HEADER LIGASE 23-NOV-04 1Y2Q TITLE CRYSTAL STRUCTURE OF THE EDITING DOMAIN OF THREONYL-TRNA TITLE 2 SYNTHETASE FROM PYROCOCCUS ABYSSI COMPND MOL_ID: 1; COMPND 2 MOLECULE: THREONYL-TRNA SYNTHETASE; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: EDITING DOMAIN; COMPND 5 SYNONYM: THREONINE--TRNA LIGASE, THRRS; COMPND 6 EC: 6.1.1.3; COMPND 7 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS ABYSSI; SOURCE 3 ORGANISM_TAXID: 29292; SOURCE 4 GENE: THRS; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 6 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET21B KEYWDS BETA-ALPHA-BETA FOLD, EDITING DOMAIN, TRNA-SYNTHETASE, KEYWDS 2 LIGASE EXPDTA X-RAY DIFFRACTION AUTHOR S.DWIVEDI,S.P.KRUPARANI,R.SANKARANARAYANAN REVDAT 3 24-FEB-09 1Y2Q 1 VERSN REVDAT 2 21-JUN-05 1Y2Q 1 JRNL REVDAT 1 14-JUN-05 1Y2Q 0 JRNL AUTH S.DWIVEDI,S.P.KRUPARANI,R.SANKARANARAYANAN JRNL TITL A D-AMINO ACID EDITING MODULE COUPLED TO THE JRNL TITL 2 TRANSLATIONAL APPARATUS IN ARCHAEA JRNL REF NAT.STRUCT.MOL.BIOL. V. 12 556 2005 JRNL REFN ISSN 1545-9993 JRNL PMID 15908961 JRNL DOI 10.1038/NSMB943 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH S.DWIVEDI,S.P.KRUPARANI,R.SANKARANARAYANAN REMARK 1 TITL CLONING, EXPRESSION, PURIFICATION, CRYSTALLIZATION REMARK 1 TITL 2 AND PRELIMINARY X-RAY CRYSTALLOGRAPHIC REMARK 1 TITL 3 INVESTIGATIONS OF A UNIQUE EDITING DOMAIN FROM REMARK 1 TITL 4 ARCHAEBACTERIA REMARK 1 REF ACTA CRYSTALLOGR.,SECT.D V. 60 1662 2004 REMARK 1 REFN ISSN 0907-4449 REMARK 1 PMID 15333948 REMARK 1 DOI 10.1107/S0907444904017329 REMARK 2 REMARK 2 RESOLUTION. 1.95 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0005 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.95 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 25.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 96.9 REMARK 3 NUMBER OF REFLECTIONS : 9957 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) : 0.209 REMARK 3 R VALUE (WORKING SET) : 0.205 REMARK 3 FREE R VALUE : 0.272 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.800 REMARK 3 FREE R VALUE TEST SET COUNT : 500 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) : 1.95 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.00 REMARK 3 REFLECTION IN BIN (WORKING SET) : 628 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 85.15 REMARK 3 BIN R VALUE (WORKING SET) : 0.3070 REMARK 3 BIN FREE R VALUE SET COUNT : 37 REMARK 3 BIN FREE R VALUE : 0.3530 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1140 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 176 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 33.32 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.91000 REMARK 3 B22 (A**2) : -0.91000 REMARK 3 B33 (A**2) : 1.36000 REMARK 3 B12 (A**2) : -0.45000 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): 0.218 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.198 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.162 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 5.785 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.955 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.934 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1162 ; 0.011 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 1566 ; 1.324 ; 1.990 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 142 ; 7.088 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 52 ;40.178 ;24.808 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 220 ;16.676 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 6 ;23.935 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 173 ; 0.089 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 866 ; 0.004 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 547 ; 0.206 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 790 ; 0.300 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 124 ; 0.175 ; 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): 31 ; 0.195 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 16 ; 0.099 ; 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): 741 ; 0.730 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1162 ; 1.201 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 470 ; 1.911 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 404 ; 3.162 ; 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 : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1Y2Q COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 29-NOV-04. REMARK 100 THE RCSB ID CODE IS RCSB031041. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 06-JUN-04 REMARK 200 TEMPERATURE (KELVIN) : 100.0 REMARK 200 PH : 7.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RU300 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : OSMIC MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 10459 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.950 REMARK 200 RESOLUTION RANGE LOW (A) : 25.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 96.7 REMARK 200 DATA REDUNDANCY : 3.300 REMARK 200 R MERGE (I) : 0.04100 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 25.3000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.95 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.02 REMARK 200 COMPLETENESS FOR SHELL (%) : 87.2 REMARK 200 DATA REDUNDANCY IN SHELL : 2.70 REMARK 200 R MERGE FOR SHELL (I) : 0.31400 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.250 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MIR REMARK 200 SOFTWARE USED: SOLVE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 27.70 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.70 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 8000, HEPES, PH 7.0, VAPOR REMARK 280 DIFFUSION, HANGING DROP, TEMPERATURE 277.0K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 32 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+2/3 REMARK 290 3555 -X+Y,-X,Z+1/3 REMARK 290 4555 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z+1/3 REMARK 290 6555 -X,-X+Y,-Z+2/3 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 43.26267 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 21.63133 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 21.63133 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 43.26267 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC 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 BIOMT1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 350 BIOMT2 2 -0.866025 0.500000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 43.26267 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 18 CG CD CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 LYS A 16 -131.90 -115.98 REMARK 500 ASN A 22 70.01 -115.74 REMARK 500 ASN A 52 78.21 -154.29 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 232 DISTANCE = 5.42 ANGSTROMS REMARK 525 HOH A 311 DISTANCE = 5.82 ANGSTROMS REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1Y2R RELATED DB: PDB REMARK 900 THE SAME PROTEIN WITH L-SERINE DBREF 1Y2Q A 1 143 UNP Q9UZ14 SYT_PYRAB 1 143 SEQRES 1 A 143 MET ARG VAL LEU LEU ILE HIS SER ASP TYR ILE GLU