOM 1207 CG TYR A 33 48.375 28.402 14.598 1.00 14.35 C ATOM 1208 CD1 TYR A 33 47.069 28.745 14.904 1.00 16.77 C ATOM 1209 CD2 TYR A 33 48.703 28.206 13.273 1.00 17.29 C ATOM 1210 CE1 TYR A 33 46.121 28.954 13.907 1.00 18.20 C ATOM 1211 CE2 TYR A 33 47.761 28.406 12.262 1.00 18.55 C ATOM 1212 CZ TYR A 33 46.488 28.788 12.598 1.00 19.04 C ATOM 1213 OH TYR A 33 45.544 28.993 11.608 1.00 22.43 O ATOM 1214 N ILE A 34 50.724 25.109 17.388 1.00 11.41 N ATOM 1215 CA ILE A 34 51.808 24.605 18.222 1.00 11.60 C ATOM 1216 C ILE A 34 52.850 23.945 17.342 1.00 12.29 C ATOM 1217 O ILE A 34 52.547 23.029 16.582 1.00 13.22 O ATOM 1218 CB ILE A 34 51.277 23.585 19.258 1.00 11.21 C ATOM 1219 CG1 ILE A 34 50.172 24.239 20.094 1.00 12.15 C ATOM 1220 CG2 ILE A 34 52.424 23.090 20.131 1.00 12.04 C ATOM 1221 CD1 ILE A 34 49.607 23.346 21.190 1.00 12.21 C ATOM 1222 N ASP A 35 54.078 24.431 17.456 1.00 11.83 N ATOM 1223 CA ASP A 35 55.240 23.899 16.752 1.00 11.63 C ATOM 1224 C ASP A 35 56.257 23.433 17.762 1.00 11.91 C ATOM 1225 O ASP A 35 56.272 23.900 18.891 1.00 11.84 O ATOM 1226 CB ASP A 35 55.897 24.987 15.887 1.00 11.68 C ATOM 1227 CG ASP A 35 54.945 25.599 14.908 1.00 12.12 C ATOM 1228 OD1 ASP A 35 55.059 25.307 13.695 1.00 13.08 O ATOM 1229 OD2 ASP A 35 54.050 26.387 15.285 1.00 12.83 O ATOM 1230 N ALA A 36 57.149 22.544 17.347 1.00 12.41 N ATOM 1231 CA ALA A 36 58.254 22.145 18.210 1.00 12.43 C ATOM 1232 C ALA A 36 58.943 23.375 18.774 1.00 12.62 C ATOM 1233 O ALA A 36 59.285 24.298 18.033 1.00 13.27 O ATOM 1234 CB ALA A 36 59.253 21.301 17.428 1.00 12.67 C ATOM 1235 N GLY A 37 59.154 23.377 20.083 1.00 11.96 N ATOM 1236 CA GLY A 37 59.778 24.482 20.768 1.00 11.86 C ATOM 1237 C GLY A 37 58.848 25.491 21.409 1.00 11.66 C ATOM 1238 O GLY A 37 59.259 26.293 22.245 1.00 12.69 O ATOM 1239 N ASP A 38 57.596 25.509 20.970 1.00 10.71 N ATOM 1240 CA ASP A 38 56.597 26.371 21.586 1.00 10.58 C ATOM 1241 C ASP A 38 56.326 25.880 22.989 1.00 10.52 C ATOM 1242 O ASP A 38 56.531 24.703 23.302 1.00 10.66 O ATOM 1243 CB ASP A 38 55.309 26.348 20.799 1.00 10.37 C ATOM 1244 CG ASP A 38 55.391 27.085 19.452 1.00 10.43 C ATOM 1245 OD1 ASP A 38 56.398 27.837 19.208 1.00 10.79 O ATOM 1246 OD2 ASP A 38 54.441 26.997 18.631 1.00 9.62 O ATOM 1247 N TRP A 39 55.819 26.756 23.837 1.00 9.95 N ATOM 1248 CA TRP A 39 55.580 26.413 25.225 1.00 10.46 C ATOM 1249 C TRP A 39 54.503 27.249 25.876 1.00 10.42 C ATOM 1250 O TRP A 39 54.125 28.330 25.387 1.00 10.31 O ATOM 1251 CB TRP A 39 56.882 26.468 26.031 1.00 10.45 C ATOM 1252 CG TRP A 39 57.633 27.762 25.978 1.00 11.50 C ATOM 1253 CD1 TRP A 39 58.673 28.064 25.142 1.00 12.56 C ATOM 1254 CD2 TRP A 39 57.419 28.917 26.789 1.00 11.26 C ATOM 1255 NE1 TRP A 39 59.128 29.324 25.416 1.00 12.28 N ATOM 1256 CE2 TRP A 39 58.383 29.877 26.418 1.00 12.43 C ATOM 1257 CE3 TRP A 39 56.533 29.233 27.822 1.00 13.69 C ATOM 1258 CZ2 TRP A 39 58.467 31.132 27.019 1.00 13.72 C ATOM 1259 CZ3 TRP A 39 56.616 30.499 28.422 1.00 13.57 C ATOM 1260 CH2 TRP A 39 57.575 31.427 28.001 1.00 13.94 C ATOM 1261 N LEU A 40 54.016 26.735 27.001 1.00 10.10 N ATOM 1262 CA LEU A 40 52.954 27.312 27.803 1.00 9.73 C ATOM 1263 C LEU A 40 53.383 27.259 29.252 1.00 10.56 C ATOM 1264 O LEU A 40 53.829 26.216 29.715 1.00 11.11 O ATOM 1265 CB LEU A 40 51.689 26.488 27.642 1.00 10.00 C ATOM 1266 CG LEU A 40 51.148 26.370 26.224 1.00 11.15 C ATOM 1267 CD1 LEU A 40 50.219 25.195 26.083 1.00 12.55 C ATOM 1268 CD2 LEU A 40 50.436 27.638 25.814 1.00 14.13 C ATOM 1269 N SER A 41 53.268 28.351 29.979 1.00 10.32 N ATOM 1270 CA SER A 41 53.572 28.401 31.399 1.00 10.48 C ATOM 1271 C SER A 41 52.325 28.702 32.191 1.00 10.45 C ATOM 1272 O SER A 41 51.556 29.594 31.824 1.00 10.73 O ATOM 1273 CB SER A 41 54.586 29.491 31.699 1.00 10.54 C ATOM 1274 OG SER A 41 54.757 29.581 33.100 1.00 12.55 O ATOM 1275 N TYR A 42 52.134 27.969 33.280 1.00 10.23 N ATOM 1276 CA TYR A 42 51.050 28.169 34.227 1.00 10.21 C ATOM 1277 C TYR A 42 51.612 28.609 35.578 1.00 10.31 C ATOM 1278 O TYR A 42 51.008 28.413 36.632 1.00 10.92 O ATOM 1279 CB TYR A 42 50.175 26.896 34.306 1.00 9.86 C ATOM 1280 CG TYR A 42 49.678 26.547 32.937 1.00 9.78 C ATOM 1281 CD1 TYR A 42 50.347 25.624 32.147 1.00 10.73 C ATOM 1282 CD2 TYR A 42 48.590 27.194 32.387 1.00 10.60 C ATOM 1283 CE1 TYR A 42 49.963 25.378 30.864 1.00 10.76 C ATOM 1284 CE2 TYR A 42 48.185 26.934 31.108 1.00 11.09 C ATOM 1285 CZ TYR A 42 48.882 26.037 30.331 1.00 10.06 C ATOM 1286 OH TYR A 42 48.498 25.791 29.034 1.00 11.80 O ATOM 1287 N ALA A 43 52.735 29.306 35.538 1.00 11.08 N ATOM 1288 CA ALA A 43 53.415 29.743 36.754 1.00 11.96 C ATOM 1289 C ALA A 43 52.597 30.747 37.563 1.00 12.69 C ATOM 1290 O ALA A 43 52.748 30.799 38.786 1.00 13.93 O ATOM 1291 CB ALA A 43 54.769 30.323 36.423 1.00 12.77 C ATOM 1292 N GLY A 44 51.725 31.509 36.915 1.00 12.94 N ATOM 1293 CA GLY A 44 50.876 32.476 37.597 1.00 13.51 C ATOM 1294 C GLY A 44 49.821 31.843 38.476 1.00 13.90 C ATOM 1295 O GLY A 44 49.240 32.531 39.296 1.00 14.54 O ATOM 1296 N THR A 45 49.545 30.548 38.317 1.00 12.64 N ATOM 1297 CA THR A 45 48.564 29.823 39.131 1.00 12.76 C ATOM 1298 C THR A 45 49.234 28.576 39.714 1.00 12.25 C ATOM 1299 O THR A 45 49.043 27.459 39.212 1.00 12.44 O ATOM 1300 CB THR A 45 47.359 29.413 38.297 1.00 12.66 C ATOM 1301 OG1 THR A 45 47.797 28.734 37.106 1.00 13.85 O ATOM 1302 CG2 THR A 45 46.570 30.606 37.776 1.00 14.13 C ATOM 1303 N PRO A 46 50.037 28.751 40.755 1.00 12.35 N ATOM 1304 CA PRO A 46 50.719 27.607 41.352 1.00 12.21 C ATOM 1305 C PRO A 46 49.721 26.594 41.866 1.00 12.21 C ATOM 1306 O PRO A 46 48.674 26.984 42.390 1.00 12.68 O ATOM 1307 CB PRO A 46 51.533 28.221 42.482 1.00 12.91 C ATOM 1308 CG PRO A 46 51.628 29.679 42.178 1.00 13.95 C ATOM 1309 CD PRO A 46 50.378 30.006 41.451 1.00 12.82 C ATOM 1310 N VAL A 47 50.059 25.320 41.754 1.00 11.66 N ATOM 1311 CA VAL A 47 49.215 24.204 42.139 1.00 11.76 C ATOM 1312 C VAL A 47 49.861 23.441 43.275 1.00 12.40 C ATOM 1313 O VAL A 47 51.060 23.161 43.248 1.00 13.30 O ATOM 1314 CB VAL A 47 48.986 23.276 40.934 1.00 11.59 C ATOM 1315 CG1 VAL A 47 48.370 21.955 41.337 1.00 12.84 C ATOM 1316 CG2 VAL A 47 48.104 23.958 39.925 1.00 12.26 C ATOM 1317 N ASN A 48 49.080 23.115 44.295 1.00 11.87 N ATOM 1318 CA ASN A 48 49.599 22.318 45.409 1.00 12.72 C ATOM 1319 C ASN A 48 49.505 20.824 45.138 1.00 12.31 C ATOM 1320 O ASN A 48 48.450 20.323 44.769 1.00 13.63 O ATOM 1321 CB ASN A 48 48.831 22.618 46.715 1.00 13.44 C ATOM 1322 CG ASN A 48 49.314 21.773 47.888 1.00 15.65 C ATOM 1323 OD1 ASN A 48 48.782 20.701 48.152 1.00 18.12 O ATOM 1324 ND2 ASN A 48 50.353 22.229 48.535 1.00 19.18 N ATOM 1325 N ILE A 49 50.617 20.124 45.343 1.00 12.60 N ATOM 1326 CA ILE A 49 50.653 18.666 45.306 1.00 12.80 C ATOM 1327 C ILE A 49 50.714 18.215 46.767 1.00 12.55 C ATOM 1328 O ILE A 49 51.644 18.573 47.477 1.00 13.74 O ATOM 1329 CB ILE A 49 51.883 18.210 44.496 1.00 13.34 C ATOM 1330 CG1 ILE A 49 51.760 18.675 43.039 1.00 13.22 C ATOM 1331 CG2 ILE A 49 52.096 16.703 44.594 1.00 14.03 C ATOM 1332 CD1 ILE A 49 50.510 18.259 42.345 1.00 14.76 C ATOM 1333 N PRO A 50 49.697 17.489 47.229 1.00 14.14 N ATOM 1334 CA PRO A 50 49.565 17.215 48.667 1.00 15.29 C ATOM 1335 C PRO A 50 50.557 16.203 49.227 1.00 15.96 C ATOM 1336 O PRO A 50 50.835 16.236 50.430 1.00 17.68 O ATOM 1337 CB PRO A 50 48.138 16.680 48.781 1.00 15.64 C ATOM 1338 CG PRO A 50 47.867 16.075 47.496 1.00 15.67 C ATOM 1339 CD PRO A 50 48.558 16.954 46.473 1.00 14.33 C ATOM 1340 N SER A 51 51.064 15.307 48.387 1.00 16.51 N ATOM 1341 CA SER A 51 51.975 14.268 48.833 1.00 16.93 C ATOM 1342 C SER A 51 52.828 13.820 47.670 1.00 16.21 C ATOM 1343 O SER A 51 52.393 13.813 46.522 1.00 15.89 O ATOM 1344 CB SER A 51 51.208 13.064 49.382 1.00 17.16 C ATOM 1345 OG SER A 51 50.299 12.553 48.455 1.00 21.82 O ATOM 1346 N SER A 52 54.041 13.414 47.968 1.00 15.53 N ATOM 1347 CA SER A 52 54.929 12.935 46.942 1.00 15.52 C ATOM 1348 C SER A 52 54.480 11.582 46.454 1.00 15.05 C ATOM 1349 O SER A 52 54.086 10.717 47.235 1.00 16.99 O ATOM 1350 CB SER A 52 56.339 12.852 