TYR SEQRES 2 A 143 GLU VAL LYS ASP LYS ALA LEU LYS ASN PRO GLU PRO ILE SEQRES 3 A 143 SER GLU ASP MET LYS ARG GLY ARG MET GLU GLU VAL LEU SEQRES 4 A 143 VAL ALA PHE ILE SER VAL GLU LYS VAL ASP GLU LYS ASN SEQRES 5 A 143 PRO GLU GLU VAL SER LEU LYS ALA ILE GLU GLU ILE SER SEQRES 6 A 143 LYS VAL ALA GLU GLN VAL LYS ALA GLU ASN VAL PHE VAL SEQRES 7 A 143 TYR PRO PHE ALA HIS LEU SER SER GLU LEU ALA LYS PRO SEQRES 8 A 143 SER VAL ALA MET ASP ILE LEU ASN ARG VAL TYR GLN GLY SEQRES 9 A 143 LEU LYS GLU ARG GLY PHE ASN VAL GLY LYS ALA PRO PHE SEQRES 10 A 143 GLY TYR TYR LYS ALA PHE LYS ILE SER CYS LYS GLY HIS SEQRES 11 A 143 PRO LEU ALA GLU LEU SER ARG THR ILE VAL PRO GLU GLU FORMUL 2 HOH *176(H2 O) HELIX 1 1 SER A 27 MET A 30 5 4 HELIX 2 2 GLU A 46 LYS A 51 5 6 HELIX 3 3 ASN A 52 VAL A 71 1 20 HELIX 4 4 ALA A 82 SER A 85 5 4 HELIX 5 5 LYS A 90 ARG A 108 1 19 SHEET 1 A 5 ASN A 111 LYS A 114 0 SHEET 2 A 5 ASN A 75 PRO A 80 1 N VAL A 78 O GLY A 113 SHEET 3 A 5 ARG A 32 SER A 44 1 N ALA A 41 O PHE A 77 SHEET 4 A 5 ARG A 2 LYS A 18 -1 N LEU A 4 O PHE A 42 SHEET 5 A 5 TYR A 119 CYS A 127 -1 O TYR A 120 N LYS A 16 SHEET 1 B 5 ASN A 111 LYS A 114 0 SHEET 2 B 5 ASN A 75 PRO A 80 1 N VAL A 78 O GLY A 113 SHEET 3 B 5 ARG A 32 SER A 44 1 N ALA A 41 O PHE A 77 SHEET 4 B 5 ARG A 2 LYS A 18 -1 N LEU A 4 O PHE A 42 SHEET 5 B 5 GLU A 134 THR A 138 -1 O LEU A 135 N LEU A 5 CRYST1 61.752 61.752 64.894 90.00 90.00 120.00 P 32 2 1 6 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 0.016194 0.009350 0.000000 0.00000 SCALE2 0.000000 0.018699 0.000000 0.00000 SCALE3 0.000000 0.000000 0.015410 0.00000 ATOM 1 N MET A 1 -8.652 31.923 16.415 1.00 21.52 N ATOM 2 CA MET A 1 -8.059 30.550 16.476 1.00 21.76 C ATOM 3 C MET A 1 -8.157 29.963 17.890 1.00 21.54 C ATOM 4 O MET A 1 -7.904 30.655 18.893 1.00 22.43 O ATOM 5 CB MET A 1 -6.576 30.586 16.053 1.00 21.55 C ATOM 6 CG MET A 1 -5.921 29.200 15.938 1.00 22.54 C ATOM 7 SD MET A 1 -4.108 29.248 15.821 1.00 23.66 S ATOM 8 CE MET A 1 -3.939 29.703 14.107 1.00 22.89 C ATOM 9 N ARG A 2 -8.482 28.679 17.948 1.00 21.03 N ATOM 10 CA ARG A 2 -8.441 27.911 19.169 1.00 20.86 C ATOM 11 C ARG A 2 -7.465 26.756 18.965 1.00 20.18 C ATOM 12 O ARG A 2 -7.500 26.073 17.946 1.00 19.10 O ATOM 13 CB ARG A 2 -9.841 27.369 19.506 1.00 21.90 C ATOM 14 CG ARG A 2 -10.830 28.401 20.047 1.00 24.24 C ATOM 15 CD ARG A 2 -10.534 28.761 21.508 1.00 30.31 C ATOM 16 NE ARG A 2 -10.826 27.684 22.470 1.00 33.80 N ATOM 17 CZ ARG A 2 -10.223 27.546 23.656 1.00 35.21 C ATOM 18 NH1 ARG A 2 -9.274 28.406 24.046 1.00 35.76 N ATOM 19 NH2 ARG A 2 -10.555 26.537 24.457 1.00 34.67 N ATOM 20 N VAL A 3 -6.597 26.552 19.944 1.00 19.82 N ATOM 21 CA VAL A 3 -5.552 25.526 19.864 1.00 20.61 C ATOM 22 C VAL A 3 -5.630 24.632 21.100 1.00 20.67 C ATOM 23 O VAL A 3 -5.716 25.134 22.203 1.00 20.82 O ATOM 24 CB VAL A 3 -4.145 26.179 19.821 1.00 19.86 C ATOM 25 CG1 VAL A 3 -3.066 25.129 19.859 1.00 20.97 C ATOM 26 CG2 VAL A 3 -3.988 27.042 18.552 1.00 21.16 C ATOM 27 N LEU A 4 -5.624 23.319 20.901 1.00 21.41 N ATOM 28 CA LEU A 4 -5.478 22.371 21.997 1.00 22.48 C ATOM 29 C LEU A 4 -4.083 21.738 21.899 1.00 22.08 C ATOM 30 O LEU A 4 -3.755 21.108 20.890 1.00 22.06 O ATOM 31 CB LEU A 4 -6.594 21.307 21.952 1.00 22.54 C ATOM 32 CG LEU A 4 -6.506 20.071 22.858 1.00 23.76 C ATOM 33 CD1 LEU A 4 -6.477 20.444 24.344 1.00 24.14 C ATOM 34 CD2 LEU A 4 -7.680 19.133 22.556 1.00 24.26 C ATOM 35 N LEU A 5 -3.284 21.921 22.947 1.00 22.41 N ATOM 36 CA LEU A 5 -1.893 21.451 23.000 1.00 23.39 C ATOM 37 C LEU A 5 -1.732 20.251 23.911 1.00 23.82 C ATOM 38 O LEU A 5 -2.012 20.333 25.114 1.00 24.71 O ATOM 39 CB LEU A 5 -0.985 22.569 23.484 1.00 22.74 C ATOM 40 CG LEU A 5 -0.974 23.795 22.570 1.00 22.50 C ATOM 41 CD1 LEU A 5 -0.348 24.950 23.286 1.00 22.39 C ATOM 42 CD2 LEU A 5 -0.238 23.467 21.251 1.00 20.25 C ATOM 43 N ILE A 6 -1.305 19.132 23.343 1.00 23.34 N ATOM 44 CA ILE A 6 -1.252 17.896 24.120 1.00 24.66 C ATOM 45 C ILE A 6 0.146 17.294 24.025 1.00 24.66 C ATOM 46 O ILE A 6 0.553 16.853 22.965 1.00 24.81 O ATOM 47 CB ILE A 6 -2.358 16.909 23.679 1.00 23.79 C ATOM 48 CG1 ILE A 6 -3.752 17.489 24.017 1.00 24.15 C ATOM 49 CG2 ILE A 6 -2.132 15.541 24.315 1.00 24.29 C ATOM 50 CD1 ILE A 6 -4.969 16.645 23.610 1.00 25.46 C ATOM 51 N HIS A 7 0.894 17.322 25.127 1.00 26.14 N ATOM 52 CA HIS A 7 2.247 16.725 25.159 1.00 26.93 C ATOM 53 C HIS A 7 2.117 15.208 25.221 1.00 28.09 C ATOM 54 O HIS A 7 1.550 14.655 26.168 1.00 29.17 O ATOM 55 CB HIS A 7 3.074 17.296 26.324 1.00 26.94 C ATOM 56 CG HIS A 7 4.540 16.964 26.267 1.00 27.25 C ATOM 57 ND1 HIS A 7 5.382 17.141 27.344 1.00 27.41 N ATOM 58 CD2 HIS A 7 5.311 16.464 25.269 1.00 27.71 C ATOM 59 CE1 HIS A 7 6.603 16.757 27.016 1.00 27.97 C ATOM 60 NE2 HIS A 7 6.586 16.341 25.763 1.00 26.85 N ATOM 61 N SER A 8 2.629 14.539 24.201 1.00 28.82 N ATOM 62 CA SER A 8 2.265 13.172 23.936 1.00 29.87 C ATOM 63 C SER A 8 3.468 12.271 23.724 1.00 30.64 C ATOM 64 O SER A 8 4.465 12.675 23.113 1.00 30.63 O ATOM 65 CB SER A 8 1.359 13.107 22.703 1.00 30.45 C ATOM 66 OG SER A 8 0.318 14.075 22.767 1.00 30.86 O ATOM 67 N ASP A 9 3.362 11.041 24.215 1.00 31.45 N ATOM 68 CA ASP A 9 4.411 10.046 24.010 1.00 32.51 C ATOM 69 C ASP A 9 4.522 9.705 22.521 1.00 32.91 C ATOM 70 O ASP A 9 5.619 9.433 22.023 1.00 32.76 O ATOM 71 CB ASP A 9 4.132 8.802 24.861 1.00 32.76 C ATOM 72 CG ASP A 9 3.906 9.144 26.313 1.00 33.82 C ATOM 73 OD1 ASP A 9 4.843 9.618 26.970 1.00 34.79 O ATOM 74 OD2 ASP A 9 2.773 8.966 26.801 1.00 37.66 O ATOM 75 N TYR A 10 3.379 9.732 21.830 1.00 33.33 N ATOM 76 CA TYR A 10 3.302 9.598 20.379 1.00 34.27 C ATOM 77 C TYR A 10 2.010 10.195 19.800 1.00 34.47 C ATOM 78 O TYR A 10 0.991 10.307 20.492 1.00 34.08 O ATOM 79 CB TYR A 10 3.432 8.125 19.939 1.00 35.40 C ATOM 80 CG TYR A 10 2.347 7.213 20.482 1.00 36.15 C ATOM 81 CD1 TYR A 10 1.113 7.101 19.844 1.00 37.75 C ATOM 82 CD2 TYR A 10 2.561 6.463 21.639 1.00 38.34 C ATOM 83 CE1 TYR A 10 0.108 6.276 20.363 1.00 38.20 C ATOM 84 CE2 TYR A 10 1.574 5.641 22.159 1.00 37.21 C ATOM 85 CZ TYR A 10 0.357 5.551 21.518 1.00 37.39 C ATOM 86 OH TYR A 10 -0.607 4.722 22.035 1.00 37.95 O ATOM 87 N ILE A 11 2.073 10.581 18.524 1.00 34.76 N ATOM 88 CA ILE A 11 0.887 10.745 17.682 1.00 35.05 C ATOM 89 C ILE A 11 1.063 9.867 16.443 1.00 35.77 C ATOM 90 O ILE A 11 2.189 9.610 16.012 1.00 35.97 O ATOM 91 CB ILE A 11 0.613 12.238 17.287 1.00 35.27 C ATOM 92 CG1 ILE A 11 -0.622 12.376 16.381 1.00 35.44 C ATOM 93 CG2 ILE A 11 1.823 12.873 16.591 1.00 34.71 C ATOM 94 CD1 ILE A 11 -1.953 12.393 17.098 1.00 36.95 C ATOM 95 N GLU A 12 -0.049 9.417 15.870 1.00 36.29 N ATOM 96 CA GLU A 12 -0.024 8.602 14.672 1.00 36.95 C ATOM 97 C GLU A 12 -1.329 8.808 13.921 1.00 37.45 C ATOM 98 O GLU A 12 -2.387 8.918 14.527 1.00 37.36 O ATOM 99 CB GLU A 12 0.157 7.142 15.076 1.00 37.24 C ATOM 100 CG GLU A 12 0.408 6.167 13.967 1.00 38.56 C ATOM 101 CD GLU A 12 0.513 4.748 14.506 1.00 40.45 C ATOM 102 OE1 GLU A 12 -0.462 3.985 14.337 1.00 42.12 O ATOM 103 OE2 GLU A 12 1.550 4.412 15.124 1.00 40.32 O ATOM 104 N TYR A 13 -1.253 8.889 12.602 