47.482 1.00 15.95 C ATOM 1351 OG SER A 52 56.775 14.132 47.887 1.00 19.16 O ATOM 1352 N GLY A 53 54.511 11.400 45.144 1.00 13.71 N ATOM 1353 CA GLY A 53 54.140 10.132 44.566 1.00 13.50 C ATOM 1354 C GLY A 53 53.578 10.256 43.174 1.00 13.06 C ATOM 1355 O GLY A 53 53.778 11.267 42.505 1.00 13.21 O ATOM 1356 N SER A 54 52.846 9.241 42.756 1.00 13.17 N ATOM 1357 CA SER A 54 52.343 9.113 41.402 1.00 13.67 C ATOM 1358 C SER A 54 51.095 9.952 41.195 1.00 12.94 C ATOM 1359 O SER A 54 50.162 9.934 42.002 1.00 13.68 O ATOM 1360 CB SER A 54 52.053 7.645 41.077 1.00 14.16 C ATOM 1361 OG SER A 54 51.898 7.470 39.688 1.00 19.79 O ATOM 1362 N TYR A 55 51.083 10.695 40.088 1.00 11.95 N ATOM 1363 CA TYR A 55 49.938 11.466 39.628 1.00 11.97 C ATOM 1364 C TYR A 55 49.649 11.129 38.182 1.00 11.83 C ATOM 1365 O TYR A 55 50.567 10.899 37.405 1.00 12.94 O ATOM 1366 CB TYR A 55 50.178 12.984 39.801 1.00 11.66 C ATOM 1367 CG TYR A 55 50.184 13.337 41.261 1.00 11.47 C ATOM 1368 CD1 TYR A 55 51.299 13.138 42.042 1.00 11.36 C ATOM 1369 CD2 TYR A 55 49.026 13.784 41.890 1.00 12.31 C ATOM 1370 CE1 TYR A 55 51.279 13.378 43.396 1.00 11.84 C ATOM 1371 CE2 TYR A 55 48.989 14.040 43.232 1.00 13.08 C ATOM 1372 CZ TYR A 55 50.109 13.825 43.995 1.00 12.95 C ATOM 1373 OH TYR A 55 50.086 14.057 45.355 1.00 15.24 O ATOM 1374 N LEU A 56 48.379 11.077 37.817 1.00 11.98 N ATOM 1375 CA LEU A 56 47.939 10.839 36.466 1.00 12.69 C ATOM 1376 C LEU A 56 47.623 12.186 35.835 1.00 12.13 C ATOM 1377 O LEU A 56 46.767 12.921 36.338 1.00 12.52 O ATOM 1378 CB LEU A 56 46.698 9.940 36.467 1.00 13.97 C ATOM 1379 CG LEU A 56 46.136 9.621 35.084 1.00 16.49 C ATOM 1380 CD1 LEU A 56 46.982 8.545 34.421 1.00 18.07 C ATOM 1381 CD2 LEU A 56 44.659 9.249 35.141 1.00 20.44 C ATOM 1382 N ILE A 57 48.303 12.505 34.742 1.00 11.04 N ATOM 1383 CA ILE A 57 48.050 13.761 34.037 1.00 10.86 C ATOM 1384 C ILE A 57 47.299 13.440 32.757 1.00 11.27 C ATOM 1385 O ILE A 57 47.737 12.598 31.972 1.00 11.52 O ATOM 1386 CB ILE A 57 49.358 14.515 33.685 1.00 11.09 C ATOM 1387 CG1 ILE A 57 50.418 14.415 34.798 1.00 11.90 C ATOM 1388 CG2 ILE A 57 49.049 15.985 33.349 1.00 11.16 C ATOM 1389 CD1 ILE A 57 49.986 14.980 36.103 1.00 11.95 C ATOM 1390 N GLU A 58 46.189 14.128 32.552 1.00 11.09 N ATOM 1391 CA GLU A 58 45.349 14.012 31.372 1.00 11.79 C ATOM 1392 C GLU A 58 45.472 15.272 30.534 1.00 11.21 C ATOM 1393 O GLU A 58 45.567 16.380 31.055 1.00 11.59 O ATOM 1394 CB GLU A 58 43.895 13.868 31.774 1.00 12.71 C ATOM 1395 CG GLU A 58 43.549 12.587 32.489 1.00 15.34 C ATOM 1396 CD GLU A 58 42.155 12.642 33.078 1.00 17.58 C ATOM 1397 OE1 GLU A 58 41.293 11.861 32.607 1.00 24.28 O ATOM 1398 OE2 GLU A 58 41.899 13.484 33.949 1.00 17.68 O ATOM 1399 N TYR A 59 45.424 15.087 29.228 1.00 10.94 N ATOM 1400 CA TYR A 59 45.489 16.165 28.259 1.00 11.08 C ATOM 1401 C TYR A 59 44.370 16.000 27.255 1.00 10.94 C ATOM 1402 O TYR A 59 44.211 14.926 26.694 1.00 11.62 O ATOM 1403 CB TYR A 59 46.824 16.198 27.502 1.00 10.87 C ATOM 1404 CG TYR A 59 48.022 16.128 28.393 1.00 11.37 C ATOM 1405 CD1 TYR A 59 48.513 14.911 28.838 1.00 11.60 C ATOM 1406 CD2 TYR A 59 48.682 17.275 28.783 1.00 11.20 C ATOM 1407 CE1 TYR A 59 49.600 14.833 29.655 1.00 11.39 C ATOM 1408 CE2 TYR A 59 49.780 17.206 29.620 1.00 11.42 C ATOM 1409 CZ TYR A 59 50.239 15.995 30.039 1.00 11.04 C ATOM 1410 OH TYR A 59 51.346 15.948 30.866 1.00 11.69 O ATOM 1411 N ARG A 60 43.615 17.064 27.029 1.00 10.95 N ATOM 1412 CA ARG A 60 42.524 17.064 26.065 1.00 11.35 C ATOM 1413 C ARG A 60 43.085 17.656 24.775 1.00 11.23 C ATOM 1414 O ARG A 60 43.384 18.860 24.713 1.00 11.66 O ATOM 1415 CB ARG A 60 41.362 17.876 26.613 1.00 11.96 C ATOM 1416 CG ARG A 60 40.097 17.823 25.782 1.00 12.22 C ATOM 1417 CD ARG A 60 39.490 16.450 25.730 1.00 14.26 C ATOM 1418 NE ARG A 60 38.206 16.461 25.036 1.00 14.18 N ATOM 1419 CZ ARG A 60 37.499 15.371 24.792 1.00 15.90 C ATOM 1420 NH1 ARG A 60 37.924 14.183 25.160 1.00 16.27 N ATOM 1421 NH2 ARG A 60 36.345 15.487 24.150 1.00 16.32 N ATOM 1422 N VAL A 61 43.233 16.824 23.753 1.00 11.78 N ATOM 1423 CA VAL A 61 44.033 17.151 22.572 1.00 11.93 C ATOM 1424 C VAL A 61 43.314 16.845 21.275 1.00 12.17 C ATOM 1425 O VAL A 61 42.414 16.001 21.246 1.00 13.10 O ATOM 1426 CB VAL A 61 45.359 16.372 22.581 1.00 12.09 C ATOM 1427 CG1 VAL A 61 46.174 16.785 23.783 1.00 12.42 C ATOM 1428 CG2 VAL A 61 45.120 14.857 22.585 1.00 12.93 C ATOM 1429 N ALA A 62 43.728 17.529 20.216 1.00 12.60 N ATOM 1430 CA ALA A 62 43.243 17.288 18.851 1.00 12.96 C ATOM 1431 C ALA A 62 44.439 17.384 17.924 1.00 13.63 C ATOM 1432 O ALA A 62 45.363 18.170 18.163 1.00 13.67 O ATOM 1433 CB ALA A 62 42.209 18.329 18.458 1.00 13.36 C ATOM 1434 N SER A 63 44.444 16.623 16.846 1.00 14.22 N ATOM 1435 CA SER A 63 45.557 16.667 15.908 1.00 14.74 C ATOM 1436 C SER A 63 45.100 16.146 14.556 1.00 15.86 C ATOM 1437 O SER A 63 44.648 15.012 14.456 1.00 16.22 O ATOM 1438 CB SER A 63 46.704 15.813 16.449 1.00 14.62 C ATOM 1439 OG SER A 63 47.814 15.812 15.570 1.00 14.33 O ATOM 1440 N GLN A 64 45.233 16.963 13.521 1.00 16.84 N ATOM 1441 CA GLN A 64 44.797 16.548 12.196 1.00 18.54 C ATOM 1442 C GLN A 64 45.589 15.340 11.712 1.00 19.14 C ATOM 1443 O GLN A 64 44.995 14.370 11.245 1.00 20.42 O ATOM 1444 CB GLN A 64 44.931 17.691 11.210 1.00 19.07 C ATOM 1445 CG GLN A 64 44.409 17.355 9.806 1.00 22.06 C ATOM 1446 CD GLN A 64 44.418 18.560 8.912 1.00 25.60 C ATOM 1447 OE1 GLN A 64 45.433 18.854 8.271 1.00 28.86 O ATOM 1448 NE2 GLN A 64 43.298 19.284 8.878 1.00 27.40 N ATOM 1449 N ASN A 65 46.913 15.384 11.844 1.00 19.32 N ATOM 1450 CA ASN A 65 47.796 14.409 11.202 1.00 20.16 C ATOM 1451 C ASN A 65 48.678 13.588 12.147 1.00 19.58 C ATOM 1452 O ASN A 65 49.412 12.696 11.706 1.00 20.12 O ATOM 1453 CB ASN A 65 48.674 15.120 10.170 1.00 21.25 C ATOM 1454 CG ASN A 65 47.860 15.826 9.104 1.00 23.94 C ATOM 1455 OD1 ASN A 65 47.058 15.205 8.414 1.00 27.81 O ATOM 1456 ND2 ASN A 65 48.044 17.135 8.985 1.00 27.05 N ATOM 1457 N GLY A 66 48.616 13.866 13.445 1.00 18.20 N ATOM 1458 CA GLY A 66 49.460 13.172 14.399 1.00 17.56 C ATOM 1459 C GLY A 66 50.904 13.649 14.378 1.00 16.68 C ATOM 1460 O GLY A 66 51.241 14.666 13.756 1.00 18.04 O ATOM 1461 N GLY A 67 51.759 12.903 15.073 1.00 16.15 N ATOM 1462 CA GLY A 67 53.183 13.174 15.108 1.00 15.75 C ATOM 1463 C GLY A 67 53.658 14.061 16.246 1.00 15.10 C ATOM 1464 O GLY A 67 54.857 14.218 16.430 1.00 16.29 O ATOM 1465 N GLY A 68 52.730 14.626 17.004 1.00 14.22 N ATOM 1466 CA GLY A 68 53.076 15.557 18.064 1.00 13.61 C ATOM 1467 C GLY A 68 53.524 14.883 19.335 1.00 13.11 C ATOM 1468 O GLY A 68 53.284 13.702 19.569 1.00 13.16 O ATOM 1469 N SER A 69 54.157 15.664 20.188 1.00 12.14 N ATOM 1470 CA SER A 69 54.552 15.207 21.520 1.00 11.68 C ATOM 1471 C SER A 69 54.785 16.408 22.407 1.00 10.87 C ATOM 1472 O SER A 69 55.100 17.513 21.924 1.00 11.36 O ATOM 1473 CB SER A 69 55.797 14.323 21.488 1.00 11.73 C ATOM 1474 OG SER A 69 56.876 15.015 20.897 1.00 14.53 O ATOM 1475 N LEU A 70 54.635 16.196 23.701 1.00 10.64 N ATOM 1476 CA LEU A 70 54.883 17.240 24.678 1.00 10.54 C ATOM 1477 C LEU A 70 55.645 16.734 25.880 1.00 11.25 C ATOM 1478 O LEU A 70 55.692 15.523 26.166 1.00 10.80 O ATOM 1479 CB LEU A 70 53.591 17.942 25.124 1.00 11.37 C ATOM 1480 CG LEU A 70 52.578 17.150 25.950 1.00 11.36 C ATOM 1481 CD1 LEU A 70 52.986 17.034 27.408 1.00 12.30 C ATOM 1482 CD2 LEU A 70 51.185 17.772 25.857 1.00 11.95 C ATOM 1483 N THR A 71 56.241 17.679 26.574 1.00 10.90 N ATOM 1484 CA THR A 71 56.876 17.488 27.867 1.00 11.16 C ATOM 1485 C THR A 71 56.122 18.290 28.924 1.00 10.86 C ATOM 1486 O THR A 71 55.853 19.492 28.733 1.00 11.86 O ATOM 1487 CB THR A 71 58.318 17.948 27.788 1.00 11.92 C ATOM 1488 OG1 THR A 71 59.030 17.098 26.872 1.00 12.63 O ATOM 1489 CG2 THR A 71 59.035 17.804 29.108 1.00 12.98 C ATOM 1490 N PHE A 72 55.732 17.642 30.009 1.00 10.26 N ATOM 1491 CA PHE A 72 55.122 18.246 31.189 1.00 9.70 C ATOM 1492 C PHE A 72 56.243 18.466 32.184 1.00 9.91 C ATOM 1493 O PHE A 72 56.995 17.542 32.508 1.00 10.00 O ATOM 1494 CB PHE A 72 54.070 17.293 31.750 1.00 10.85 C ATOM 1495 CG PHE A 72 53.312 17.816 32.943 1.00 11.01 C ATOM 1496 CD1 PHE A 72 52.611 19.011 32.866 1.00 12.06 C ATOM 1497 CD2 PHE A 72 53.245 17.091 34.125 1.00 12.40 C ATOM 1498 CE1 PHE A 72 51.890 19.464 33.952 1.00 12.41 C ATOM 1499 CE2 PHE A 72 52.531 17.564 35.210 1.00 13.00 C ATOM 1500 CZ PHE A 72 51.859 18.754 35.118 1.00 14.35 C ATOM 1501 N GLU A 73 56.399 19.698 32.649 1.00 10.06 N ATOM 1502 CA GLU A 73 57.575 20.098 33.407 1.00 11.02 C ATOM 1503 C GLU A 73 57.219 21.195 34.387 1.00 11.53 C ATOM 1504 O GLU A 73 56.100 21.707 34.420 1.00 11.35 O ATOM 1505 CB GLU A 73 58.673 20.560 32.450 1.00 12.54 C ATOM 1506 CG GLU A 73 58.275 21.690 31.534 1.00 13.75 C ATOM 1507 CD GLU A 73 59.317 21.995 30.487 1.00 18.49 C ATOM 1508 OE1 GLU A 73 60.026 21.064 30.071 1.00 21.90 O ATOM 1509 OE2 GLU A 73 59.407 23.165 30.092 1.00 21.44 O ATOM 1510 N GLU A 74 58.178 21.560 35.214 1.00 12.44 N ATOM 1511 CA GLU A 74 58.073 22.780 35.985 1.00 13.74 C ATOM 1512 C GLU A 74 58.373 23.932 35.043 1.00 14.79 C ATOM 1513 O GLU A 74 59.234 23.794 34.168 1.00 15.07 O ATOM 1514 CB GLU A 74 59.088 22.698 37.115 1.00 14.55 C ATOM 1515 CG GLU A 74 58.671 23.354 38.392 1.00 18.00 C ATOM 1516 CD GLU A 74 57.462 22.727 39.083 1.00 16.49 C ATOM 1517 OE1 GLU A 74 56.876 21.647 38.728 1.00 17.71 O ATOM 1518 OE2 GLU A 74 57.107 23.371 40.063 1.00 18.20 O ATOM 1519 N ALA A 75 57.666 25.057 35.177 1.00 16.30 N ATOM 1520 CA ALA A 75 57.925 26.238 34.360 1.00 17.34 C ATOM 1521 C ALA A 75 59.406 26.596 34.417 1.00 18.28 C ATOM 1522 O ALA A 75 59.995 26.603 35.488 1.00 18.48 O ATOM 1523 CB ALA A 75 57.070 27.434 34.817 1.00 17.80 C ATOM 1524 N GLY A 76 59.998 26.853 33.254 1.00 19.71 N ATOM 1525 CA GLY A 76 61.438 27.037 33.138 1.00 20.68 C ATOM 1526 C GLY A 76 62.193 25.805 32.656 1.00 21.32 C ATOM 1527 O GLY A 76 63.330 25.919 32.181 1.00 22.93 O ATOM 1528 N GLY A 77 61.600 24.617 32.779 1.00 21.31 N ATOM 1529 CA GLY A 77 62.170 23.414 32.194 1.00 21.32 C ATOM 1530 C GLY A 77 62.851 22.431 33.131 1.00 20.92 C ATOM 1531 O GLY A 77 63.377 21.418 32.672 1.00 21.94 O ATOM 1532 N ALA A 78 62.844 22.704 34.429 1.00 19.88 N ATOM 1533 CA ALA A 78 63.470 21.802 35.390 1.00 19.88 C ATOM 1534 C ALA A 78 62.787 21.853 36.753 1.00 18.56 C ATOM 1535 O ALA A 78 62.559 22.950 37.249 1.00 19.38 O ATOM 1536 CB ALA A 78 64.932 22.162 35.536 1.00 20.57 C ATOM 1537 N PRO A 79 62.438 20.711 37.357 1.00 17.17 N ATOM 1538 CA PRO A 79 62.553 19.385 36.742 1.00 16.22 C ATOM 1539 C PRO A 79 61.495 19.107 35.691 1.00 15.24 C ATOM 1540 O PRO A 79 60.450 19.770 35.634 1.00 16.34 O ATOM 1541 CB PRO A 79 62.325 18.435 37.917 1.00 16.59 C ATOM 1542 CG PRO A 79 61.491 19.188 38.845 1.00 18.77 C ATOM 1543 CD PRO A 79 61.901 20.608 38.720 1.00 16.91 C ATOM 1544 N VAL A 80 61.783 18.127 34.858 1.00 13.66 N ATOM 1545 CA VAL A 80 60.831 17.580 33.913 1.00 13.02 C ATOM 1546 C VAL A 80 60.101 16.426 34.556 1.00 12.30 C ATOM 1547 O VAL A 80 60.705 15.597 35.235 1.00 12.45 O ATOM 1548 CB VAL A 80 61.552 17.105 32.633 1.00 13.17 C ATOM 1549 CG1 VAL A 80 60.613 16.322 31.743 1.00 13.56 C ATOM 1550 CG2 VAL A 80 62.155 18.303 31.912 1.00 15.28 C ATOM 1551 N HIS A 81 58.798 16.372 34.358 1.00 11.17 N ATOM 1552 CA HIS A 81 57.948 15.339 34.945 1.00 10.74 C ATOM 1553 C HIS A 81 57.665 14.172 34.021 1.00 11.18 C ATOM 1554 O HIS A 81 57.692 13.014 34.439 1.00 11.24 O ATOM 1555 CB HIS A 81 56.645 15.961 35.424 1.00 11.45 C ATOM 1556 CG HIS A 81 56.837 17.172 36.291 1.00 10.40 C ATOM 1557 ND1 HIS A 81 57.658 17.187 37.396 1.00 11.49 N ATOM 1558 CD2 HIS A 81 56.303 18.414 36.203 1.00 11.83 C ATOM 1559 CE1 HIS A 81 57.619 18.390 37.953 1.00 11.34 C ATOM 1560 NE2 HIS A 81 56.800 19.149 37.251 1.00 12.16 N ATOM 1561 N GLY A 82 57.385 14.448 32.764 1.00 11.21 N ATOM 1562 CA GLY A 82 57.101 13.369 31.842 1.00 11.42 C ATOM 1563 C GLY A 82 56.893 13.814 30.429 1.00 11.52 C ATOM 1564 O GLY A 82 56.833 15.001 30.153 1.00 12.52 O ATOM 1565 N THR A 83 56.780 12.869 29.513 1.00 11.12 N ATOM 1566 CA THR A 83 56.537 13.122 28.112 1.00 11.21 C ATOM 1567 C THR A 83 55.391 12.256 27.645 1.00 10.96 C ATOM 1568 O THR A 83 55.101 11.198 28.228 1.00 11.37 O ATOM 1569 CB THR A 83 57.777 12.796 27.264 1.00 10.74 C ATOM 1570 OG1 THR A 83 58.119 11.398 27.418 1.00 11.80 O ATOM 1571 CG2 THR A 83 58.977 13.640 27.678 1.00 11.73 C ATOM 1572 N ILE A 84 54.738 12.682 26.574 1.00 10.69 N ATOM 1573 CA ILE A 84 53.620 11.929 26.031 1.00 11.41 C ATOM 1574 C ILE A 84 53.487 12.201 24.546 1.00 12.11 C ATOM 1575 O ILE A 84 53.655 13.328 24.080 1.00 12.05 O ATOM 1576 CB ILE A 84 52.314 12.236 26.826 1.00 11.60 C ATOM 1577 CG1 ILE A 84 51.183 11.301 26.425 1.00 12.44 C ATOM 1578 CG2 ILE A 84 51.905 13.689 26.667 1.00 12.79 C ATOM 1579 CD1 ILE A 84 49.958 11.394 27.337 1.00 14.34 C ATOM 1580 N ALA A 85 53.190 11.134 23.810 1.00 12.78 N ATOM 1581 CA ALA A 85 52.893 11.213 22.387 1.00 13.22 C ATOM 1582 C ALA A 85 51.443 11.599 22.162 1.00 14.26 C ATOM 1583 O ALA A 85 50.551 11.153 22.868 1.00 14.33 O ATOM 1584 CB ALA A 85 53.195 9.883 21.707 1.00 14.06 C ATOM 1585 N ILE A 86 51.206 12.424 21.157 1.00 15.04 N ATOM 1586 CA ILE A 86 49.873 12.919 20.874 1.00 15.57 C ATOM 1587 C ILE A 86 49.391 12.281 19.574 1.00 15.91 C ATOM 1588 O ILE A 86 49.962 12.514 18.525 1.00 15.58 O ATOM 1589 CB ILE A 86 49.885 14.437 20.808 1.00 16.23 C ATOM 1590 CG1 ILE A 86 50.417 14.957 22.159 1.00 18.66 C ATOM 1591 CG2 ILE A 86 48.487 14.954 20.492 1.00 16.85 C ATOM 1592 CD1 ILE A 86 51.015 16.275 22.142 1.00 18.25 C ATOM 1593 N PRO A 87 48.336 11.478 19.648 1.00 16.66 N ATOM 1594 CA PRO A 87 47.901 10.716 18.474 1.00 17.51 C ATOM 1595 C PRO A 87 47.181 11.600 17.471 1.00 17.13 C ATOM 1596 O PRO A 87 46.689 12.666 17.818 1.00 17.56 O ATOM 1597 CB PRO A 87 46.924 9.711 19.082 1.00 18.10 C ATOM 1598 CG PRO A 87 46.306 10.437 20.203 1.00 19.05 C ATOM 1599 CD PRO A 87 47.447 11.255 20.804 1.00 17.05 C ATOM 1600 N ALA A 88 47.104 11.156 16.225 1.00 17.56 N ATOM 1601 CA ALA A 88 46.179 11.757 15.280 1.00 17.95 C ATOM 1602 C ALA A 88 44.757 11.498 15.758 1.00 18.47 C ATOM 1603 O ALA A 88 44.450 10.409 16.244 1.00 19.50 O ATOM 1604 CB ALA A 88 46.368 11.172 13.884 1.00 18.53 C ATOM 1605 N THR A 89 43.917 12.515 15.679 1.00 18.43 N ATOM 1606 CA THR A 89 42.494 12.396 15.956 1.00 19.69 C ATOM 1607 C THR A 89 41.668 12.642 14.671 1.00 20.87 C ATOM 1608 O THR A 89 40.466 12.431 14.675 1.00 23.76 O ATOM 1609 CB THR A 89 42.072 13.413 17.041 1.00 18.92 C ATOM 1610 OG1 THR A 89 42.208 14.737 16.515 1.00 16.64 O ATOM 1611 CG2 THR A 89 42.971 13.352 18.296 1.00 20.00 C ATOM 1612 N GLY A 90 42.315 13.093 13.600 1.00 22.06 N ATOM 1613 CA GLY A 90 41.674 13.273 12.302 1.00 22.25 C ATOM 1614 C GLY A 90 41.142 14.664 12.041 1.00 22.40 C ATOM 1615 O GLY A 90 40.669 14.959 10.934 1.00 23.90 O ATOM 1616 N GLY A 91 41.191 15.534 13.042 1.00 20.61 N ATOM 1617 CA GLY A 91 40.781 16.898 12.831 1.00 19.48 C ATOM 1618 C GLY A 91 41.269 17.821 13.921 1.00 18.17 C ATOM 1619 O GLY A 91 41.515 17.388 15.052 1.00 17.58 O ATOM 1620 N TRP A 92 41.376 19.095 13.583 1.00 17.47 N ATOM 1621 CA TRP A 92 41.844 20.112 14.522 1.00 17.05 C ATOM 1622 C TRP A 92 40.845 20.353 15.650 1.00 16.77 C ATOM 1623 O TRP A 92 41.189 20.902 16.686 1.00 15.22 O ATOM 1624 CB TRP A 92 42.109 21.425 13.797 1.00 17.29 C ATOM 1625 CG TRP A 92 43.268 21.401 12.864 1.00 17.85 C ATOM 1626 CD1 TRP A 92 43.252 21.660 11.525 1.00 19.95 C ATOM 1627 CD2 TRP A 92 44.632 21.127 13.198 1.00 16.57 C ATOM 1628 NE1 TRP A 92 44.521 21.563 11.009 1.00 20.32 N ATOM 1629 CE2 TRP A 92 45.389 21.234 12.017 1.00 18.47 C ATOM 1630 CE3 TRP A 92 45.297 20.803 14.388 1.00 16.91 C ATOM 1631 CZ2 TRP A 92 46.767 21.036 11.987 1.00 17.60 C ATOM 1632 CZ3 TRP A 92 46.664 20.614 14.354 1.00 18.12 C ATOM 1633 CH2 TRP A 92 47.384 20.728 13.165 1.00 19.30 C ATOM 1634 N GLN A 93 39.587 19.976 15.436 1.00 16.09 N ATOM 1635 CA GLN A 93 38.560 20.076 16.474 1.00 16.39 C ATOM 1636 C GLN A 93 37.893 18.719 16.695 1.00 16.42 C ATOM 1637 O GLN A 93 36.722 18.651 17.074 1.00 17.53 O ATOM 1638 CB GLN A 93 