1.00 37.72 N ATOM 105 CA TYR A 13 -2.444 9.043 11.798 1.00 38.24 C ATOM 106 C TYR A 13 -2.359 8.274 10.495 1.00 39.19 C ATOM 107 O TYR A 13 -1.270 7.946 10.006 1.00 39.21 O ATOM 108 CB TYR A 13 -2.736 10.521 11.512 1.00 38.22 C ATOM 109 CG TYR A 13 -1.895 11.140 10.412 1.00 37.01 C ATOM 110 CD1 TYR A 13 -2.326 11.114 9.085 1.00 35.92 C ATOM 111 CD2 TYR A 13 -0.674 11.758 10.704 1.00 37.03 C ATOM 112 CE1 TYR A 13 -1.563 11.669 8.075 1.00 36.42 C ATOM 113 CE2 TYR A 13 0.099 12.333 9.697 1.00 36.24 C ATOM 114 CZ TYR A 13 -0.355 12.285 8.383 1.00 37.01 C ATOM 115 OH TYR A 13 0.389 12.852 7.374 1.00 38.31 O ATOM 116 N GLU A 14 -3.534 8.011 9.947 1.00 39.94 N ATOM 117 CA GLU A 14 -3.713 7.399 8.644 1.00 41.19 C ATOM 118 C GLU A 14 -4.923 8.092 8.039 1.00 40.68 C ATOM 119 O GLU A 14 -6.016 8.084 8.608 1.00 40.96 O ATOM 120 CB GLU A 14 -3.854 5.862 8.773 1.00 41.57 C ATOM 121 CG GLU A 14 -5.061 5.192 8.095 1.00 46.12 C ATOM 122 CD GLU A 14 -4.824 4.766 6.649 1.00 51.11 C ATOM 123 OE1 GLU A 14 -3.647 4.680 6.221 1.00 53.29 O ATOM 124 OE2 GLU A 14 -5.827 4.495 5.940 1.00 52.67 O ATOM 125 N VAL A 15 -4.687 8.758 6.917 1.00 40.57 N ATOM 126 CA VAL A 15 -5.717 9.427 6.153 1.00 40.61 C ATOM 127 C VAL A 15 -6.690 8.396 5.611 1.00 41.42 C ATOM 128 O VAL A 15 -6.283 7.364 5.062 1.00 41.52 O ATOM 129 CB VAL A 15 -5.091 10.227 4.991 1.00 40.49 C ATOM 130 CG1 VAL A 15 -6.141 10.701 4.007 1.00 40.25 C ATOM 131 CG2 VAL A 15 -4.301 11.390 5.533 1.00 39.74 C ATOM 132 N LYS A 16 -7.980 8.678 5.785 1.00 41.97 N ATOM 133 CA LYS A 16 -9.032 7.821 5.262 1.00 42.74 C ATOM 134 C LYS A 16 -9.819 8.603 4.221 1.00 42.83 C ATOM 135 O LYS A 16 -9.219 9.229 3.346 1.00 43.50 O ATOM 136 CB LYS A 16 -9.913 7.261 6.387 1.00 42.69 C ATOM 137 CG LYS A 16 -9.227 6.186 7.231 1.00 43.52 C ATOM 138 CD LYS A 16 -10.257 5.219 7.816 1.00 46.63 C ATOM 139 CE LYS A 16 -9.755 3.780 7.845 1.00 47.42 C ATOM 140 NZ LYS A 16 -10.792 2.853 8.402 1.00 49.05 N ATOM 141 N ASP A 17 -11.143 8.581 4.307 1.00 42.89 N ATOM 142 CA ASP A 17 -11.982 9.216 3.301 1.00 42.90 C ATOM 143 C ASP A 17 -11.829 10.745 3.327 1.00 42.71 C ATOM 144 O ASP A 17 -11.437 11.322 4.342 1.00 41.76 O ATOM 145 CB ASP A 17 -13.454 8.790 3.476 1.00 43.63 C ATOM 146 CG ASP A 17 -13.666 7.263 3.338 1.00 45.66 C ATOM 147 OD1 ASP A 17 -12.910 6.604 2.582 1.00 48.83 O ATOM 148 OD2 ASP A 17 -14.599 6.714 3.978 1.00 47.17 O ATOM 149 N LYS A 18 -12.120 11.391 2.199 1.00 42.40 N ATOM 150 CA LYS A 18 -12.115 12.846 2.122 1.00 42.55 C ATOM 151 C LYS A 18 -13.361 13.430 2.781 1.00 42.66 C ATOM 152 O LYS A 18 -14.458 12.895 2.635 1.00 42.45 O ATOM 153 CB LYS A 18 -12.014 13.301 0.679 1.00 42.59 C ATOM 154 N ALA A 19 -13.180 14.537 3.496 1.00 42.83 N ATOM 155 CA ALA A 19 -14.235 15.150 4.307 1.00 43.16 C ATOM 156 C ALA A 19 -14.786 16.409 3.649 1.00 43.77 C ATOM 157 O ALA A 19 -15.854 16.902 4.013 1.00 43.45 O ATOM 158 CB ALA A 19 -13.699 15.467 5.698 1.00 42.56 C ATOM 159 N LEU A 20 -14.019 16.924 2.695 1.00 44.74 N ATOM 160 CA LEU A 20 -14.376 18.077 1.882 1.00 46.03 C ATOM 161 C LEU A 20 -14.264 17.653 0.427 1.00 46.59 C ATOM 162 O LEU A 20 -13.633 16.638 0.131 1.00 46.76 O ATOM 163 CB LEU A 20 -13.396 19.231 2.135 1.00 45.97 C ATOM 164 CG LEU A 20 -13.445 19.995 3.451 1.00 46.45 C ATOM 165 CD1 LEU A 20 -12.125 20.683 3.672 1.00 46.72 C ATOM 166 CD2 LEU A 20 -14.572 21.017 3.445 1.00 47.09 C ATOM 167 N LYS A 21 -14.858 18.432 -0.476 1.00 47.72 N ATOM 168 CA LYS A 21 -14.737 18.170 -1.920 1.00 48.68 C ATOM 169 C LYS A 21 -13.375 18.626 -2.476 1.00 48.92 C ATOM 170 O LYS A 21 -12.812 17.988 -3.378 1.00 49.50 O ATOM 171 CB LYS A 21 -15.890 18.819 -2.699 1.00 48.95 C ATOM 172 CG LYS A 21 -16.217 18.133 -4.036 1.00 49.89 C ATOM 173 CD LYS A 21 -17.153 16.938 -3.845 1.00 51.35 C ATOM 174 CE LYS A 21 -17.813 16.516 -5.157 1.00 51.96 C ATOM 175 NZ LYS A 21 -18.857 15.469 -4.947 1.00 52.04 N ATOM 176 N ASN A 22 -12.849 19.721 -1.923 1.00 48.82 N ATOM 177 CA ASN A 22 -11.527 20.228 -2.287 1.00 48.22 C ATOM 178 C ASN A 22 -10.544 20.174 -1.109 1.00 47.62 C ATOM 179 O ASN A 22 -10.164 21.222 -0.583 1.00 47.64 O ATOM 180 CB ASN A 22 -11.633 21.673 -2.798 1.00 48.65 C ATOM 181 CG ASN A 22 -12.548 21.813 -4.008 1.00 49.07 C ATOM 182 OD1 ASN A 22 -12.294 21.236 -5.067 1.00 50.42 O ATOM 183 ND2 ASN A 22 -13.611 22.603 -3.858 1.00 49.83 N ATOM 184 N PRO A 23 -10.116 18.959 -0.690 1.00 46.90 N ATOM 185 CA PRO A 23 -9.194 18.920 0.447 1.00 46.33 C ATOM 186 C PRO A 23 -7.770 19.310 0.035 1.00 45.68 C ATOM 187 O PRO A 23 -7.541 19.679 -1.121 1.00 45.82 O ATOM 188 CB PRO A 23 -9.258 17.457 0.894 1.00 46.04 C ATOM 189 CG PRO A 23 -9.538 16.712 -0.346 1.00 46.89 C ATOM 190 CD PRO A 23 -10.401 17.604 -1.200 1.00 46.77 C ATOM 191 N GLU A 24 -6.836 19.253 0.981 1.00 44.89 N ATOM 192 CA GLU A 24 -5.437 19.527 0.700 1.00 44.16 C ATOM 193 C GLU A 24 -4.873 18.435 -0.211 1.00 44.33 C ATOM 194 O GLU A 24 -5.023 17.250 0.091 1.00 44.09 O ATOM 195 CB GLU A 24 -4.649 19.582 2.007 1.00 43.91 C ATOM 196 CG GLU A 24 -3.181 19.933 1.851 1.00 42.88 C ATOM 197 CD GLU A 24 -2.423 19.938 3.170 1.00 43.57 C ATOM 198 OE1 GLU A 24 -3.060 20.011 4.251 1.00 40.69 O ATOM 199 OE2 GLU A 24 -1.176 19.863 3.125 1.00 41.83 O ATOM 200 N PRO A 25 -4.228 18.826 -1.337 1.00 44.54 N ATOM 201 CA PRO A 25 -3.533 17.834 -2.172 1.00 44.46 C ATOM 202 C PRO A 25 -2.428 17.123 -1.390 1.00 44.42 C ATOM 203 O PRO A 25 -1.614 17.783 -0.744 1.00 44.53 O ATOM 204 CB PRO A 25 -2.939 18.678 -3.315 1.00 44.54 C ATOM 205 CG PRO A 25 -2.948 20.078 -2.824 1.00 44.57 C ATOM 206 CD PRO A 25 -4.114 20.188 -1.891 1.00 44.44 C ATOM 207 N ILE A 26 -2.412 15.792 -1.433 1.00 44.61 N ATOM 208 CA ILE A 26 -1.413 15.019 -0.681 1.00 45.11 C ATOM 209 C ILE A 26 -0.555 14.071 -1.530 1.00 45.23 C ATOM 210 O ILE A 26 -0.993 13.563 -2.560 1.00 45.09 O ATOM 211 CB ILE A 26 -2.038 14.233 0.512 1.00 44.97 C ATOM 212 CG1 ILE A 26 -3.164 13.297 0.041 1.00 45.52 C ATOM 213 CG2 ILE A 26 -2.522 15.204 1.587 1.00 45.02 C ATOM 214 CD1 ILE A 26 -3.597 12.256 1.085 1.00 45.09 C ATOM 215 N SER A 27 0.676 13.865 -1.078 1.00 45.59 N ATOM 216 CA SER A 27 1.559 12.839 -1.625 1.00 45.81 C ATOM 217 C SER A 27 1.408 11.603 -0.765 1.00 46.03 C ATOM 218 O SER A 27 0.791 11.662 0.305 1.00 45.83 O ATOM 219 CB SER A 27 3.014 13.309 -1.598 1.00 45.74 C ATOM 220 OG SER A 27 3.493 13.398 -0.269 1.00 45.87 O ATOM 221 N GLU A 28 2.001 10.504 -1.222 1.00 46.02 N ATOM 222 CA GLU A 28 1.881 9.198 -0.584 1.00 46.50 C ATOM 223 C GLU A 28 2.481 9.132 0.824 1.00 46.46 C ATOM 224 O GLU A 28 1.994 8.387 1.685 1.00 46.60 O ATOM 225 CB GLU A 28 2.529 8.134 -1.475 1.00 46.48 C ATOM 226 CG GLU A 28 2.255 6.700 -1.049 1.00 47.96 C ATOM 227 CD GLU A 28 0.859 6.215 -1.409 1.00 49.88 C ATOM 228 OE1 GLU A 28 0.200 6.846 -2.273 1.00 49.55 O ATOM 229 OE2 GLU A 28 0.434 5.191 -0.829 1.00 50.77 O ATOM 230 N ASP A 29 3.550 9.894 1.048 1.00 46.23 N ATOM 231 CA ASP A 29 4.162 9.991 2.375 1.00 46.18 C ATOM 232 C ASP A 29 3.232 10.719 3.372 1.00 45.40 C ATOM 233 O ASP A 29 3.326 10.518 4.586 1.00 44.94 O ATOM 234 CB ASP A 29 5.507 10.722 2.286 1.00 46.74 C ATOM 235 CG ASP A 29 6.554 10.143 3.233 1.00 48.72 C ATOM 236 OD1 ASP A 29 7.033 10.897 4.108 1.00 49.66 O ATOM 237 OD2 ASP A 29 6.902 8.938 3.100 1.00 50.15 O ATOM 238 N MET A 30 2.332 11.543 2.841 1.00 44.71 N ATOM 239 CA MET A 30 1.439 12.357 3.669 1.00 45.11 C ATOM 240 C MET A 30 0.232 11.609 4.239 1.00 45.20 C ATOM 241 O MET A 30 -0.442 12.129 5.138 1.00 44.84 O ATOM 242 CB MET A 30 0.958 13.590 2.904 1.00 44.94 C ATOM 243 CG MET A 30 2.045 14.599 2.588 1.00 44.95 C ATOM 244 SD MET A 30 1.444 15.853 1.458 1.00 45.13 S ATOM 245 CE MET A 30 2.826 16.994 1.439 1.00 45.28 C ATOM 246 N LYS A 31 -0.038 10.399 3.736 1.00 45.30 N ATOM 247 CA LYS A 31 -1.239 9.662 4.155 1.00 45.70 C ATOM 248 C LYS A 31 -1.091 8.879 5.461 1.00 45.41 C ATOM 249 O LYS A 31 -2.070 8.357 5.998 1.00 45.31 O ATOM 250 CB LYS A 31 -1.846 8.808 3.021 1.00 45.87 C ATOM 251 CG LYS A 31 -0.883 8.152 2.066 1.00 46.10 C ATOM 252 CD LYS A 31 -1.616 7.516 0.882 1.00 47.21 C ATOM 253 CE LYS A 31 -2.035 8.542 -0.181 1.00 48.88 C ATOM 254 NZ LYS A 31 -2.775 7.905 -1.319 1.00 50.10 N ATOM 255 N ARG A 32 0.134 8.807 5.966 1.00 45.20 N ATOM 256 CA ARG A 32 0.386 8.321 7.314 1.00 45.29 C ATOM 257 C ARG A 32 1.635 8.950 7.918 1.00 44.67 C ATOM 258 O ARG A 32 2.511 9.458 7.211 1.00 45.03 O ATOM 259 CB ARG A 32 0.435 6.786 7.399 1.00 45.13 C ATOM 260 CG ARG A 32 1.143 6.086 6.266 1.00 46.42 C ATOM 261 CD ARG A 32 1.051 4.571 6.403 1.00 46.63 C ATOM 262 NE ARG A 32 -0.332 4.101 6.454 1.00 49.27 N ATOM 263 CZ ARG A 32 -0.896 3.518 7.511 1.00 51.09 C ATOM 264 NH1 ARG A 32 -0.204 3.312 8.627 1.00 51.95 N ATOM 265 NH2 ARG A 32 -2.161 3.118 7.450 1.00 52.27 N ATOM 266 N GLY A 33 1.707 8.929 9.235 1.00 43.73 N ATOM 267 CA GLY A 33 2.766 9.627 9.925 1.00 42.94 C ATOM 268 C GLY A 33 2.750 9.267 11.381 1.00 42.46 C ATOM 269 O GLY A 33 1.725 8.837 11.921 1.00 42.43 O ATOM 270 N ARG A 34 3.905 9.424 12.009 1.00 42.11 N ATOM 271 CA ARG A 34 4.062 9.141 13.414 1.00 41.84 C ATOM 272 C ARG A 34 5.186 10.007 13.950 1.00 41.46 C ATOM 273 O ARG A 34 6.235 10.120 13.319 1.00 41.83 O ATOM 274 CB ARG A 34 4.377 7.658 13.618 1.00 42.03 C ATOM 275 CG ARG A 34 4.553 7.278 15.055 1.00 43.21 C ATOM 276 CD ARG A 34 4.760 5.795 15.237 1.00 44.31 C ATOM 277 NE ARG A 34 5.193 5.534 16.607 1.00 45.25 N ATOM 278 CZ ARG A 34 4.396 5.124 17.589 1.00 44.96 C ATOM 279 NH1 ARG A 34 3.106 4.898 17.363 1.00 45.82 N ATOM 280 NH2 ARG A 34 4.899 4.934 18.801 1.00 44.52 N ATOM 281 N MET A 35 4.958 10.637 15.096 1.00 40.33 N ATOM 282 CA MET A 35 6.035 11.261 15.842 1.00 39.38 C ATOM 283 C MET A 35 5.967 10.798 17.280 1.00 38.89 C ATOM 284 O MET A 35 4.892 10.456 17.787 1.00 38.98 O ATOM 285 CB MET A 35 5.953 12.789 15.795 1.00 39.25 C ATOM 286 CG MET A 35 6.123 13.402 14.423 1.00 39.07 C ATOM 287 SD MET A 35 6.141 15.187 14.568 1.00 39.10 S ATOM 288 CE MET A 35 7.890 15.532 14.674 1.00 37.70 C ATOM 289 N GLU A 36 7.112 10.802 17.945 1.00 38.06 N ATOM 290 CA GLU A 36 7.150 10.454 19.345 1.00 38.15 C ATOM 291 C GLU A 36 7.636 11.648 20.129 1.00 37.16 C ATOM 292 O GLU A 36 8.272 12.537 19.561 1.00 37.54 O ATOM 293 CB GLU A 36 8.065 9.253 19.578 1.00 38.08 C ATOM 294 CG GLU A 36 7.601 7.980 18.879 1.00 39.67 C ATOM 295 CD GLU A 36 8.518 6.803 19.154 1.00 40.09 C ATOM 296 OE1 GLU A 36 8.682 6.424 20.340 1.00 43.02 O ATOM 297 OE2 GLU A 36 9.066 6.254 18.180 1.00 42.51 O ATOM 298 N GLU A 37 7.329 11.662 21.426 1.00 35.78 N ATOM 299 CA GLU A 37 7.837 12.677 22.350 1.00 35.07 C ATOM 300 C GLU A 37 7.549 14.070 21.772 1.00 33.74 C ATOM 301 O GLU A 37 8.469 14.854 21.496 1.00 33.45 O ATOM 302 CB GLU A 37 9.342 12.458 22.599 1.00 35.49 C ATOM 303 CG GLU A 37 9.763 12.456 24.061 1.00 38.07 C ATOM 304 CD GLU A 37 9.081 11.376 24.882 1.00 39.56 C ATOM 305 OE1 GLU A 37 8.863 10.262 24.359 1.00 43.21 O ATOM 306 OE2 GLU A 37 8.757 11.642 26.055 1.00 40.15 O ATOM 307 N VAL A 38 6.254 14.369 21.625 1.00 31.14 N ATOM 308 CA VAL A 38 5.791 15.384 20.690 1.00 28.70 C ATOM 309 C VAL A 38 4.683 16.243 21.294 1.00 27.34 C ATOM 310 O VAL A 38 3.778 15.734 21.954 1.00 26.22 O ATOM 311 CB VAL A 38 5.316 14.699 19.359 1.00 29.26 C ATOM 312 CG1 VAL A 38 4.243 13.635 19.623 1.00 28.52 C ATOM 313 CG2 VAL A 38 4.859 15.708 18.293 1.00 26.82 C ATOM 314 N LEU A 39 4.779 17.550 21.087 1.00 25.70 N ATOM 315 CA LEU A 39 3.699 18.448 21.450 1.00 24.58 C ATOM 316 C LEU A 39 2.743 18.493 20.269 1.00 24.28 C ATOM 317 O LEU A 39 3.082 19.030 19.195 1.00 24.24 O ATOM 318 CB LEU A 39 4.228 19.842 21.778 1.00 24.43 C ATOM 319 CG LEU A 39 3.190 20.866 22.255 1.00 22.80 C ATOM 320 CD1 LEU A 39 2.639 20.511 23.643 1.00 22.60 C ATOM 321 CD2 LEU A 39 3.792 22.248 22.264 1.00 23.44 C ATOM 322 N VAL A 40 1.562 17.904 20.446 1.00 23.57 N ATOM 323 CA VAL A 40 0.543 17.914 19.400 1.00 22.67 C ATOM 324 C VAL A 40 -0.338 19.160 19.527 1.00 22.72 C ATOM 325 O VAL A 40 -0.935 19.405 20.575 1.00 22.35 O ATOM 326 CB VAL A 40 -0.329 16.647 19.427 1.00 22.94 C ATOM 327 CG1 VAL A 40 -1.302 16.634 18.231 1.00 21.36 C ATOM 328 CG2 VAL A 40 0.558 15.384 19.410 1.00 23.42 C ATOM 329 N ALA A 41 -0.401 19.934 18.452 1.00 22.28 N ATOM 330 CA ALA A 41 -1.162 21.167 18.415 1.00 21.79 C ATOM 331 C ALA A 41 -2.389 20.901 17.557 1.00 21.32 C ATOM 332 O ALA A 41 -2.306 20.882 16.329 1.00 22.09 O ATOM 333 CB ALA A 41 -0.319 22.290 17.833 1.00 21.57 C ATOM 334 N PHE A 42 -3.518 20.632 18.208 1.00 20.69 N ATOM 335 CA PHE A 42 -4.814 20.518 17.512 1.00 19.89 C ATOM 336 C PHE A 42 -5.358 21.927 17.236 1.00 19.61 C ATOM 337 O PHE A 42 -5.579 22.698 18.176 1.00 19.57 O ATOM 338 CB PHE A 42 -5.815 19.728 18.372 1.00 19.89 C ATOM 339 CG PHE A 42 -5.453 18.274 18.561 1.00 19.81 C ATOM 340 CD1 PHE A 42 -5.750 17.329 17.573 1.00 21.11 C ATOM 341 CD2 PHE A 42 -4.823 17.842 19.715 1.00 19.64 C ATOM 342 CE1 PHE A 42 -5.406 15.964 17.738 1.00 21.85 C ATOM 343 CE2 PHE A 42 -4.492 16.477 19.885 1.00 20.95 C ATOM 344 CZ PHE A 42 -4.788 15.545 18.899 1.00 19.85 C ATOM 345 N ILE A 43 -5.558 22.280 15.967 1.00 18.72 N ATOM 346 CA ILE A 43 -5.829 23.683 15.641 1.00 19.45 C ATOM 347 C ILE A 43 -7.157 23.904 14.922 1.00 19.28 C ATOM 348 O ILE A 43 -7.416 23.287 13.890 1.00 20.65 O ATOM 349 CB ILE A 43 -4.635 24.367 14.856 1.00 19.12 C ATOM 350 CG1 ILE A 43 -3.381 24.379 15.735 1.00 19.50 C ATOM 351 CG2 ILE A 43 -5.025 25.802 14.371 1.00 18.73 C ATOM 352 CD1 ILE A 43 -2.063 24.687 15.009 1.00 19.66 C ATOM 353 N SER A 44 -7.998 24.767 15.498 1.00 19.31 N ATOM 354 CA SER A 44 -9.203 25.269 14.825 1.00 19.38 C ATOM 355 C SER A 44 -9.003 26.688 14.343 1.00 19.31 C ATOM 356 O SER A 44 -8.920 27.611 15.151 1.00 19.46 O ATOM 357 CB SER A 44 -10.421 25.247 15.762 1.00 19.59 C ATOM 358 OG SER A 44 -10.732 23.933 16.175 1.00 19.44 O ATOM 359 N VAL A 45 -8.961 26.867 13.032 1.00 19.29 N ATOM 360 CA VAL A 45 -8.839 28.200 12.452 1.00 20.58 C ATOM 361 C VAL A 45 -10.234 28.804 12.360 1.00 21.08 C ATOM 362 O VAL A 45 -11.162 28.169 11.827 1.00 21.40 O ATOM 363 CB VAL A 45 -8.143 28.182 11.086 1.00 21.10 C ATOM 364 CG1 VAL A 45 -7.937 29.614 10.579 1.00 20.01 C ATOM 365 CG2 VAL A 45 -6.806 27.459 11.191 1.00 21.70 C ATOM 366 N GLU