37.553 21.179 16.141 1.00 16.09 C ATOM 1639 CG GLN A 93 38.159 22.561 16.065 1.00 16.77 C ATOM 1640 CD GLN A 93 38.615 23.123 17.414 1.00 16.19 C ATOM 1641 OE1 GLN A 93 39.570 23.923 17.467 1.00 18.08 O ATOM 1642 NE2 GLN A 93 37.924 22.762 18.478 1.00 13.55 N ATOM 1643 N THR A 94 38.656 17.644 16.501 1.00 16.52 N ATOM 1644 CA THR A 94 38.238 16.304 16.903 1.00 16.86 C ATOM 1645 C THR A 94 39.082 15.951 18.117 1.00 16.80 C ATOM 1646 O THR A 94 40.280 15.782 18.001 1.00 16.88 O ATOM 1647 CB THR A 94 38.435 15.292 15.771 1.00 17.65 C ATOM 1648 OG1 THR A 94 37.677 15.708 14.623 1.00 19.66 O ATOM 1649 CG2 THR A 94 37.861 13.934 16.145 1.00 18.84 C ATOM 1650 N TRP A 95 38.434 15.877 19.269 1.00 15.86 N ATOM 1651 CA TRP A 95 39.116 15.854 20.561 1.00 15.84 C ATOM 1652 C TRP A 95 39.133 14.470 21.197 1.00 16.50 C ATOM 1653 O TRP A 95 38.197 13.667 21.051 1.00 17.05 O ATOM 1654 CB TRP A 95 38.444 16.858 21.491 1.00 15.74 C ATOM 1655 CG TRP A 95 38.588 18.250 20.985 1.00 15.35 C ATOM 1656 CD1 TRP A 95 37.726 18.924 20.174 1.00 15.99 C ATOM 1657 CD2 TRP A 95 39.713 19.105 21.166 1.00 13.87 C ATOM 1658 NE1 TRP A 95 38.230 20.163 19.871 1.00 15.14 N ATOM 1659 CE2 TRP A 95 39.459 20.296 20.469 1.00 14.28 C ATOM 1660 CE3 TRP A 95 40.904 19.000 21.891 1.00 12.46 C ATOM 1661 CZ2 TRP A 95 40.358 21.366 20.454 1.00 13.67 C ATOM 1662 CZ3 TRP A 95 41.796 20.048 21.864 1.00 13.28 C ATOM 1663 CH2 TRP A 95 41.520 21.222 21.166 1.00 13.59 C ATOM 1664 N THR A 96 40.205 14.183 21.920 1.00 16.16 N ATOM 1665 CA THR A 96 40.304 12.983 22.737 1.00 16.54 C ATOM 1666 C THR A 96 41.127 13.309 23.971 1.00 15.40 C ATOM 1667 O THR A 96 41.835 14.314 24.003 1.00 14.84 O ATOM 1668 CB THR A 96 40.959 11.849 21.920 1.00 16.79 C ATOM 1669 OG1 THR A 96 40.786 10.576 22.574 1.00 20.99 O ATOM 1670 CG2 THR A 96 42.461 12.044 21.795 1.00 17.58 C ATOM 1671 N THR A 97 41.049 12.461 24.980 1.00 14.60 N ATOM 1672 CA THR A 97 41.821 12.619 26.203 1.00 14.61 C ATOM 1673 C THR A 97 42.870 11.529 26.273 1.00 14.46 C ATOM 1674 O THR A 97 42.568 10.338 26.129 1.00 15.77 O ATOM 1675 CB THR A 97 40.911 12.552 27.422 1.00 13.98 C ATOM 1676 OG1 THR A 97 39.897 13.563 27.308 1.00 16.22 O ATOM 1677 CG2 THR A 97 41.676 12.896 28.716 1.00 15.75 C ATOM 1678 N ILE A 98 44.114 11.944 26.463 1.00 13.19 N ATOM 1679 CA ILE A 98 45.246 11.050 26.649 1.00 12.70 C ATOM 1680 C ILE A 98 45.792 11.262 28.043 1.00 12.11 C ATOM 1681 O ILE A 98 45.467 12.238 28.696 1.00 12.25 O ATOM 1682 CB ILE A 98 46.323 11.305 25.569 1.00 13.00 C ATOM 1683 CG1 ILE A 98 46.911 12.718 25.672 1.00 12.91 C ATOM 1684 CG2 ILE A 98 45.728 11.027 24.186 1.00 14.26 C ATOM 1685 CD1 ILE A 98 48.049 13.021 24.703 1.00 14.33 C ATOM 1686 N GLN A 99 46.592 10.327 28.512 1.00 12.41 N ATOM 1687 CA GLN A 99 47.079 10.382 29.872 1.00 12.73 C ATOM 1688 C GLN A 99 48.372 9.618 30.040 1.00 12.50 C ATOM 1689 O GLN A 99 48.706 8.710 29.263 1.00 13.11 O ATOM 1690 CB GLN A 99 46.038 9.811 30.848 1.00 13.67 C ATOM 1691 CG GLN A 99 45.794 8.293 30.670 1.00 17.18 C ATOM 1692 CD GLN A 99 44.672 7.709 31.535 1.00 22.01 C ATOM 1693 OE1 GLN A 99 44.823 6.612 32.090 1.00 28.13 O ATOM 1694 NE2 GLN A 99 43.565 8.418 31.644 1.00 24.78 N ATOM 1695 N HIS A 100 49.114 10.028 31.058 1.00 12.06 N ATOM 1696 CA HIS A 100 50.283 9.320 31.544 1.00 12.09 C ATOM 1697 C HIS A 100 50.460 9.564 33.012 1.00 11.87 C ATOM 1698 O HIS A 100 49.766 10.391 33.597 1.00 12.11 O ATOM 1699 CB HIS A 100 51.532 9.698 30.767 1.00 12.25 C ATOM 1700 CG HIS A 100 52.046 11.111 30.940 1.00 12.73 C ATOM 1701 ND1 HIS A 100 51.283 12.248 31.124 1.00 15.48 N ATOM 1702 CD2 HIS A 100 53.317 11.549 30.842 1.00 11.88 C ATOM 1703 CE1 HIS A 100 52.080 13.311 31.176 1.00 10.25 C ATOM 1704 NE2 HIS A 100 53.312 12.909 30.986 1.00 16.63 N ATOM 1705 N THR A 101 51.381 8.837 33.618 1.00 11.96 N ATOM 1706 CA THR A 101 51.736 9.032 35.003 1.00 12.67 C ATOM 1707 C THR A 101 53.104 9.640 35.151 1.00 12.35 C ATOM 1708 O THR A 101 54.000 9.396 34.350 1.00 12.94 O ATOM 1709 CB THR A 101 51.718 7.722 35.786 1.00 13.55 C ATOM 1710 OG1 THR A 101 52.700 6.818 35.238 1.00 15.86 O ATOM 1711 CG2 THR A 101 50.376 7.074 35.701 1.00 13.65 C ATOM 1712 N VAL A 102 53.250 10.420 36.201 1.00 11.34 N ATOM 1713 CA VAL A 102 54.504 11.068 36.562 1.00 11.40 C ATOM 1714 C VAL A 102 54.632 11.007 38.070 1.00 11.35 C ATOM 1715 O VAL A 102 53.630 10.826 38.767 1.00 12.88 O ATOM 1716 CB VAL A 102 54.553 12.559 36.097 1.00 11.70 C ATOM 1717 CG1 VAL A 102 54.381 12.654 34.598 1.00 12.41 C ATOM 1718 CG2 VAL A 102 53.494 13.429 36.801 1.00 12.25 C ATOM 1719 N ASN A 103 55.850 11.123 38.566 1.00 11.58 N ATOM 1720 CA ASN A 103 56.094 11.342 39.970 1.00 11.87 C ATOM 1721 C ASN A 103 56.169 12.844 40.226 1.00 12.35 C ATOM 1722 O ASN A 103 56.837 13.574 39.480 1.00 13.35 O ATOM 1723 CB ASN A 103 57.413 10.690 40.403 1.00 12.05 C ATOM 1724 CG ASN A 103 57.738 10.990 41.830 1.00 13.51 C ATOM 1725 OD1 ASN A 103 58.687 11.730 42.150 1.00 16.82 O ATOM 1726 ND2 ASN A 103 56.928 10.466 42.704 1.00 12.04 N ATOM 1727 N LEU A 104 55.486 13.315 41.268 1.00 12.41 N ATOM 1728 CA LEU A 104 55.590 14.720 41.680 1.00 12.40 C ATOM 1729 C LEU A 104 55.914 14.802 43.156 1.00 13.59 C ATOM 1730 O LEU A 104 55.356 14.037 43.946 1.00 14.10 O ATOM 1731 CB LEU A 104 54.291 15.480 41.425 1.00 12.37 C ATOM 1732 CG LEU A 104 53.809 15.556 39.979 1.00 11.47 C ATOM 1733 CD1 LEU A 104 52.430 16.175 39.893 1.00 11.92 C ATOM 1734 CD2 LEU A 104 54.797 16.321 39.131 1.00 13.23 C ATOM 1735 N SER A 105 56.751 15.759 43.516 1.00 13.85 N ATOM 1736 CA SER A 105 57.085 16.026 44.910 1.00 15.03 C ATOM 1737 C SER A 105 55.977 16.855 45.562 1.00 15.14 C ATOM 1738 O SER A 105 55.297 17.643 44.905 1.00 14.69 O ATOM 1739 CB SER A 105 58.402 16.780 44.978 1.00 15.74 C ATOM 1740 OG SER A 105 58.312 18.024 44.322 1.00 20.16 O ATOM 1741 N ALA A 106 55.796 16.681 46.866 1.00 15.12 N ATOM 1742 CA ALA A 106 54.826 17.462 47.617 1.00 15.54 C ATOM 1743 C ALA A 106 55.229 18.919 47.612 1.00 15.45 C ATOM 1744 O ALA A 106 56.404 19.247 47.660 1.00 16.85 O ATOM 1745 CB ALA A 106 54.729 16.964 49.050 1.00 16.18 C ATOM 1746 N GLY A 107 54.240 19.797 47.567 1.00 15.51 N ATOM 1747 CA GLY A 107 54.468 21.222 47.697 1.00 15.31 C ATOM 1748 C GLY A 107 53.864 22.002 46.551 1.00 15.36 C ATOM 1749 O GLY A 107 53.105 21.474 45.756 1.00 14.30 O ATOM 1750 N SER A 108 54.237 23.269 46.449 1.00 15.37 N ATOM 1751 CA SER A 108 53.664 24.158 45.451 1.00 16.31 C ATOM 1752 C SER A 108 54.464 23.985 44.173 1.00 16.06 C ATOM 1753 O SER A 108 55.691 23.977 44.199 1.00 18.27 O ATOM 1754 CB SER A 108 53.705 25.606 45.933 1.00 16.97 C ATOM 1755 OG SER A 108 53.036 26.459 45.013 1.00 21.66 O ATOM 1756 N HIS A 109 53.759 23.792 43.070 1.00 14.14 N ATOM 1757 CA HIS A 109 54.358 23.654 41.751 1.00 13.66 C ATOM 1758 C HIS A 109 53.880 24.734 40.808 1.00 13.59 C ATOM 1759 O HIS A 109 52.750 25.187 40.878 1.00 14.16 O ATOM 1760 CB HIS A 109 53.978 22.311 41.140 1.00 13.29 C ATOM 1761 CG HIS A 109 54.715 21.144 41.712 1.00 13.02 C ATOM 1762 ND1 HIS A 109 55.680 20.460 41.006 1.00 14.81 N ATOM 1763 CD2 HIS A 109 54.610 20.523 42.909 1.00 13.39 C ATOM 1764 CE1 HIS A 109 56.147 19.474 41.753 1.00 14.22 C ATOM 1765 NE2 HIS A 109 55.527 19.499 42.922 1.00 14.69 N ATOM 1766 N GLN A 110 54.743 25.119 39.893 1.00 12.92 N ATOM 1767 CA GLN A 110 54.424 26.012 38.795 1.00 12.84 C ATOM 1768 C GLN A 110 54.677 25.200 37.550 1.00 12.65 C ATOM 1769 O GLN A 110 55.839 24.932 37.211 1.00 14.94 O ATOM 1770 CB GLN A 110 55.335 27.234 38.846 1.00 13.75 C ATOM 1771 CG GLN A 110 55.001 28.152 40.021 1.00 15.58 C ATOM 1772 CD GLN A 110 55.982 29.273 40.194 1.00 21.28 C ATOM 1773 OE1 GLN A 110 57.128 29.039 40.571 1.00 26.76 O ATOM 1774 NE2 GLN A 110 55.534 30.494 39.959 1.00 24.12 N ATOM 1775 N PHE A 111 53.615 24.766 36.892 1.00 10.90 N ATOM 1776 CA PHE A 111 53.721 23.832 35.782 1.00 10.91 C ATOM 1777 C PHE A 111 53.879 24.531 34.445 1.00 10.88 C ATOM 1778 O PHE A 111 53.448 25.668 34.264 1.00 11.28 O ATOM 1779 CB PHE A 111 52.510 22.899 35.741 1.00 11.24 C ATOM 1780 CG PHE A 111 52.444 21.954 36.902 1.00 11.23 C ATOM 1781 CD1 PHE A 111 51.406 22.009 37.819 1.00 11.73 C ATOM 1782 CD2 PHE A 111 53.436 21.002 37.091 1.00 11.54 C ATOM 1783 CE1 PHE A 111 51.361 21.117 38.896 1.00 12.12 C ATOM 1784 CE2 PHE A 111 53.389 20.111 38.137 1.00 12.67 C ATOM 1785 CZ PHE A 111 52.355 20.156 39.039 1.00 12.13 C ATOM 1786 N GLY A 112 54.472 23.824 33.509 1.00 11.04 N ATOM 1787 CA GLY A 112 54.592 24.247 32.132 1.00 11.33 C ATOM 1788 C GLY A 112 54.522 23.066 31.189 1.00 11.61 C ATOM 1789 O GLY A 112 54.662 21.898 31.599 1.00 11.25 O ATOM 1790 N ILE A 113 54.277 23.373 29.930 1.00 11.43 N ATOM 1791 CA ILE A 113 54.236 22.406 28.845 1.00 11.86 C ATOM 1792 C ILE A 113 55.141 22.893 27.723 1.00 11.84 C ATOM 1793 O ILE A 113 55.062 24.059 27.308 1.00 11.83 O ATOM 1794 CB ILE A 113 52.820 22.240 28.312 1.00 12.52 C ATOM 1795 CG1 ILE A 113 51.951 21.577 29.391 1.00 15.26 C ATOM 1796 CG2 ILE A 113 52.807 21.428 27.018 1.00 14.48 C ATOM 1797 CD1 ILE A 113 50.514 21.503 29.053 1.00 16.89 C ATOM 1798 N LYS A 114 56.018 22.025 27.240 1.00 12.20 N ATOM 1799 CA LYS A 114 56.847 22.326 26.074 1.00 12.96 C ATOM 1800 C LYS A 114 56.498 21.338 24.973 1.00 11.91 C ATOM 1801 O LYS A 114 56.454 20.125 25.208 1.00 11.70 O ATOM 1802 CB LYS A 114 58.324 22.209 26.436 1.00 14.58 C ATOM 1803 CG LYS A 114 59.277 22.391 25.251 1.00 18.95 C ATOM 1804 CD LYS A 114 59.922 23.760 25.180 1.00 24.16 C ATOM 1805 CE LYS A 114 61.442 23.643 25.089 1.00 28.55 C ATOM 1806 NZ LYS A 114 62.167 24.771 25.746 1.00 31.10 N ATOM 1807 N ALA A 115 56.291 21.828 23.762 1.00 11.31 N ATOM 1808 CA ALA A 115 56.046 20.973 22.611 1.00 11.35 C ATOM 1809 C ALA A 115 57.359 20.472 22.060 1.00 11.82 C ATOM 1810 O ALA A 115 58.225 21.247 21.720 1.00 12.77 O ATOM 1811 CB ALA A 115 55.298 21.732 21.534 1.00 11.78 C ATOM 1812 N ASN A 116 57.507 19.160 21.991 1.00 11.50 N ATOM 1813 CA ASN A 116 58.685 18.547 21.379 1.00 12.29 C ATOM 1814 C ASN A 116 58.497 18.328 19.892 1.00 13.15 C ATOM 1815 O ASN A 116 59.474 18.317 19.137 1.00 14.54 O ATOM 1816 CB ASN A 116 59.045 17.246 22.086 1.00 12.24 C ATOM 1817 CG ASN A 116 59.214 17.443 23.568 1.00 13.28 C ATOM 1818 OD1 ASN A 116 60.161 18.116 24.006 1.00 18.97 O ATOM 1819 ND2 ASN A 116 58.305 16.929 24.330 1.00 11.94 N ATOM 1820 N ALA A 117 57.255 18.170 19.469 1.00 13.22 N ATOM 1821 CA ALA A 117 56.891 18.089 18.057 1.00 13.28 C ATOM 1822 C ALA A 117 55.519 18.709 17.979 1.00 13.77 C ATOM 1823 O ALA A 117 54.719 18.524 18.900 1.00 13.85 O ATOM 1824 CB ALA A 117 56.863 16.652 17.586 1.00 13.66 C ATOM 1825 N GLY A 118 55.239 19.456 16.919 1.00 13.64 N ATOM 1826 CA GLY A 118 54.011 20.215 16.825 1.00 14.10 C ATOM 1827 C GLY A 118 52.896 19.431 16.151 1.00 13.41 C ATOM 1828 O GLY A 118 52.933 18.201 16.064 1.00 14.03 O ATOM 1829 N GLY A 119 51.877 20.147 15.697 1.00 13.17 N ATOM 1830 CA GLY A 119 50.793 19.564 14.930 1.00 13.31 C ATOM 1831 C GLY A 119 49.604 19.118 15.742 1.00 13.41 C ATOM 1832 O GLY A 119 48.844 18.272 15.300 1.00 14.38 O ATOM 1833 N TRP A 120 49.426 19.714 16.922 1.00 12.16 N ATOM 1834 CA TRP A 120 48.332 19.377 17.816 1.00 12.40 C ATOM 1835 C TRP A 120 47.808 20.635 18.492 1.00 11.89 C ATOM 1836 O TRP A 120 48.472 21.680 18.524 1.00 12.15 O ATOM 1837 CB TRP A 120 48.770 18.331 18.857 1.00 12.51 C ATOM 1838 CG TRP A 120 50.009 18.693 19.585 1.00 11.75 C ATOM 1839 CD1 TRP A 120 51.277 18.592 19.116 1.00 12.70 C ATOM 1840 CD2 TRP A 120 50.126 19.231 20.912 1.00 10.83 C ATOM 1841 NE1 TRP A 120 52.175 19.042 20.051 1.00 12.83 N ATOM 1842 CE2 TRP A 120 51.492 19.438 21.167 1.00 11.25 C ATOM 1843 CE3 TRP A 120 49.211 19.564 21.915 1.00 12.78 C ATOM 1844 CZ2 TRP A 120 51.967 19.962 22.361 1.00 11.82 C ATOM 1845 CZ3 TRP A 120 49.692 20.070 23.115 1.00 12.90 C ATOM 1846 CH2 TRP A 120 51.058 20.262 23.325 1.00 12.26 C ATOM 1847 N ASN A 121 46.603 20.504 19.041 1.00 11.88 N ATOM 1848 CA ASN A 121 45.904 21.526 19.808 1.00 11.89 C ATOM 1849 C ASN A 121 45.636 21.013 21.223 1.00 11.50 C ATOM 1850 O ASN A 121 45.555 19.812 21.442 1.00 11.64 O ATOM 1851 CB ASN A 121 44.557 21.843 19.171 1.00 12.34 C ATOM 1852 CG ASN A 121 44.675 22.511 17.827 1.00 12.85 C ATOM 1853 OD1 ASN A 121 45.703 23.115 17.505 1.00 12.74 O ATOM 1854 ND2 ASN A 121 43.607 22.422 17.031 1.00 13.94 N ATOM 1855 N LEU A 122 45.487 21.926 22.167 1.00 10.99 N ATOM 1856 CA LEU A 122 45.315 21.595 23.579 1.00 10.50 C ATOM 1857 C LEU A 122 44.163 22.412 24.146 1.00 10.69 C ATOM 1858 O LEU A 122 44.171 23.639 24.076 1.00 11.21 O ATOM 1859 CB LEU A 122 46.593 21.882 24.363 1.00 10.74 C ATOM 1860 CG LEU A 122 46.609 21.436 25.830 1.00 10.89 C ATOM 1861 CD1 LEU A 122 46.567 19.932 25.956 1.00 11.69 C ATOM 1862 CD2 LEU A 122 47.855 21.978 26.526 1.00 11.63 C ATOM 1863 N ASN A 123 43.185 21.720 24.727 1.00 10.74 N ATOM 1864 CA ASN A 123 42.030 22.361 25.342 1.00 11.09 C ATOM 1865 C ASN A 123 42.259 22.622 26.834 1.00 10.45 C ATOM 1866 O ASN A 123 42.022 23.730 27.322 1.00 11.37 O ATOM 1867 CB ASN A 123 40.765 21.503 25.099 1.00 11.22 C ATOM 1868 CG ASN A 123 39.480 22.203 25.472 1.00 12.48 C ATOM 1869 OD1 ASN A 123 39.488 23.326 25.903 1.00 13.45 O ATOM 1870 ND2 ASN A 123 38.345 21.523 25.263 1.00 13.34 N ATOM 1871 N TRP A 124 42.680 21.579 27.544 1.00 10.55 N ATOM 1872 CA TRP A 124 42.887 21.641 28.978 1.00 10.79 C ATOM 1873 C TRP A 124 43.739 20.471 29.411 1.00 10.26 C ATOM 1874 O TRP A 124 43.966 19.526 28.649 1.00 11.20 O ATOM 1875 CB TRP A 124 41.542 21.668 29.750 1.00 10.89 C ATOM 1876 CG TRP A 124 40.543 20.613 29.401 1.00 12.23 C ATOM 1877 CD1 TRP A 124 39.428 20.809 28.649 1.00 13.53 C ATOM 1878 CD2 TRP A 124 40.515 19.227 29.801 1.00 12.09 C ATOM 1879 NE1 TRP A 124 38.723 19.642 28.529 1.00 14.40 N ATOM 1880 CE2 TRP A 124 39.353 18.650 29.222 1.00 13.39 C ATOM 1881 CE3 TRP A 124 41.353 18.405 30.571 1.00 13.18 C ATOM 1882 CZ2 TRP A 124 39.009 17.299 29.383 1.00 14.34 C ATOM 1883 CZ3 TRP A 124 41.009 17.053 30.727 1.00 13.19 C ATOM 1884 CH2 TRP A 124 39.837 16.521 30.121 1.00 14.29 C ATOM 1885 N ILE A 125 44.215 20.568 30.645 1.00 11.17 N ATOM 1886 CA ILE A 125 44.984 19.527 31.312 1.00 12.17 C ATOM 1887 C ILE A 125 44.359 19.265 32.680 1.00 11.80 C ATOM 1888 O ILE A 125 43.754 20.152 33.277 1.00 12.44 O ATOM 1889 CB ILE A 125 46.483 19.892 31.429 1.00 14.91 C ATOM 1890 CG1 ILE A 125 46.797 20.895 32.491 1.00 18.35 C ATOM 1891 CG2 ILE A 125 47.015 20.453 30.121 1.00 16.63 C ATOM 1892 CD1 ILE A 125 48.309 20.957 32.770 1.00 20.68 C ATOM 1893 N ARG A 126 44.485 18.044 33.174 1.00 11.83 N ATOM 1894 CA ARG A 126 43.950 17.723 34.488 1.00 12.33 C ATOM 1895 C ARG A 126 44.950 16.854 35.214 1.00 11.41 C ATOM 1896 O ARG A 126 45.458 15.894 34.660 1.00 11.94 O ATOM 1897 CB ARG A 126 42.602 17.036 34.373 1.00 12.97 C ATOM 1898 CG ARG A 126 41.858 16.943 35.693 1.00 14.14 C ATOM 1899 CD ARG A 126 40.360 16.806 35.545 1.00 18.57 C ATOM 1900 NE ARG A 126 40.070 15.671 34.692 1.00 20.54 N ATOM 1901 CZ ARG A 126 39.003 15.523 33.924 1.00 23.25 C ATOM 1902 NH1 ARG A 126 38.904 14.433 33.183 1.00 24.03 N ATOM 1903 NH2 ARG A 126 38.027 16.423 33.896 1.00 25.65 N ATOM 1904 N ILE A 127 45.213 17.199 36.469 1.00 11.34 N ATOM 1905 CA ILE A 127 46.119 16.479 37.334 1.00 11.69 C ATOM 1906 C ILE A 127 45.294 15.712 38.349 1.00 12.03 C ATOM 1907 O ILE A 127 44.421 16.288 39.011 1.00 12.67 O ATOM 1908 CB ILE A 127 47.056 17.455 38.043 1.00 12.01 C ATOM 1909 CG1 ILE A 127 47.807 18.308 37.023 1.00 13.68 C ATOM 1910 CG2 ILE A 127 48.024 16.720 38.959 1.00 11.43 C ATOM 1911 CD1 ILE A 127 48.671 19.362 37.619 1.00 15.65 C ATOM 1912 N ASN A 128 45.577 14.417 38.479 1.00 12.84 N ATOM 1913 CA ASN A 128 44.786 13.504 39.316 1.00 14.41 C ATOM 1914 C ASN A 128 45.681 12.724 40.255 1.00 15.93 C ATOM 1915 O ASN A 128 46.763 12.282 39.880 1.00 14.40 O ATOM 1916 CB ASN A 128 44.005 12.504 38.468 1.00 14.44 C ATOM 1917 CG ASN A 128 43.177 13.157 37.413 1.00 15.37 C ATOM 1918 OD1 ASN A 128 42.023 13.529 37.660 1.00 17.78 O ATOM 1919 ND2 ASN A 128 43.743 13.325 36.224 1.00 15.55 N ATOM 1920 N LYS A 129 45.233 12.534 41.488 1.00 18.83 N ATOM 1921 CA LYS