A 46 -10.370 30.010 12.899 1.00 21.38 N ATOM 367 CA GLU A 46 -11.679 30.650 13.089 1.00 22.76 C ATOM 368 C GLU A 46 -11.895 31.795 12.118 1.00 23.03 C ATOM 369 O GLU A 46 -10.942 32.355 11.553 1.00 22.97 O ATOM 370 CB GLU A 46 -11.849 31.182 14.524 1.00 21.92 C ATOM 371 CG GLU A 46 -11.945 30.110 15.615 1.00 23.38 C ATOM 372 CD GLU A 46 -12.104 30.699 17.024 1.00 23.85 C ATOM 373 OE1 GLU A 46 -11.244 31.509 17.440 1.00 24.25 O ATOM 374 OE2 GLU A 46 -13.084 30.342 17.726 1.00 23.12 O ATOM 375 N LYS A 47 -13.170 32.133 11.940 1.00 23.22 N ATOM 376 CA LYS A 47 -13.604 33.220 11.088 1.00 23.09 C ATOM 377 C LYS A 47 -12.876 34.540 11.373 1.00 23.67 C ATOM 378 O LYS A 47 -12.412 35.186 10.433 1.00 23.52 O ATOM 379 CB LYS A 47 -15.145 33.375 11.172 1.00 22.90 C ATOM 380 CG LYS A 47 -15.766 34.483 10.318 1.00 21.68 C ATOM 381 CD LYS A 47 -15.379 34.417 8.853 1.00 23.26 C ATOM 382 CE LYS A 47 -16.021 33.236 8.138 1.00 23.04 C ATOM 383 NZ LYS A 47 -15.638 33.151 6.691 1.00 25.98 N ATOM 384 N VAL A 48 -12.752 34.936 12.639 1.00 24.30 N ATOM 385 CA VAL A 48 -12.103 36.219 12.958 1.00 25.60 C ATOM 386 C VAL A 48 -10.601 36.232 12.524 1.00 25.14 C ATOM 387 O VAL A 48 -10.018 37.300 12.319 1.00 25.00 O ATOM 388 CB VAL A 48 -12.288 36.640 14.459 1.00 26.11 C ATOM 389 CG1 VAL A 48 -11.388 37.824 14.822 1.00 28.93 C ATOM 390 CG2 VAL A 48 -13.754 37.009 14.763 1.00 27.86 C ATOM 391 N ASP A 49 -10.001 35.054 12.356 1.00 24.45 N ATOM 392 CA ASP A 49 -8.590 34.955 11.916 1.00 24.60 C ATOM 393 C ASP A 49 -8.390 35.440 10.474 1.00 24.95 C ATOM 394 O ASP A 49 -7.266 35.774 10.072 1.00 24.09 O ATOM 395 CB ASP A 49 -8.053 33.515 12.040 1.00 23.29 C ATOM 396 CG ASP A 49 -8.151 32.949 13.469 1.00 22.67 C ATOM 397 OD1 ASP A 49 -8.130 33.708 14.460 1.00 23.30 O ATOM 398 OD2 ASP A 49 -8.240 31.719 13.594 1.00 20.52 O ATOM 399 N GLU A 50 -9.476 35.479 9.705 1.00 26.02 N ATOM 400 CA GLU A 50 -9.415 35.930 8.302 1.00 27.57 C ATOM 401 C GLU A 50 -9.073 37.424 8.178 1.00 27.81 C ATOM 402 O GLU A 50 -8.591 37.853 7.142 1.00 28.32 O ATOM 403 CB GLU A 50 -10.706 35.600 7.524 1.00 26.95 C ATOM 404 CG GLU A 50 -11.086 34.093 7.479 1.00 28.02 C ATOM 405 CD GLU A 50 -12.358 33.815 6.660 1.00 28.71 C ATOM 406 OE1 GLU A 50 -12.674 34.586 5.734 1.00 29.39 O ATOM 407 OE2 GLU A 50 -13.037 32.804 6.930 1.00 31.25 O ATOM 408 N LYS A 51 -9.323 38.204 9.225 1.00 28.91 N ATOM 409 CA LYS A 51 -8.934 39.626 9.244 1.00 29.82 C ATOM 410 C LYS A 51 -7.404 39.798 9.091 1.00 29.40 C ATOM 411 O LYS A 51 -6.932 40.732 8.437 1.00 29.22 O ATOM 412 CB LYS A 51 -9.395 40.295 10.534 1.00 30.36 C ATOM 413 CG LYS A 51 -10.908 40.460 10.677 1.00 33.32 C ATOM 414 CD LYS A 51 -11.306 40.529 12.159 1.00 37.44 C ATOM 415 CE LYS A 51 -12.827 40.593 12.331 1.00 38.93 C ATOM 416 NZ LYS A 51 -13.221 40.803 13.754 1.00 39.80 N ATOM 417 N ASN A 52 -6.632 38.891 9.688 1.00 28.47 N ATOM 418 CA ASN A 52 -5.167 38.986 9.623 1.00 27.40 C ATOM 419 C ASN A 52 -4.461 37.644 9.781 1.00 26.82 C ATOM 420 O ASN A 52 -3.972 37.336 10.861 1.00 25.91 O ATOM 421 CB ASN A 52 -4.628 39.996 10.650 1.00 27.77 C ATOM 422 CG ASN A 52 -3.270 40.573 10.234 1.00 27.20 C ATOM 423 OD1 ASN A 52 -2.456 39.887 9.612 1.00 26.44 O ATOM 424 ND2 ASN A 52 -3.027 41.837 10.577 1.00 30.23 N ATOM 425 N PRO A 53 -4.438 36.839 8.704 1.00 26.77 N ATOM 426 CA PRO A 53 -3.802 35.534 8.721 1.00 26.57 C ATOM 427 C PRO A 53 -2.367 35.569 9.240 1.00 26.94 C ATOM 428 O PRO A 53 -1.985 34.698 10.025 1.00 26.71 O ATOM 429 CB PRO A 53 -3.868 35.091 7.259 1.00 26.54 C ATOM 430 CG PRO A 53 -5.124 35.777 6.737 1.00 27.27 C ATOM 431 CD PRO A 53 -5.096 37.116 7.406 1.00 26.92 C ATOM 432 N GLU A 54 -1.593 36.575 8.829 1.00 26.69 N ATOM 433 CA GLU A 54 -0.202 36.662 9.233 1.00 26.62 C ATOM 434 C GLU A 54 -0.031 36.900 10.738 1.00 25.86 C ATOM 435 O GLU A 54 0.750 36.196 11.384 1.00 25.89 O ATOM 436 CB GLU A 54 0.533 37.737 8.433 1.00 26.82 C ATOM 437 CG GLU A 54 2.001 37.829 8.798 1.00 29.50 C ATOM 438 CD GLU A 54 2.631 39.093 8.282 1.00 32.26 C ATOM 439 OE1 GLU A 54 2.522 39.362 7.070 1.00 33.68 O ATOM 440 OE2 GLU A 54 3.226 39.813 9.097 1.00 36.20 O ATOM 441 N GLU A 55 -0.747 37.885 11.278 1.00 24.85 N ATOM 442 CA GLU A 55 -0.668 38.234 12.697 1.00 25.84 C ATOM 443 C GLU A 55 -1.063 37.054 13.585 1.00 24.96 C ATOM 444 O GLU A 55 -0.384 36.778 14.582 1.00 23.89 O ATOM 445 CB GLU A 55 -1.570 39.437 12.999 1.00 25.58 C ATOM 446 CG GLU A 55 -1.403 40.055 14.393 1.00 28.35 C ATOM 447 CD GLU A 55 -2.672 40.750 14.918 1.00 28.44 C ATOM 448 OE1 GLU A 55 -3.534 41.184 14.120 1.00 31.24 O ATOM 449 OE2 GLU A 55 -2.807 40.859 16.149 1.00 33.48 O ATOM 450 N VAL A 56 -2.170 36.389 13.229 1.00 24.00 N ATOM 451 CA VAL A 56 -2.678 35.229 13.986 1.00 24.40 C ATOM 452 C VAL A 56 -1.649 34.101 13.985 1.00 22.99 C ATOM 453 O VAL A 56 -1.390 33.486 15.008 1.00 22.81 O ATOM 454 CB VAL A 56 -4.002 34.629 13.372 1.00 23.88 C ATOM 455 CG1 VAL A 56 -4.449 33.409 14.181 1.00 27.15 C ATOM 456 CG2 VAL A 56 -5.103 35.625 13.382 1.00 26.55 C ATOM 457 N SER A 57 -1.107 33.804 12.811 1.00 22.96 N ATOM 458 CA SER A 57 -0.132 32.712 12.681 1.00 22.91 C ATOM 459 C SER A 57 1.110 32.970 13.529 1.00 23.15 C ATOM 460 O SER A 57 1.584 32.085 14.243 1.00 23.34 O ATOM 461 CB SER A 57 0.269 32.544 11.237 1.00 22.84 C ATOM 462 OG SER A 57 -0.853 32.210 10.470 1.00 23.65 O ATOM 463 N LEU A 58 1.632 34.187 13.451 1.00 23.45 N ATOM 464 CA LEU A 58 2.807 34.551 14.222 1.00 24.14 C ATOM 465 C LEU A 58 2.543 34.386 15.726 1.00 24.13 C ATOM 466 O LEU A 58 3.357 33.798 16.429 1.00 23.39 O ATOM 467 CB LEU A 58 3.285 35.971 13.871 1.00 24.93 C ATOM 468 CG LEU A 58 3.794 36.265 12.438 1.00 26.63 C ATOM 469 CD1 LEU A 58 4.397 37.665 12.330 1.00 29.63 C ATOM 470 CD2 LEU A 58 4.816 35.250 11.920 1.00 31.17 C ATOM 471 N LYS A 59 1.385 34.866 16.193 1.00 24.20 N ATOM 472 CA LYS A 59 0.969 34.704 17.590 1.00 24.73 C ATOM 473 C LYS A 59 0.866 33.229 17.983 1.00 23.85 C ATOM 474 O LYS A 59 1.318 32.835 19.048 1.00 24.36 O ATOM 475 CB LYS A 59 -0.362 35.410 17.829 1.00 24.68 C ATOM 476 CG LYS A 59 -0.256 36.889 18.188 1.00 28.60 C ATOM 477 CD LYS A 59 -1.615 37.539 18.064 1.00 32.97 C ATOM 478 CE LYS A 59 -1.705 38.815 18.858 1.00 37.15 C ATOM 479 NZ LYS A 59 -3.044 39.440 18.658 1.00 40.00 N ATOM 480 N ALA A 60 0.276 32.421 17.110 1.00 23.70 N ATOM 481 CA ALA A 60 0.208 30.963 17.304 1.00 22.93 C ATOM 482 C ALA A 60 1.596 30.343 17.361 1.00 22.83 C ATOM 483 O ALA A 60 1.886 29.550 18.233 1.00 22.78 O ATOM 484 CB ALA A 60 -0.624 30.318 16.184 1.00 22.14 C ATOM 485 N ILE A 61 2.469 30.737 16.447 1.00 22.85 N ATOM 486 CA ILE A 61 3.830 30.193 16.404 1.00 23.91 C ATOM 487 C ILE A 61 4.552 30.456 17.733 1.00 24.46 C ATOM 488 O ILE A 61 5.209 29.562 18.280 1.00 24.11 O ATOM 489 CB ILE A 61 4.614 30.765 15.186 1.00 23.98 C ATOM 490 CG1 ILE A 61 4.035 30.213 13.883 1.00 23.58 C ATOM 491 CG2 ILE A 61 6.145 30.520 15.312 1.00 23.64 C ATOM 492 CD1 ILE A 61 4.385 31.047 12.664 1.00 22.12 C ATOM 493 N GLU A 62 4.391 31.673 18.250 1.00 25.30 N ATOM 494 CA GLU A 62 4.972 32.078 19.525 1.00 26.47 C ATOM 495 C GLU A 62 4.395 31.291 20.711 1.00 25.72 C ATOM 496 O GLU A 62 5.143 30.814 21.559 1.00 24.73 O ATOM 497 CB GLU A 62 4.783 33.586 19.718 1.00 27.28 C ATOM 498 CG GLU A 62 5.528 34.196 20.898 1.00 32.67 C ATOM 499 CD GLU A 62 7.040 34.353 20.659 1.00 38.55 C ATOM 500 OE1 GLU A 62 7.737 33.329 20.474 1.00 40.66 O ATOM 501 OE2 GLU A 62 7.538 35.507 20.681 1.00 42.33 O ATOM 502 N GLU A 63 3.070 31.154 20.766 1.00 25.22 N ATOM 503 CA GLU A 63 2.430 30.423 21.849 1.00 25.05 C ATOM 504 C GLU A 63 2.757 28.944 21.880 1.00 24.09 C ATOM 505 O GLU A 63 2.940 28.363 22.956 1.00 23.00 O ATOM 506 CB GLU A 63 0.910 30.631 21.841 1.00 25.82 C ATOM 507 CG GLU A 63 0.513 32.026 22.267 1.00 30.17 C ATOM 508 CD GLU A 63 1.221 32.466 23.543 1.00 35.54 C ATOM 509 OE1 GLU A 63 0.932 31.858 24.600 1.00 36.25 O ATOM 510 OE2 GLU A 63 2.073 33.400 23.474 1.00 39.04 O ATOM 511 N ILE A 64 2.782 28.333 20.701 1.00 23.66 N ATOM 512 CA ILE A 64 3.071 26.912 20.569 1.00 23.50 C ATOM 513 C ILE A 64 4.531 26.669 20.934 1.00 23.83 C ATOM 514 O ILE A 64 4.826 25.740 21.681 1.00 24.44 O ATOM 515 CB ILE A 64 2.709 26.375 19.158 1.00 23.44 C ATOM 516 CG1 ILE A 64 1.176 26.453 18.961 1.00 23.89 C ATOM 517 CG2 ILE A 64 3.199 24.925 18.989 1.00 22.92 C ATOM 518 CD1 ILE A 64 0.673 26.327 17.529 1.00 22.43 C ATOM 519 N SER A 65 5.432 27.525 20.446 1.00 24.87 N ATOM 520 CA SER A 65 6.871 27.440 20.793 1.00 25.33 C ATOM 521 C SER A 65 7.108 27.541 22.289 1.00 25.62 C ATOM 522 O SER A 65 7.885 26.768 22.850 1.00 25.82 O ATOM 523 CB SER A 65 7.689 28.517 20.066 1.00 24.86 C ATOM 524 OG SER A 65 7.603 28.302 18.668 1.00 26.06 O ATOM 525 N LYS A 66 6.451 28.505 22.926 1.00 25.77 N ATOM 526 CA LYS A 66 6.571 28.697 24.368 1.00 26.59 C ATOM 527 C LYS A 66 6.177 27.472 25.175 1.00 26.17 C ATOM 528 O LYS A 66 6.857 27.111 26.125 1.00 26.30 O ATOM 529 CB LYS A 66 5.757 29.903 24.829 1.00 26.75 C ATOM 530 CG LYS A 66 5.908 30.157 26.322 1.00 29.62 C ATOM 531 CD LYS A 66 5.787 31.618 26.673 1.00 33.02 C ATOM 532 CE LYS A 66 4.366 32.050 26.726 1.00 33.83 C ATOM 533 NZ LYS A 66 4.248 33.299 27.535 1.00 35.25 N ATOM 534 N VAL A 67 5.077 26.831 24.799 1.00 26.18 N ATOM 535 CA VAL A 67 4.636 25.622 25.498 1.00 25.73 C ATOM 536 C VAL A 67 5.622 24.467 25.244 1.00 26.05 C ATOM 537 O VAL A 67 5.953 23.714 26.163 1.00 24.65 O ATOM 538 CB VAL A 67 3.173 25.257 25.148 1.00 25.12 C ATOM 539 CG1 VAL A 67 2.822 23.865 25.629 1.00 25.94 C ATOM 540 CG2 VAL A 67 2.242 26.256 25.792 1.00 25.26 C ATOM 541 N ALA A 68 6.108 24.355 24.007 1.00 26.45 N ATOM 542 CA ALA A 68 7.086 23.306 23.674 1.00 28.06 C ATOM 543 C ALA A 68 8.360 23.505 24.481 1.00 29.29 C ATOM 544 O ALA A 68 8.928 22.535 24.982 1.00 28.66 O ATOM 545 CB ALA A 68 7.383 23.256 22.154 1.00 27.00 C ATOM 546 N GLU A 69 8.778 24.761 24.635 1.00 30.82 N ATOM 547 CA GLU A 69 9.936 25.081 25.461 1.00 33.58 C ATOM 548 C GLU A 69 9.697 24.679 26.914 1.00 34.29 C ATOM 549 O GLU A 69 10.592 24.117 27.531 1.00 34.71 O ATOM 550 CB GLU A 69 10.305 26.570 25.404 1.00 34.08 C ATOM 551 CG GLU A 69 10.340 27.211 24.014 1.00 38.25 C ATOM 552 CD GLU A 69 11.618 26.954 23.227 1.00 43.53 C ATOM 553 OE1 GLU A 69 12.134 25.805 23.243 1.00 45.22 O ATOM 554 OE2 GLU A 69 12.092 27.915 22.568 1.00 43.83 O ATOM 555 N GLN A 70 8.498 24.957 27.448 1.00 35.18 N ATOM 556 CA GLN A 70 8.151 24.625 28.850 1.00 35.99 C ATOM 557 C GLN A 70 8.226 23.132 29.144 1.00 35.59 C ATOM 558 O GLN A 70 8.712 22.725 30.197 1.00 36.21 O ATOM 559 CB GLN A 70 6.733 25.083 29.209 1.00 35.82 C ATOM 560 CG GLN A 70 6.550 26.564 29.491 1.00 38.23 C ATOM 561 CD GLN A 70 5.074 26.952 29.525 1.00 38.43 C ATOM 562 OE1 GLN A 70 4.308 26.441 30.340 1.00 42.38 O ATOM 563 NE2 GLN A 70 4.667 27.840 28.619 1.00 41.28 N ATOM 564 N VAL A 71 7.695 22.328 28.231 1.00 35.02 N ATOM 565 CA VAL A 71 7.610 20.883 28.413 1.00 34.17 C ATOM 566 C VAL A 71 8.810 20.202 27.776 1.00 34.13 C ATOM 567 O VAL A 71 8.882 18.971 27.734 1.00 33.58 O ATOM 568 CB VAL A 71 6.299 20.294 27.809 1.00 34.03 C ATOM 569 CG1 VAL A 71 5.073 20.944 28.446 1.00 34.19 C ATOM 570 CG2 VAL A 71 6.279 20.428 26.280 1.00 33.04 C ATOM 571 N LYS A 72 9.724 21.023 27.254 1.00 33.89 N ATOM 572 CA LYS A 72 10.952 20.564 26.613 1.00 34.12 C ATOM 573 C LYS A 72 10.672 19.571 25.480 1.00 33.54 C ATOM 574 O LYS A 72 11.297 18.504 25.417 1.00 33.65 O ATOM 575 CB LYS A 72 11.919 19.981 27.663 1.00 34.50 C ATOM 576 CG LYS A 72 12.786 21.020 28.388 1.00 36.18 C ATOM 577 CD LYS A 72 12.011 21.875 29.387 1.00 38.37 C ATOM 578 CE LYS A 72 12.714 23.215 29.643 1.00 40.60 C ATOM 579 NZ LYS A 72 11.930 24.117 30.547 1.00 40.60 N ATOM 580 N ALA A 73 9.727 19.921 24.602 1.00 32.13 N ATOM 581 CA ALA A 73 9.440 19.139 23.403 1.00 32.12 C ATOM 582 C ALA A 73 10.254 19.704 22.257 1.00 32.28 C ATOM 583 O ALA A 73 10.305 20.922 22.085 1.00 31.56 O ATOM 584 CB ALA A 73 7.930 19.181 23.049 1.00 32.33 C ATOM 585 N GLU A 74 10.884 18.801 21.492 1.00 32.17 N ATOM 586 CA GLU A 74 11.691 19.129 20.315 1.00 32.21 C ATOM 587 C GLU A 74 10.908 18.798 19.046 1.00 30.79 C ATOM 588 O GLU A 74 11.267 19.225 17.943 1.00 30.49 O ATOM 589 CB GLU A 74 13.017 18.346 20.346 1.00 32.09 C ATOM 590 CG GLU A 74 13.972 18.845 21.426 1.00 34.49 C ATOM 591 CD GLU A 74 15.336 18.165 21.412 1.00 35.15 C ATOM 592 OE1 GLU A 74 15.669 17.465 20.413 1.00 37.90 O ATOM 593 OE2 GLU A 74 16.069 18.337 22.420 1.00 38.65 O ATOM 594 N ASN A 75 9.826 18.044 19.221 1.00 29.13 N ATOM 595 CA ASN A 75 8.947 17.668 18.130 1.00 27.89 C ATOM 596 C ASN A 75 7.570 18.323 18.316 1.00 26.64 C ATOM 597 O ASN A 75 7.032 18.340 19.429 1.00 25.97 O ATOM 598 CB ASN A 75 8.827 16.146 18.074 1.00 28.13 C ATOM 599 CG ASN A 75 10.189 15.456 17.954 1.00 30.44 C ATOM 600 OD1 ASN A 75 10.940 15.719 17.014 1.00 31.79 O ATOM 601 ND2 ASN A 75 10.504 14.575 18.902 1.00 28.61 N ATOM 602 N VAL A 76 7.044 18.920 17.252 1.00 25.30 N ATOM 603 CA VAL A 76 5.686 19.501 17.268 1.00 24.52 C ATOM 604 C VAL A 76 4.910 18.878 16.125 1.00 24.25 C ATOM 605 O VAL A 76 5.485 18.578 15.060 1.00 24.12 O ATOM 606 CB VAL A 76 5.671 21.048 17.100 1.00 24.31 C ATOM 607 CG1 VAL A 76 4.226 21.590 17.108 1.00 23.13 C ATOM 608 CG2 VAL A 76 6.510 21.741 18.184 1.00 25.79 C ATOM 609 N PHE A 77 3.611 18.666 16.331 1.00 23.58 N ATOM 610 CA PHE A 77 2.766 18.133 15.283 1.00 23.15 C ATOM 611 C PHE A 77 1.570 19.056 15.101 1.00 22.96 C ATOM 612 O PHE A 77 0.879 19.366 16.076 1.00 22.87 O ATOM 613 CB PHE A 77 2.305 16.717 15.653 1.00 23.37 C ATOM 614 CG PHE A 77 1.722 15.945 14.496 1.00 24.79 C ATOM 615 CD1 PHE A 77 2.528 15.106 13.717 1.00 26.31 C ATOM 616 CD2 PHE A 77 0.379 16.055 14.172 1.00 24.95 C ATOM 617 CE1 PHE A 77 1.995 14.411 12.648 1.00 25.26 C ATOM 618 CE2 PHE A 77 -0.148 15.368 13.108 1.00 26.23 C ATOM 619 CZ PHE A 77 0.657 14.541 12.346 1.00 26.17 C ATOM 620 N VAL A 78 1.336 19.492 13.866 1.00 22.73 N ATOM 621 CA VAL A 78 0.183 20.341 13.538 1.00 23.06 C ATOM 622 C VAL A 78 -0.973 19.470 13.061 1.00 22.56 C ATOM 623 O VAL A 78 -0.936 18.885 11.972 1.00 22.72 O ATOM 624 CB VAL A 78 0.522 21.439 12.467 1.00 22.69 C ATOM 625 CG1 VAL A 78 -0.747 22.216 12.038 