A 129 45.951 11.670 42.409 1.00 22.93 C ATOM 1922 C LYS A 129 45.701 10.234 41.959 1.00 25.69 C ATOM 1923 O LYS A 129 44.663 9.929 41.373 1.00 27.56 O ATOM 1924 CB LYS A 129 45.503 11.924 43.864 1.00 23.71 C ATOM 1925 CG LYS A 129 46.585 11.586 44.905 1.00 26.55 C ATOM 1926 CD LYS A 129 46.430 12.307 46.246 1.00 29.35 C ATOM 1927 CE LYS A 129 47.453 11.785 47.264 1.00 31.57 C ATOM 1928 NZ LYS A 129 47.384 12.408 48.642 1.00 31.92 N ATOM 1929 N THR A 130 46.705 9.379 42.107 1.00 28.19 N ATOM 1930 CA THR A 130 46.527 7.944 41.930 1.00 30.39 C ATOM 1931 C THR A 130 46.350 7.352 43.324 1.00 32.65 C ATOM 1932 O THR A 130 45.379 6.653 43.566 1.00 33.63 O ATOM 1933 CB THR A 130 47.739 7.301 41.229 1.00 30.58 C ATOM 1934 OG1 THR A 130 48.898 7.429 42.060 1.00 31.50 O ATOM 1935 CG2 THR A 130 48.124 8.036 39.948 1.00 29.42 C ATOM 1936 N HIS A 131 47.311 7.675 44.204 1.00 34.70 N ATOM 1937 CA HIS A 131 47.376 7.338 45.639 1.00 36.29 C ATOM 1938 C HIS A 131 48.642 6.518 45.875 1.00 36.63 C ATOM 1939 O HIS A 131 49.742 6.927 45.474 1.00 36.94 O ATOM 1940 CB HIS A 131 46.138 6.598 46.177 1.00 36.86 C ATOM 1941 CG HIS A 131 44.989 7.500 46.516 1.00 39.30 C ATOM 1942 ND1 HIS A 131 45.081 8.503 47.459 1.00 41.98 N ATOM 1943 CD2 HIS A 131 43.716 7.539 46.051 1.00 41.74 C ATOM 1944 CE1 HIS A 131 43.919 9.125 47.555 1.00 42.63 C ATOM 1945 NE2 HIS A 131 43.073 8.561 46.710 1.00 42.78 N TER 1946 HIS B 131 HETATM 1947 O HOH A2001 72.137 28.127 21.688 1.00 38.58 O HETATM 1948 O HOH A2002 63.561 25.071 21.726 1.00 34.41 O HETATM 1949 O HOH A2003 66.680 24.157 20.884 1.00 39.45 O HETATM 1950 O HOH A2004 61.367 29.321 23.185 1.00 21.74 O HETATM 1951 O HOH A2005 63.186 22.798 16.762 1.00 34.09 O HETATM 1952 O HOH A2006 61.064 24.233 15.983 1.00 20.29 O HETATM 1953 O HOH A2007 55.893 28.782 16.611 1.00 11.43 O HETATM 1954 O HOH A2008 50.194 21.253 4.933 1.00 36.61 O HETATM 1955 O HOH A2009 46.418 25.307 9.385 1.00 41.47 O HETATM 1956 O HOH A2010 44.795 33.704 4.865 1.00 47.01 O HETATM 1957 O HOH A2011 60.716 23.145 9.869 1.00 42.25 O HETATM 1958 O HOH A2012 55.559 21.941 10.550 1.00 27.44 O HETATM 1959 O HOH A2013 58.566 22.648 7.340 1.00 24.99 O HETATM 1960 O HOH A2014 55.591 22.120 7.824 1.00 28.91 O HETATM 1961 O HOH A2015 51.545 23.728 7.034 1.00 39.24 O HETATM 1962 O HOH A2016 53.706 17.721 -3.321 1.00 44.41 O HETATM 1963 O HOH A2017 47.888 27.780 8.330 1.00 28.25 O HETATM 1964 O HOH A2018 54.013 27.626 12.505 1.00 12.45 O HETATM 1965 O HOH A2019 52.059 24.529 10.038 1.00 24.40 O HETATM 1966 O HOH A2020 49.155 24.950 9.403 1.00 30.35 O HETATM 1967 O HOH A2021 65.405 22.315 6.096 1.00 31.50 O HETATM 1968 O HOH A2022 45.753 35.245 7.327 1.00 19.97 O HETATM 1969 O HOH A2023 47.396 31.315 8.045 1.00 20.39 O HETATM 1970 O HOH A2024 44.655 33.448 9.305 1.00 33.95 O HETATM 1971 O HOH A2025 43.845 35.321 12.035 1.00 47.35 O HETATM 1972 O HOH A2026 43.398 37.405 8.142 1.00 40.06 O HETATM 1973 O HOH A2027 46.757 39.442 13.143 1.00 21.14 O HETATM 1974 O HOH A2028 44.122 39.599 12.137 1.00 44.03 O HETATM 1975 O HOH A2029 42.728 44.948 8.438 1.00 40.84 O HETATM 1976 O HOH A2030 47.005 45.203 9.962 1.00 37.94 O HETATM 1977 O HOH A2031 52.656 47.956 4.717 1.00 43.18 O HETATM 1978 O HOH A2032 44.876 34.862 2.558 1.00 35.65 O HETATM 1979 O HOH A2033 44.750 38.230 5.939 1.00 23.62 O HETATM 1980 O HOH A2034 44.015 37.459 3.328 1.00 19.15 O HETATM 1981 O HOH A2035 49.001 43.574 14.323 1.00 36.07 O HETATM 1982 O HOH A2036 59.142 47.215 -10.507 1.00 44.25 O HETATM 1983 O HOH A2037 50.187 43.792 -0.562 1.00 13.16 O HETATM 1984 O HOH A2038 48.032 38.004 22.222 1.00 39.96 O HETATM 1985 O HOH A2039 51.854 39.475 -4.490 1.00 2.00 O HETATM 1986 O HOH A2040 47.299 34.433 1.056 1.00 26.25 O HETATM 1987 O HOH A2041 49.688 33.598 2.085 1.00 16.12 O HETATM 1988 O HOH A2042 44.529 30.942 -6.827 1.00 35.63 O HETATM 1989 O HOH A2043 46.923 31.629 -8.857 1.00 33.70 O HETATM 1990 O HOH A2044 70.879 43.538 27.844 1.00 40.84 O HETATM 1991 O HOH A2045 75.024 35.181 15.725 1.00 41.40 O HETATM 1992 O HOH A2046 75.845 41.376 22.552 1.00 42.33 O HETATM 1993 O HOH A2047 48.392 27.826 -4.748 1.00 34.66 O HETATM 1994 O HOH A2048 46.751 26.726 2.128 1.00 33.33 O HETATM 1995 O HOH A2049 46.445 31.463 -0.015 1.00 27.35 O HETATM 1996 O HOH A2050 47.911 25.622 -0.539 1.00 28.30 O HETATM 1997 O HOH A2051 46.238 28.943 -2.413 1.00 40.57 O HETATM 1998 O HOH A2052 45.486 31.460 6.142 1.00 38.87 O HETATM 1999 O HOH A2053 47.587 27.274 5.817 1.00 31.21 O HETATM 2000 O HOH A2054 50.646 27.894 -6.643 1.00 38.06 O HETATM 2001 O HOH A2055 56.059 29.706 -6.448 1.00 17.10 O HETATM 2002 O HOH A2056 54.109 28.713 -8.001 1.00 39.12 O HETATM 2003 O HOH A2057 53.235 24.343 -5.465 1.00 38.00 O HETATM 2004 O HOH A2058 55.468 22.389 -5.002 1.00 35.89 O HETATM 2005 O HOH A2059 48.775 22.756 0.040 1.00 41.61 O HETATM 2006 O HOH A2060 49.592 24.133 -4.426 1.00 28.92 O HETATM 2007 O HOH A2061 60.882 39.426 -9.345 1.00 35.64 O HETATM 2008 O HOH A2062 54.962 18.173 -0.821 1.00 35.26 O HETATM 2009 O HOH A2063 70.878 38.772 -3.250 1.00 35.61 O HETATM 2010 O HOH A2064 58.910 20.794 -6.941 1.00 36.70 O HETATM 2011 O HOH A2065 63.070 18.868 -1.753 1.00 39.63 O HETATM 2012 O HOH A2066 64.812 48.220 3.356 1.00 16.20 O HETATM 2013 O HOH A2067 62.529 22.674 5.275 1.00 17.10 O HETATM 2014 O HOH A2068 64.566 20.734 -0.484 1.00 22.75 O HETATM 2015 O HOH A2069 52.535 45.521 8.504 1.00 44.33 O HETATM 2016 O HOH A2070 57.355 46.997 20.270 1.00 43.67 O HETATM 2017 O HOH A2071 66.538 20.052 4.114 1.00 36.53 O HETATM 2018 O HOH A2072 58.851 21.943 4.602 1.00 17.82 O HETATM 2019 O HOH A2073 60.374 15.264 2.863 1.00 37.50 O HETATM 2020 O HOH A2074 54.846 19.627 6.976 1.00 38.40 O HETATM 2021 O HOH A2075 60.486 52.179 16.389 1.00 46.81 O HETATM 2022 O HOH A2076 55.636 23.544 5.562 1.00 20.92 O HETATM 2023 O HOH A2077 53.066 17.995 1.556 1.00 35.59 O HETATM 2024 O HOH A2078 55.894 25.910 5.467 1.00 2.77 O HETATM 2025 O HOH A2079 57.397 25.477 -8.974 1.00 33.72 O HETATM 2026 O HOH A2080 50.234 32.112 -11.753 1.00 47.74 O HETATM 2027 O HOH A2081 50.095 28.820 -9.055 1.00 38.96 O HETATM 2028 O HOH A2082 74.672 32.618 10.366 1.00 40.67 O HETATM 2029 O HOH A2083 54.335 37.451 -7.414 1.00 18.13 O HETATM 2030 O HOH A2084 50.897 38.957 -6.535 1.00 14.42 O HETATM 2031 O HOH A2085 56.396 42.520 -8.830 1.00 18.43 O HETATM 2032 O HOH A2086 56.476 38.631 -7.541 1.00 14.02 O HETATM 2033 O HOH A2087 63.636 48.835 20.090 1.00 28.75 O HETATM 2034 O HOH A2088 52.661 47.669 2.021 1.00 20.10 O HETATM 2035 O HOH A2089 58.903 46.344 -7.471 1.00 31.22 O HETATM 2036 O HOH A2090 48.276 41.595 12.250 1.00 25.30 O HETATM 2037 O HOH A2091 57.137 35.811 -10.179 1.00 38.59 O HETATM 2038 O HOH A2092 54.926 36.694 16.257 1.00 11.67 O HETATM 2039 O HOH A2093 47.919 37.932 19.609 1.00 25.16 O HETATM 2040 O HOH A2094 46.336 39.099 15.828 1.00 35.71 O HETATM 2041 O HOH A2095 46.492 35.681 19.345 1.00 23.51 O HETATM 2042 O HOH A2096 50.282 34.286 13.606 1.00 15.51 O HETATM 2043 O HOH A2097 52.439 31.456 13.414 1.00 14.05 O HETATM 2044 O HOH A2098 56.831 37.944 28.734 1.00 41.80 O HETATM 2045 O HOH A2099 61.371 33.244 26.715 1.00 40.14 O HETATM 2046 O HOH A2100 61.192 31.727 24.601 1.00 21.86 O HETATM 2047 O HOH A2101 60.742 37.419 28.570 1.00 38.93 O HETATM 2048 O HOH A2102 70.294 37.735 25.218 1.00 27.84 O HETATM 2049 O HOH A2103 68.608 34.038 27.447 1.00 35.04 O HETATM 2050 O HOH A2104 71.822 43.110 25.461 1.00 37.64 O HETATM 2051 O HOH A2105 70.141 40.684 28.298 1.00 37.90 O HETATM 2052 O HOH A2106 72.773 40.679 25.518 1.00 33.49 O HETATM 2053 O HOH A2107 67.147 41.096 29.437 1.00 20.88 O HETATM 2054 O HOH A2108 70.464 35.172 22.328 1.00 29.20 O HETATM 2055 O HOH A2109 75.453 40.520 17.202 1.00 34.81 O HETATM 2056 O HOH A2110 75.305 37.655 17.556 1.00 31.31 O HETATM 2057 O HOH A2111 73.048 41.858 17.505 1.00 14.58 O HETATM 2058 O HOH A2112 71.184 37.062 23.123 1.00 28.94 O HETATM 2059 O HOH A2113 73.592 39.809 22.901 1.00 22.19 O HETATM 2060 O HOH A2114 69.154 34.702 24.571 1.00 44.79 O HETATM 2061 O HOH A2115 70.865 27.205 12.710 1.00 46.39 O HETATM 2062 O HOH A2116 71.234 29.320 8.898 1.00 28.06 O HETATM 2063 O HOH A2117 69.122 22.337 2.675 1.00 42.39 O HETATM 2064 O HOH A2118 61.409 27.235 -11.019 1.00 29.02 O HETATM 2065 O HOH A2119 60.791 29.798 -13.042 1.00 54.07 O HETATM 2066 O HOH A2120 68.309 39.223 -9.704 1.00 41.05 O HETATM 2067 O HOH A2121 70.015 35.992 -10.903 1.00 45.30 O HETATM 2068 O HOH A2122 61.143 36.713 -10.573 1.00 29.69 O HETATM 2069 O HOH A2123 63.378 39.920 -7.512 1.00 29.77 O HETATM 2070 O HOH A2124 64.949 43.307 -7.301 1.00 36.97 O HETATM 2071 O HOH A2125 70.038 38.224 -5.899 1.00 32.33 O HETATM 2072 O HOH A2126 65.845 43.751 -3.242 1.00 20.40 O HETATM 2073 O HOH A2127 68.395 40.146 -3.586 1.00 28.15 O HETATM 2074 O HOH A2128 63.422 48.205 5.795 1.00 14.18 O HETATM 2075 O HOH A2129 54.365 44.077 9.883 1.00 29.52 O HETATM 2076 O HOH A2130 58.472 47.930 6.976 1.00 34.34 O HETATM 2077 O HOH A2131 54.440 44.041 19.356 1.00 32.32 O HETATM 2078 O HOH A2132 59.731 45.304 19.678 1.00 42.38 O HETATM 2079 O HOH A2133 54.241 48.071 14.996 1.00 26.07 O HETATM 2080 O HOH A2134 52.789 44.644 17.123 1.00 27.86 O HETATM 2081 O HOH A2135 51.831 43.665 9.927 1.00 40.39 O HETATM 2082 O HOH A2136 54.790 51.610 11.409 1.00 41.34 O HETATM 2083 O HOH A2137 59.755 51.803 12.015 1.00 40.91 O HETATM 2084 O HOH A2138 58.289 49.946 8.913 1.00 36.19 O HETATM 2085 O HOH A2139 61.983 51.100 13.675 1.00 25.21 O HETATM 2086 O HOH A2140 64.517 45.302 17.619 1.00 15.92 O HETATM 2087 O HOH A2141 71.072 40.823 6.255 1.00 14.55 O HETATM 2088 O HOH A2142 71.297 37.335 2.402 1.00 35.50 O HETATM 2089 O HOH A2143 65.057 36.856 -4.386 1.00 16.53 O HETATM 2090 O HOH A2144 71.647 35.923 -6.419 1.00 33.30 O HETATM 2091 O HOH A2145 71.185 30.563 -2.855 1.00 32.29 O HETATM 2092 O HOH A2146 56.294 26.793 -6.770 1.00 21.76 O HETATM 2093 O HOH A2147 62.728 21.346 -7.497 1.00 38.42 O HETATM 2094 O HOH A2148 62.018 20.989 -3.457 1.00 30.71 O HETATM 2095 O HOH A2149 67.336 23.923 -9.092 1.00 42.51 O HETATM 2096 O HOH A2150 62.709 24.181 -8.410 1.00 12.19 O HETATM 2097 O HOH A2151 65.511 22.130 -2.687 1.00 20.51 O HETATM 2098 O HOH A2152 69.603 24.701 -2.257 1.00 41.54 O HETATM 2099 O HOH A2153 70.123 24.105 0.694 1.00 41.50 O HETATM 2100 O HOH A2154 71.977 29.904 1.820 1.00 33.91 O HETATM 2101 O HOH A2155 70.636 25.772 3.381 1.00 25.22 O HETATM 2102 O HOH A2156 68.082 24.785 7.662 1.00 20.31 O HETATM 2103 O HOH A2157 72.394 34.403 4.532 1.00 31.80 O HETATM 2104 O HOH A2158 73.583 35.728 6.198 1.00 27.57 O HETATM 2105 O HOH A2159 72.972 30.603 10.066 1.00 42.93 O HETATM 2106 O HOH A2160 72.726 42.360 14.785 1.00 15.31 O HETATM 2107 O HOH A2161 70.131 43.649 11.860 1.00 14.75 O HETATM 2108 O HOH A2162 72.345 41.204 10.527 1.00 18.76 O HETATM 2109 O HOH A2163 75.809 40.403 14.468 1.00 28.20 O HETATM 2110 O HOH A2164 69.929 44.392 23.763 1.00 19.69 O HETATM 2111 O HOH A2165 67.667 47.486 18.633 1.00 16.24 O HETATM 2112 O HOH A2166 59.996 43.877 24.424 1.00 30.18 O HETATM 2113 O HOH A2167 63.039 44.645 19.907 1.00 16.24 O HETATM 2114 O HOH A2168 61.513 46.788 21.221 1.00 23.50 O HETATM 2115 O HOH A2169 62.391 44.501 27.333 1.00 37.86 O HETATM 2116 O HOH A2170 52.737 40.295 22.398 1.00 27.30 O HETATM 2117 O HOH A2171 56.321 41.583 27.258 1.00 27.88 O HETATM 2118 O HOH A2172 58.021 43.636 22.061 1.00 33.94 O HETATM 2119 O HOH A2173 51.492 38.740 24.265 1.00 39.86 O HETATM 2120 O HOH A2174 55.272 35.745 24.293 1.00 20.90 O HETATM 2121 O HOH A2175 50.353 43.549 16.652 1.00 42.15 O HETATM 2122 O HOH A2176 53.592 42.517 21.665 1.00 47.29 O HETATM 2123 O HOH A2177 57.590 48.175 -0.296 1.00 42.80 O HETATM 2124 O HOH A2178 59.763 48.645 0.892 1.00 31.95 O HETATM 2125 O HOH A2179 65.437 45.549 2.596 1.00 17.35 O HETATM 2126 O HOH A2180 60.248 48.498 -1.675 1.00 46.40 O HETATM 2127 O HOH A2181 61.363 46.864 -4.914 1.00 33.26 O HETATM 2128 O HOH A2182 58.520 43.288 -6.698 1.00 7.74 O HETATM 2129 O HOH A2183 58.330 40.103 -7.793 1.00 24.51 O HETATM 2130 O HOH A2184 62.590 34.937 -8.946 1.00 23.24 O HETATM 2131 O HOH A2185 57.646 36.779 -7.184 1.00 20.10 O HETATM 2132 O HOH A2186 57.058 34.973 -5.154 1.00 14.23 O HETATM 2133 O HOH A2187 55.918 32.565 -5.983 1.00 15.31 O HETATM 2134 O HOH A2188 67.444 24.161 14.494 1.00 32.13 O HETATM 2135 O HOH A2189 62.622 24.003 12.811 1.00 41.77 O HETATM 2136 O HOH A2190 65.041 23.104 14.520 1.00 33.38 O HETATM 2137 O HOH A2191 68.756 26.544 14.270 1.00 33.17 O HETATM 2138 O HOH A2192 69.567 27.102 17.126 1.00 41.81 O HETATM 2139 O HOH A2193 65.183 30.525 27.320 1.00 45.63 O HETATM 2140 O HOH A2194 72.460 30.939 16.823 1.00 40.08 O HETATM 2141 O HOH B2001 36.485 17.313 40.330 1.00 44.81 O HETATM 2142 O HOH B2002 39.078 17.570 43.730 1.00 31.14 O HETATM 2143 O HOH B2003 37.749 14.870 42.718 1.00 27.40 O HETATM 2144 O HOH B2004 45.316 20.617 44.782 1.00 25.00 O HETATM 2145 O HOH B2005 36.510 17.240 37.730 1.00 34.26 O HETATM 2146 O HOH B2006 36.254 26.213 29.312 1.00 34.92 O HETATM 2147 O HOH B2007 37.728 28.426 32.782 1.00 37.01 O HETATM 2148 O HOH B2008 43.592 25.287 38.119 1.00 13.24 O HETATM 2149 O HOH B2009 37.801 18.767 35.929 1.00 19.65 O HETATM 2150 O HOH B2010 36.531 25.970 32.105 1.00 35.12 O HETATM 2151 O HOH B2011 36.596 22.871 28.997 1.00 27.91 O HETATM 2152 O HOH B2012 49.137 35.064 24.254 1.00 25.34 O HETATM 2153 O HOH B2013 54.230 37.767 28.437 1.00 32.78 O HETATM 2154 O HOH B2014 48.069 4.521 34.889 1.00 41.23 O HETATM 2155 O HOH B2015 38.394 29.936 28.318 1.00 40.71 O HETATM 2156 O HOH B2016 32.019 27.851 18.053 1.00 38.00 O HETATM 2157 O HOH B2017 42.130 27.178 33.980 1.00 16.14 O HETATM 2158 O HOH B2018 47.163 32.946 34.585 1.00 30.00 O HETATM 2159 O HOH B2019 39.294 29.545 31.070 1.00 32.68 O HETATM 2160 O HOH B2020 39.857 32.035 30.646 1.00 40.56 O HETATM 2161 O HOH B2021 42.707 33.205 29.859 1.00 29.14 O HETATM 2162 O HOH B2022 35.650 16.302 27.722 1.00 27.11 O HETATM 2163 O HOH B2023 48.561 36.129 30.536 1.00 41.00 O HETATM 2164 O HOH B2024 46.068 34.256 32.761 1.00 45.51 O HETATM 2165 O HOH B2025 46.179 33.516 29.413 1.00 20.36 O HETATM 2166 O HOH B2026 50.286 34.723 28.438 1.00 21.05 O HETATM 2167 O HOH B2027 50.635 36.842 33.012 1.00 36.77 O HETATM 2168 O HOH B2028 54.374 33.626 34.274 1.00 20.97 O HETATM 2169 O HOH B2029 49.787 23.077 11.484 1.00 25.19 O HETATM 2170 O HOH B2030 59.459 22.953 13.673 1.00 26.69 O HETATM 2171 O HOH B2031 63.194 21.534 23.888 1.00 43.84 O HETATM 2172 O HOH B2032 62.915 23.334 19.738 1.00 43.68 O HETATM 2173 O HOH B2033 53.069 35.626 27.170 1.00 19.26 O HETATM 2174 O HOH B2034 51.857 36.107 24.649 1.00 19.58 O HETATM 2175 O HOH B2035 59.722 26.915 29.521 1.00 46.83 O HETATM 2176 O HOH B2036 58.439 31.058 35.451 1.00 36.82 O HETATM 2177 O HOH B2037 58.169 29.688 20.599 1.00 13.66 O HETATM 2178 O HOH B2038 51.560 33.285 42.814 1.00 32.29 O HETATM 2179 O HOH B2039 48.059 30.724 23.456 1.00 13.65 O HETATM 2180 O HOH B2040 48.754 33.122 22.318 1.00 15.06 O HETATM 2181 O HOH B2041 44.879 28.688 17.489 1.00 44.27 O HETATM 2182 O HOH B2042 45.383 32.566 12.157 1.00 28.14 O HETATM 2183 O HOH B2043 48.032 32.504 12.958 1.00 21.48 O HETATM 2184 O HOH B2044 53.935 4.255 44.083 1.00 43.98 O HETATM 2185 O HOH B2045 48.005 5.959 37.642 1.00 44.78 O HETATM 2186 O HOH B2046 42.312 32.489 16.656 1.00 29.86 O HETATM 2187 O HOH B2047 43.773 34.577 19.194 1.00 36.96 O HETATM 2188 O HOH B2048 46.022 35.392 27.574 1.00 34.63 O HETATM 2189 O HOH B2049 46.229 34.055 21.502 1.00 22.71 O HETATM 2190 O HOH B2050 42.266 33.692 27.238 1.00 29.39 O HETATM 2191 O HOH B2051 40.274 33.277 20.959 1.00 28.95 O HETATM 2192 O HOH B2052 42.351 30.143 14.754 1.00 31.88 O HETATM 2193 O HOH B2053 43.741 24.620 15.149 1.00 17.01 O HETATM 2194 O HOH B2054 42.735 26.583 13.583 1.00 30.64 O HETATM 2195 O HOH B2055 38.822 27.469 15.993 1.00 42.12 O HETATM 2196 O HOH B2056 38.802 31.738 17.104 1.00 27.95 O HETATM 2197 O HOH B2057 36.562 25.734 16.610 1.00 37.66 O HETATM 2198 O HOH B2058 53.299 18.784 12.214 1.00 42.31 O HETATM 2199 O HOH B2059 32.420 26.849 20.645 1.00 34.37 O