1.00 21.76 C ATOM 626 CG2 VAL A 78 1.641 22.402 12.973 1.00 23.94 C ATOM 627 N TYR A 79 -2.005 19.383 13.886 1.00 23.19 N ATOM 628 CA TYR A 79 -3.115 18.512 13.591 1.00 22.91 C ATOM 629 C TYR A 79 -4.379 19.363 13.355 1.00 23.01 C ATOM 630 O TYR A 79 -4.927 19.925 14.297 1.00 22.59 O ATOM 631 CB TYR A 79 -3.298 17.478 14.718 1.00 23.65 C ATOM 632 CG TYR A 79 -4.133 16.282 14.287 1.00 24.42 C ATOM 633 CD1 TYR A 79 -5.503 16.398 14.080 1.00 24.16 C ATOM 634 CD2 TYR A 79 -3.533 15.047 14.038 1.00 26.05 C ATOM 635 CE1 TYR A 79 -6.275 15.301 13.646 1.00 25.14 C ATOM 636 CE2 TYR A 79 -4.279 13.955 13.611 1.00 24.02 C ATOM 637 CZ TYR A 79 -5.644 14.087 13.422 1.00 25.36 C ATOM 638 OH TYR A 79 -6.366 12.999 13.006 1.00 26.32 O ATOM 639 N PRO A 80 -4.848 19.456 12.100 1.00 23.34 N ATOM 640 CA PRO A 80 -6.012 20.308 11.881 1.00 23.83 C ATOM 641 C PRO A 80 -7.238 19.679 12.566 1.00 24.70 C ATOM 642 O PRO A 80 -7.470 18.474 12.453 1.00 23.65 O ATOM 643 CB PRO A 80 -6.177 20.312 10.350 1.00 23.88 C ATOM 644 CG PRO A 80 -4.890 19.727 9.803 1.00 23.27 C ATOM 645 CD PRO A 80 -4.423 18.777 10.859 1.00 23.65 C ATOM 646 N PHE A 81 -7.986 20.494 13.301 1.00 25.43 N ATOM 647 CA PHE A 81 -9.018 19.980 14.188 1.00 26.76 C ATOM 648 C PHE A 81 -10.083 21.043 14.373 1.00 27.43 C ATOM 649 O PHE A 81 -9.914 21.963 15.171 1.00 28.74 O ATOM 650 CB PHE A 81 -8.385 19.645 15.531 1.00 26.57 C ATOM 651 CG PHE A 81 -9.075 18.550 16.287 1.00 27.92 C ATOM 652 CD1 PHE A 81 -8.987 17.222 15.858 1.00 28.88 C ATOM 653 CD2 PHE A 81 -9.778 18.838 17.461 1.00 28.32 C ATOM 654 CE1 PHE A 81 -9.602 16.192 16.571 1.00 27.16 C ATOM 655 CE2 PHE A 81 -10.393 17.807 18.187 1.00 28.81 C ATOM 656 CZ PHE A 81 -10.299 16.485 17.734 1.00 28.15 C ATOM 657 N ALA A 82 -11.185 20.883 13.656 1.00 27.62 N ATOM 658 CA ALA A 82 -12.255 21.880 13.586 1.00 28.25 C ATOM 659 C ALA A 82 -13.129 22.036 14.840 1.00 28.38 C ATOM 660 O ALA A 82 -13.793 23.055 15.005 1.00 28.96 O ATOM 661 CB ALA A 82 -13.123 21.573 12.397 1.00 28.27 C ATOM 662 N HIS A 83 -13.088 21.051 15.726 1.00 28.14 N ATOM 663 CA HIS A 83 -14.078 20.882 16.811 1.00 27.81 C ATOM 664 C HIS A 83 -13.949 21.777 18.039 1.00 27.23 C ATOM 665 O HIS A 83 -14.797 21.734 18.927 1.00 28.33 O ATOM 666 CB HIS A 83 -14.078 19.409 17.238 1.00 27.71 C ATOM 667 CG HIS A 83 -14.353 18.481 16.108 1.00 26.77 C ATOM 668 ND1 HIS A 83 -13.399 17.635 15.586 1.00 28.03 N ATOM 669 CD2 HIS A 83 -15.471 18.291 15.369 1.00 27.85 C ATOM 670 CE1 HIS A 83 -13.918 16.961 14.577 1.00 27.90 C ATOM 671 NE2 HIS A 83 -15.176 17.337 14.425 1.00 28.75 N ATOM 672 N LEU A 84 -12.894 22.584 18.089 1.00 26.69 N ATOM 673 CA LEU A 84 -12.642 23.512 19.196 1.00 25.79 C ATOM 674 C LEU A 84 -13.434 24.815 19.066 1.00 25.52 C ATOM 675 O LEU A 84 -13.478 25.612 19.997 1.00 25.14 O ATOM 676 CB LEU A 84 -11.144 23.816 19.324 1.00 25.42 C ATOM 677 CG LEU A 84 -10.160 22.633 19.373 1.00 26.80 C ATOM 678 CD1 LEU A 84 -8.723 23.133 19.468 1.00 25.74 C ATOM 679 CD2 LEU A 84 -10.461 21.676 20.532 1.00 25.97 C ATOM 680 N SER A 85 -14.059 25.017 17.913 1.00 25.43 N ATOM 681 CA SER A 85 -14.889 26.192 17.674 1.00 26.02 C ATOM 682 C SER A 85 -15.972 25.888 16.649 1.00 26.13 C ATOM 683 O SER A 85 -15.824 24.974 15.839 1.00 26.15 O ATOM 684 CB SER A 85 -14.021 27.367 17.197 1.00 25.62 C ATOM 685 OG SER A 85 -14.802 28.497 16.867 1.00 26.39 O ATOM 686 N SER A 86 -17.061 26.653 16.716 1.00 26.20 N ATOM 687 CA SER A 86 -18.114 26.638 15.706 1.00 27.76 C ATOM 688 C SER A 86 -17.973 27.803 14.731 1.00 27.80 C ATOM 689 O SER A 86 -18.613 27.816 13.679 1.00 28.32 O ATOM 690 CB SER A 86 -19.492 26.709 16.380 1.00 27.96 C ATOM 691 OG SER A 86 -19.946 25.414 16.703 1.00 29.90 O ATOM 692 N GLU A 87 -17.126 28.777 15.090 1.00 27.87 N ATOM 693 CA GLU A 87 -16.934 30.013 14.324 1.00 27.69 C ATOM 694 C GLU A 87 -15.786 29.783 13.380 1.00 26.91 C ATOM 695 O GLU A 87 -14.738 30.405 13.546 1.00 26.10 O ATOM 696 CB GLU A 87 -16.500 31.136 15.266 1.00 28.31 C ATOM 697 CG GLU A 87 -17.557 32.088 15.752 1.00 33.48 C ATOM 698 CD GLU A 87 -18.852 31.434 16.129 1.00 37.25 C ATOM 699 OE1 GLU A 87 -18.853 30.452 16.910 1.00 42.42 O ATOM 700 OE2 GLU A 87 -19.876 31.922 15.646 1.00 38.10 O ATOM 701 N LEU A 88 -15.973 28.913 12.391 1.00 25.90 N ATOM 702 CA LEU A 88 -14.848 28.439 11.601 1.00 25.31 C ATOM 703 C LEU A 88 -14.482 29.328 10.412 1.00 25.31 C ATOM 704 O LEU A 88 -15.331 30.056 9.872 1.00 23.70 O ATOM 705 CB LEU A 88 -15.056 26.980 11.207 1.00 25.16 C ATOM 706 CG LEU A 88 -15.105 26.039 12.422 1.00 25.29 C ATOM 707 CD1 LEU A 88 -15.240 24.597 11.952 1.00 24.42 C ATOM 708 CD2 LEU A 88 -13.868 26.212 13.336 1.00 23.92 C ATOM 709 N ALA A 89 -13.201 29.294 10.036 1.00 24.94 N ATOM 710 CA ALA A 89 -12.739 30.043 8.872 1.00 24.97 C ATOM 711 C ALA A 89 -13.035 29.274 7.592 1.00 25.00 C ATOM 712 O ALA A 89 -13.175 28.050 7.604 1.00 25.30 O ATOM 713 CB ALA A 89 -11.250 30.357 8.976 1.00 24.50 C ATOM 714 N LYS A 90 -13.130 30.016 6.496 1.00 25.99 N ATOM 715 CA LYS A 90 -13.107 29.489 5.128 1.00 27.30 C ATOM 716 C LYS A 90 -11.948 28.488 4.980 1.00 27.28 C ATOM 717 O LYS A 90 -10.837 28.780 5.447 1.00 27.01 O ATOM 718 CB LYS A 90 -12.927 30.703 4.207 1.00 27.47 C ATOM 719 CG LYS A 90 -12.712 30.444 2.732 1.00 30.14 C ATOM 720 CD LYS A 90 -12.568 31.773 1.952 1.00 29.62 C ATOM 721 CE LYS A 90 -13.813 32.120 1.153 1.00 34.45 C ATOM 722 NZ LYS A 90 -14.169 31.059 0.140 1.00 37.45 N ATOM 723 N PRO A 91 -12.190 27.301 4.367 1.00 27.27 N ATOM 724 CA PRO A 91 -11.135 26.275 4.311 1.00 27.66 C ATOM 725 C PRO A 91 -9.808 26.731 3.661 1.00 27.79 C ATOM 726 O PRO A 91 -8.760 26.255 4.066 1.00 27.44 O ATOM 727 CB PRO A 91 -11.768 25.134 3.491 1.00 27.55 C ATOM 728 CG PRO A 91 -13.226 25.329 3.636 1.00 27.79 C ATOM 729 CD PRO A 91 -13.433 26.826 3.721 1.00 27.85 C ATOM 730 N SER A 92 -9.869 27.627 2.672 1.00 27.97 N ATOM 731 CA SER A 92 -8.671 28.162 2.026 1.00 28.15 C ATOM 732 C SER A 92 -7.823 28.969 3.017 1.00 27.77 C ATOM 733 O SER A 92 -6.600 28.809 3.073 1.00 27.38 O ATOM 734 CB SER A 92 -9.052 29.012 0.793 1.00 29.17 C ATOM 735 OG SER A 92 -9.756 30.196 1.154 1.00 29.99 O ATOM 736 N VAL A 93 -8.486 29.817 3.806 1.00 26.93 N ATOM 737 CA VAL A 93 -7.827 30.574 4.863 1.00 26.02 C ATOM 738 C VAL A 93 -7.331 29.638 5.973 1.00 25.66 C ATOM 739 O VAL A 93 -6.205 29.794 6.439 1.00 24.13 O ATOM 740 CB VAL A 93 -8.726 31.699 5.435 1.00 26.46 C ATOM 741 CG1 VAL A 93 -7.951 32.544 6.472 1.00 25.18 C ATOM 742 CG2 VAL A 93 -9.260 32.589 4.307 1.00 26.31 C ATOM 743 N ALA A 94 -8.144 28.653 6.373 1.00 25.27 N ATOM 744 CA ALA A 94 -7.674 27.637 7.333 1.00 25.33 C ATOM 745 C ALA A 94 -6.350 26.979 6.887 1.00 25.77 C ATOM 746 O ALA A 94 -5.403 26.915 7.659 1.00 24.50 O ATOM 747 CB ALA A 94 -8.746 26.579 7.608 1.00 25.70 C ATOM 748 N MET A 95 -6.286 26.513 5.638 1.00 25.84 N ATOM 749 CA MET A 95 -5.070 25.886 5.117 1.00 27.16 C ATOM 750 C MET A 95 -3.879 26.828 5.066 1.00 26.18 C ATOM 751 O MET A 95 -2.766 26.414 5.372 1.00 26.38 O ATOM 752 CB MET A 95 -5.311 25.288 3.732 1.00 27.22 C ATOM 753 CG MET A 95 -5.827 23.843 3.810 1.00 28.66 