HETATM 2200 O HOH B2060 51.709 9.222 18.263 1.00 41.50 O HETATM 2201 O HOH B2061 34.428 22.059 14.804 1.00 38.97 O HETATM 2202 O HOH B2062 32.338 18.616 20.184 1.00 36.71 O HETATM 2203 O HOH B2063 61.150 14.748 20.164 1.00 39.22 O HETATM 2204 O HOH B2064 61.295 14.475 24.752 1.00 15.61 O HETATM 2205 O HOH B2065 62.538 18.292 26.834 1.00 43.26 O HETATM 2206 O HOH B2066 36.328 18.893 26.941 1.00 18.83 O HETATM 2207 O HOH B2067 34.212 17.005 21.275 1.00 24.94 O HETATM 2208 O HOH B2068 61.351 22.637 41.540 1.00 40.96 O HETATM 2209 O HOH B2069 35.907 22.724 26.187 1.00 19.33 O HETATM 2210 O HOH B2070 33.513 15.090 26.220 1.00 40.87 O HETATM 2211 O HOH B2071 29.040 21.707 24.605 1.00 44.31 O HETATM 2212 O HOH B2072 37.798 25.849 27.133 1.00 20.86 O HETATM 2213 O HOH B2073 32.531 28.627 22.939 1.00 38.21 O HETATM 2214 O HOH B2074 39.525 32.512 28.021 1.00 42.22 O HETATM 2215 O HOH B2075 40.112 25.321 26.990 1.00 4.08 O HETATM 2216 O HOH B2076 41.714 34.623 23.234 1.00 31.80 O HETATM 2217 O HOH B2077 40.239 10.416 18.413 1.00 43.72 O HETATM 2218 O HOH B2078 39.284 23.656 12.538 1.00 30.31 O HETATM 2219 O HOH B2079 43.376 30.467 12.289 1.00 31.84 O HETATM 2220 O HOH B2080 45.989 29.311 9.209 1.00 25.70 O HETATM 2221 O HOH B2081 50.734 22.888 14.092 1.00 17.85 O HETATM 2222 O HOH B2082 46.518 5.401 28.358 1.00 38.49 O HETATM 2223 O HOH B2083 48.915 6.071 32.535 1.00 30.10 O HETATM 2224 O HOH B2084 51.634 25.681 13.859 1.00 15.22 O HETATM 2225 O HOH B2085 53.167 29.133 14.652 1.00 12.30 O HETATM 2226 O HOH B2086 53.805 23.333 11.990 1.00 31.05 O HETATM 2227 O HOH B2087 57.144 24.150 12.336 1.00 19.44 O HETATM 2228 O HOH B2088 53.614 28.112 16.685 1.00 2.13 O HETATM 2229 O HOH B2089 51.915 2.815 32.182 1.00 32.29 O HETATM 2230 O HOH B2090 56.886 21.261 14.627 1.00 19.15 O HETATM 2231 O HOH B2091 58.649 26.928 17.896 1.00 12.92 O HETATM 2232 O HOH B2092 62.230 15.731 41.699 1.00 33.65 O HETATM 2233 O HOH B2093 61.866 21.777 21.635 1.00 46.60 O HETATM 2234 O HOH B2094 61.695 26.193 23.440 1.00 44.15 O HETATM 2235 O HOH B2095 54.496 28.808 48.041 1.00 45.20 O HETATM 2236 O HOH B2096 56.922 26.352 30.058 1.00 39.86 O HETATM 2237 O HOH B2097 61.909 19.856 15.514 1.00 38.22 O HETATM 2238 O HOH B2098 64.199 17.672 23.266 1.00 40.70 O HETATM 2239 O HOH B2099 56.431 31.727 33.402 1.00 23.23 O HETATM 2240 O HOH B2100 51.061 25.829 37.730 1.00 12.44 O HETATM 2241 O HOH B2101 53.142 32.850 40.642 1.00 27.90 O HETATM 2242 O HOH B2102 48.902 32.913 42.250 1.00 38.65 O HETATM 2243 O HOH B2103 50.003 34.626 40.768 1.00 30.51 O HETATM 2244 O HOH B2104 53.844 34.286 36.842 1.00 37.00 O HETATM 2245 O HOH B2105 46.057 28.570 34.889 1.00 16.61 O HETATM 2246 O HOH B2106 48.973 30.551 35.002 1.00 16.38 O HETATM 2247 O HOH B2107 46.384 19.716 46.940 1.00 24.44 O HETATM 2248 O HOH B2108 48.153 20.100 50.720 1.00 30.29 O HETATM 2249 O HOH B2109 51.141 25.159 48.509 1.00 26.56 O HETATM 2250 O HOH B2110 51.848 19.754 50.128 1.00 32.27 O HETATM 2251 O HOH B2111 49.368 17.990 52.106 1.00 37.82 O HETATM 2252 O HOH B2112 51.044 10.429 46.904 1.00 27.04 O HETATM 2253 O HOH B2113 53.853 7.772 47.315 1.00 29.99 O HETATM 2254 O HOH B2114 54.758 13.468 50.983 1.00 20.76 O HETATM 2255 O HOH B2115 54.186 10.380 49.990 1.00 34.65 O HETATM 2256 O HOH B2116 56.361 8.536 46.960 1.00 37.96 O HETATM 2257 O HOH B2117 54.656 7.092 39.249 1.00 15.04 O HETATM 2258 O HOH B2118 50.366 5.133 39.279 1.00 32.57 O HETATM 2259 O HOH B2119 48.574 10.208 43.931 1.00 34.46 O HETATM 2260 O HOH B2120 52.823 6.905 44.664 1.00 23.94 O HETATM 2261 O HOH B2121 53.188 4.834 39.002 1.00 40.27 O HETATM 2262 O HOH B2122 39.732 11.085 34.784 1.00 38.56 O HETATM 2263 O HOH B2123 35.997 11.851 24.366 1.00 41.84 O HETATM 2264 O HOH B2124 40.785 19.494 10.534 1.00 26.01 O HETATM 2265 O HOH B2125 45.988 21.722 8.194 1.00 45.13 O HETATM 2266 O HOH B2126 50.084 18.977 10.881 1.00 31.59 O HETATM 2267 O HOH B2127 56.344 14.576 14.229 1.00 37.75 O HETATM 2268 O HOH B2128 50.778 10.067 15.588 1.00 36.03 O HETATM 2269 O HOH B2129 56.685 13.615 18.346 1.00 29.18 O HETATM 2270 O HOH B2130 53.259 11.396 18.166 1.00 27.47 O HETATM 2271 O HOH B2131 58.706 13.269 19.279 1.00 25.86 O HETATM 2272 O HOH B2132 61.482 15.886 27.153 1.00 13.19 O HETATM 2273 O HOH B2133 60.885 24.746 28.558 1.00 48.39 O HETATM 2274 O HOH B2134 61.743 21.168 28.311 1.00 32.49 O HETATM 2275 O HOH B2135 58.306 25.190 31.220 1.00 28.27 O HETATM 2276 O HOH B2136 59.256 20.377 40.966 1.00 35.87 O HETATM 2277 O HOH B2137 58.554 25.513 40.488 1.00 36.05 O HETATM 2278 O HOH B2138 62.433 25.431 36.005 1.00 23.89 O HETATM 2279 O HOH B2139 59.374 27.190 38.067 1.00 30.53 O HETATM 2280 O HOH B2140 58.176 28.134 31.116 1.00 37.01 O HETATM 2281 O HOH B2141 63.772 21.161 30.015 1.00 34.10 O HETATM 2282 O HOH B2142 65.381 19.283 33.044 1.00 37.75 O HETATM 2283 O HOH B2143 61.866 24.249 39.532 1.00 40.00 O HETATM 2284 O HOH B2144 64.595 17.128 35.149 1.00 26.77 O HETATM 2285 O HOH B2145 50.082 8.831 24.076 1.00 34.65 O HETATM 2286 O HOH B2146 49.974 14.968 17.225 1.00 15.77 O HETATM 2287 O HOH B2147 43.080 9.512 18.617 1.00 33.19 O HETATM 2288 O HOH B2148 48.352 8.504 15.415 1.00 29.01 O HETATM 2289 O HOH B2149 39.846 16.963 9.376 1.00 45.18 O HETATM 2290 O HOH B2150 40.730 24.751 14.784 1.00 23.15 O HETATM 2291 O HOH B2151 34.782 18.255 14.526 1.00 41.94 O HETATM 2292 O HOH B2152 34.601 19.552 18.414 1.00 28.80 O HETATM 2293 O HOH B2153 34.339 16.268 16.702 1.00 39.64 O HETATM 2294 O HOH B2154 37.678 18.506 13.244 1.00 13.01 O HETATM 2295 O HOH B2155 35.949 13.121 19.598 1.00 40.75 O HETATM 2296 O HOH B2156 35.450 15.868 19.080 1.00 21.59 O HETATM 2297 O HOH B2157 38.081 9.865 22.145 1.00 47.79 O HETATM 2298 O HOH B2158 42.568 8.752 23.437 1.00 35.25 O HETATM 2299 O HOH B2159 38.659 10.508 25.293 1.00 25.18 O HETATM 2300 O HOH B2160 43.279 7.370 26.200 1.00 51.78 O HETATM 2301 O HOH B2161 37.900 13.226 29.369 1.00 27.72 O HETATM 2302 O HOH B2162 43.338 9.250 28.993 1.00 40.71 O HETATM 2303 O HOH B2163 46.294 7.749 26.749 1.00 22.07 O HETATM 2304 O HOH B2164 41.938 10.002 30.978 1.00 34.89 O HETATM 2305 O HOH B2165 46.992 5.189 31.426 1.00 49.25 O HETATM 2306 O HOH B2166 56.620 9.675 33.455 1.00 13.82 O HETATM 2307 O HOH B2167 52.066 6.036 32.241 1.00 22.85 O HETATM 2308 O HOH B2168 53.082 4.498 36.419 1.00 29.70 O HETATM 2309 O HOH B2169 59.320 13.205 44.899 1.00 36.70 O HETATM 2310 O HOH B2170 58.774 15.350 39.016 1.00 14.85 O HETATM 2311 O HOH B2171 57.694 10.233 45.305 1.00 20.01 O HETATM 2312 O HOH B2172 60.675 18.256 42.466 1.00 24.66 O HETATM 2313 O HOH B2173 58.253 17.042 41.271 1.00 15.87 O HETATM 2314 O HOH B2174 58.440 17.852 48.759 1.00 37.90 O HETATM 2315 O HOH B2175 58.017 20.310 45.771 1.00 31.12 O HETATM 2316 O HOH B2176 54.935 28.712 43.738 1.00 36.44 O HETATM 2317 O HOH B2177 53.162 29.137 45.722 1.00 31.17 O HETATM 2318 O HOH B2178 57.850 22.380 42.978 1.00 36.84 O HETATM 2319 O HOH B2179 55.995 26.785 43.163 1.00 38.89 O HETATM 2320 O HOH B2180 50.335 26.005 45.742 1.00 23.23 O HETATM 2321 O HOH B2181 56.022 24.310 48.677 1.00 30.11 O HETATM 2322 O HOH B2182 58.203 29.797 37.773 1.00 38.54 O HETATM 2323 O HOH B2183 62.133 19.488 22.238 1.00 31.85 O HETATM 2324 O HOH B2184 60.179 17.755 16.567 1.00 34.93 O HETATM 2325 O HOH B2185 61.935 19.287 19.707 1.00 29.30 O HETATM 2326 O HOH B2186 53.255 16.535 13.918 1.00 24.55 O HETATM 2327 O HOH B2187 57.467 18.696 14.702 1.00 22.34 O HETATM 2328 O HOH B2188 48.478 17.615 12.631 1.00 22.28 O HETATM 2329 O HOH B2189 54.241 21.279 13.664 1.00 34.18 O HETATM 2330 O HOH B2190 48.884 23.126 16.200 1.00 12.44 O HETATM 2331 O HOH B2191 46.506 24.438 15.420 1.00 14.33 O HETATM 2332 O HOH B2192 37.182 14.307 36.753 1.00 37.91 O HETATM 2333 O HOH B2193 36.499 14.709 31.147 1.00 42.23 O HETATM 2334 O HOH B2194 39.562 12.775 36.768 1.00 31.14 O HETATM 2335 O HOH B2195 50.576 4.370 42.332 1.00 39.10 O HETATM 2336 O HOH B2196 41.771 9.166 44.219 1.00 45.47 O HETATM 2337 O HOH B2197 50.291 9.561 44.887 1.00 27.70 O MASTER 319 0 0 2 26 0 0 9 2335 2 0 22 END