C ATOM 754 SD MET A 95 -6.371 23.115 2.245 1.00 32.17 S ATOM 755 CE MET A 95 -4.976 23.454 1.151 1.00 36.49 C ATOM 756 N ASP A 96 -4.134 28.067 4.652 1.00 25.07 N ATOM 757 CA ASP A 96 -3.147 29.151 4.640 1.00 24.78 C ATOM 758 C ASP A 96 -2.519 29.305 6.018 1.00 23.32 C ATOM 759 O ASP A 96 -1.302 29.286 6.152 1.00 22.19 O ATOM 760 CB ASP A 96 -3.842 30.441 4.213 1.00 24.85 C ATOM 761 CG ASP A 96 -2.918 31.658 4.188 1.00 28.87 C ATOM 762 OD1 ASP A 96 -1.677 31.506 4.166 1.00 30.69 O ATOM 763 OD2 ASP A 96 -3.463 32.790 4.186 1.00 32.11 O ATOM 764 N ILE A 97 -3.359 29.452 7.040 1.00 22.05 N ATOM 765 CA ILE A 97 -2.875 29.639 8.401 1.00 20.84 C ATOM 766 C ILE A 97 -2.182 28.401 8.978 1.00 20.93 C ATOM 767 O ILE A 97 -1.145 28.514 9.616 1.00 20.77 O ATOM 768 CB ILE A 97 -3.978 30.210 9.301 1.00 21.46 C ATOM 769 CG1 ILE A 97 -4.318 31.640 8.849 1.00 19.19 C ATOM 770 CG2 ILE A 97 -3.550 30.199 10.769 1.00 21.27 C ATOM 771 CD1 ILE A 97 -5.590 32.222 9.476 1.00 20.19 C ATOM 772 N LEU A 98 -2.740 27.221 8.723 1.00 21.12 N ATOM 773 CA LEU A 98 -2.128 25.978 9.150 1.00 21.95 C ATOM 774 C LEU A 98 -0.719 25.852 8.566 1.00 22.71 C ATOM 775 O LEU A 98 0.210 25.428 9.263 1.00 22.41 O ATOM 776 CB LEU A 98 -3.008 24.771 8.778 1.00 21.73 C ATOM 777 CG LEU A 98 -4.280 24.525 9.624 1.00 21.28 C ATOM 778 CD1 LEU A 98 -5.282 23.642 8.897 1.00 21.47 C ATOM 779 CD2 LEU A 98 -3.930 23.886 10.983 1.00 21.70 C ATOM 780 N ASN A 99 -0.569 26.240 7.298 1.00 23.35 N ATOM 781 CA ASN A 99 0.741 26.208 6.645 1.00 24.06 C ATOM 782 C ASN A 99 1.708 27.252 7.221 1.00 22.91 C ATOM 783 O ASN A 99 2.863 26.938 7.488 1.00 23.78 O ATOM 784 CB ASN A 99 0.621 26.372 5.129 1.00 24.55 C ATOM 785 CG ASN A 99 1.976 26.274 4.433 1.00 27.27 C ATOM 786 OD1 ASN A 99 2.505 27.274 3.904 1.00 30.60 O ATOM 787 ND2 ASN A 99 2.560 25.090 4.468 1.00 27.02 N ATOM 788 N ARG A 100 1.231 28.471 7.431 1.00 22.29 N ATOM 789 CA ARG A 100 2.040 29.522 8.058 1.00 22.15 C ATOM 790 C ARG A 100 2.598 29.068 9.413 1.00 22.13 C ATOM 791 O ARG A 100 3.777 29.308 9.735 1.00 20.87 O ATOM 792 CB ARG A 100 1.216 30.783 8.257 1.00 22.52 C ATOM 793 CG ARG A 100 1.064 31.648 7.017 1.00 23.72 C ATOM 794 CD ARG A 100 -0.206 32.478 7.106 1.00 28.64 C ATOM 795 NE ARG A 100 -0.118 33.800 6.492 1.00 30.02 N ATOM 796 CZ ARG A 100 0.234 34.053 5.235 1.00 31.55 C ATOM 797 NH1 ARG A 100 0.553 33.056 4.416 1.00 36.84 N ATOM 798 NH2 ARG A 100 0.287 35.310 4.794 1.00 28.64 N ATOM 799 N VAL A 101 1.736 28.430 10.207 1.00 20.89 N ATOM 800 CA VAL A 101 2.123 27.952 11.535 1.00 21.19 C ATOM 801 C VAL A 101 3.160 26.837 11.425 1.00 21.43 C ATOM 802 O VAL A 101 4.234 26.917 12.033 1.00 21.52 O ATOM 803 CB VAL A 101 0.895 27.527 12.365 1.00 20.73 C ATOM 804 CG1 VAL A 101 1.332 26.762 13.632 1.00 21.68 C ATOM 805 CG2 VAL A 101 0.098 28.762 12.718 1.00 20.42 C ATOM 806 N TYR A 102 2.843 25.831 10.616 1.00 22.35 N ATOM 807 CA TYR A 102 3.751 24.725 10.298 1.00 23.67 C ATOM 808 C TYR A 102 5.154 25.210 9.857 1.00 24.03 C ATOM 809 O TYR A 102 6.171 24.817 10.450 1.00 23.89 O ATOM 810 CB TYR A 102 3.110 23.866 9.206 1.00 23.64 C ATOM 811 CG TYR A 102 3.959 22.745 8.650 1.00 25.54 C ATOM 812 CD1 TYR A 102 4.392 21.697 9.466 1.00 24.46 C ATOM 813 CD2 TYR A 102 4.289 22.707 7.293 1.00 24.87 C ATOM 814 CE1 TYR A 102 5.149 20.644 8.948 1.00 25.43 C ATOM 815 CE2 TYR A 102 5.059 21.665 6.769 1.00 26.19 C ATOM 816 CZ TYR A 102 5.485 20.643 7.607 1.00 25.25 C ATOM 817 OH TYR A 102 6.244 19.610 7.109 1.00 26.27 O ATOM 818 N GLN A 103 5.194 26.067 8.840 1.00 24.59 N ATOM 819 CA GLN A 103 6.467 26.621 8.341 1.00 25.54 C ATOM 820 C GLN A 103 7.202 27.438 9.398 1.00 24.24 C ATOM 821 O GLN A 103 8.425 27.299 9.567 1.00 23.28 O ATOM 822 CB GLN A 103 6.237 27.462 7.086 1.00 25.44 C ATOM 823 CG GLN A 103 7.521 27.783 6.303 1.00 28.91 C ATOM 824 CD GLN A 103 7.284 28.767 5.143 1.00 28.28 C ATOM 825 OE1 GLN A 103 6.294 28.658 4.403 1.00 35.26 O ATOM 826 NE2 GLN A 103 8.177 29.746 5.002 1.00 30.79 N ATOM 827 N GLY A 104 6.449 28.287 10.101 1.00 23.96 N ATOM 828 CA GLY A 104 6.991 29.151 11.129 1.00 23.52 C ATOM 829 C GLY A 104 7.702 28.371 12.219 1.00 23.77 C ATOM 830 O GLY A 104 8.736 28.799 12.727 1.00 23.68 O ATOM 831 N LEU A 105 7.132 27.224 12.569 1.00 23.89 N ATOM 832 CA LEU A 105 7.653 26.348 13.615 1.00 24.64 C ATOM 833 C LEU A 105 8.950 25.655 13.190 1.00 24.71 C ATOM 834 O LEU A 105 9.843 25.464 14.003 1.00 24.52 O ATOM 835 CB LEU A 105 6.591 25.317 14.013 1.00 23.59 C ATOM 836 CG LEU A 105 5.732 25.477 15.298 1.00 25.35 C ATOM 837 CD1 LEU A 105 5.867 26.804 16.023 1.00 22.90 C ATOM 838 CD2 LEU A 105 4.276 25.131 15.072 1.00 23.94 C ATOM 839 N LYS A 106 9.039 25.290 11.918 1.00 25.34 N ATOM 840 CA LYS A 106 10.298 24.762 11.356 1.00 26.69 C ATOM 841 C LYS A 106 11.394 25.832 11.333 1.00 27.11 C ATOM 842 O LYS A 106 12.562 25.548 11.631 1.00 27.51 O ATOM 843 CB LYS A 106 10.062 24.191 9.960 1.00 26.33 C ATOM 844 CG LYS A 106 9.288 22.895 9.974 1.00 27.03 C ATOM 845 CD LYS A 106 9.213 22.248 8.608 1.00 29.50 C ATOM 846 CE LYS A 106 8.285 22.999 7.687 1.00 32.11 C ATOM 847 NZ LYS A 106 8.324 22.400 6.322 1.00 33.49 N ATOM 848 N GLU A 107 11.004 27.062 11.028 1.00 27.65 N ATOM 849 CA GLU A 107 11.953 28.180 10.975 1.00 29.09 C ATOM 850 C GLU A 107 12.524 28.528 12.344 1.00 29.43 C ATOM 851 O GLU A 107 13.593 29.124 12.437 1.00 29.48 O ATOM 852 CB GLU A 107 11.343 29.391 10.269 1.00 29.33 C ATOM 853 CG GLU A 107 11.077 29.101 8.795 1.00 30.73 C ATOM 854 CD GLU A 107 10.127 30.088 8.140 1.00 34.57 C ATOM 855 OE1 GLU A 107 9.428 30.843 8.857 1.00 37.48 O ATOM 856 OE2 GLU A 107 10.068 30.093 6.899 1.00 36.19 O ATOM 857 N ARG A 108 11.833 28.100 13.400 1.00 30.05 N ATOM 858 CA ARG A 108 12.332 28.221 14.773 1.00 30.91 C ATOM 859 C ARG A 108 13.197 27.052 15.228 1.00 30.11 C ATOM 860 O ARG A 108 13.663 27.036 16.356 1.00 30.39 O ATOM 861 CB ARG A 108 11.175 28.417 15.755 1.00 31.44 C ATOM 862 CG ARG A 108 10.798 29.866 15.910 1.00 34.53 C ATOM 863 CD ARG A 108 9.677 29.984 16.883 1.00 39.02 C ATOM 864 NE ARG A 108 9.053 31.298 16.811 1.00 42.34 N ATOM 865 CZ ARG A 108 9.026 32.178 17.803 1.00 42.74 C ATOM 866 NH1 ARG A 108 9.601 31.906 18.967 1.00 42.57 N ATOM 867 NH2 ARG A 108 8.404 33.333 17.625 1.00 45.86 N ATOM 868 N GLY A 109 13.395 26.064 14.360 1.00 30.47 N ATOM 869 CA GLY A 109 14.299 24.949 14.660 1.00 29.43 C ATOM 870 C GLY A 109 13.687 23.713 15.285 1.00 29.42 C ATOM 871 O GLY A 109 14.419 22.826 15.758 1.00 29.19 O ATOM 872 N PHE A 110 12.351 23.627 15.282 1.00 28.55 N ATOM 873 CA PHE A 110 11.683 22.421 15.757 1.00 27.11 C ATOM 874 C PHE A 110 11.637 21.398 14.649 1.00 27.03 C ATOM 875 O PHE A 110 11.640 21.741 13.461 1.00 27.38 O ATOM 876 CB PHE A 110 10.244 22.707 16.241 1.00 26.78 C ATOM 877 CG PHE A 110 10.170 23.557 17.482 1.00 25.25 C ATOM 878 CD1 PHE A 110 10.405 22.996 18.745 1.00 25.27 C ATOM 879 CD2 PHE A 110 9.880 24.912 17.387 1.00 23.54 C ATOM 880 CE1 PHE A 110 10.344 23.782 19.904 1.00 25.45 C ATOM 881 CE2 PHE A 110 9.816 25.717 18.530 1.00 26.12 C ATOM 882 CZ PHE A 110 10.043 25.151 19.799 1.00 24.74 C ATOM 883 N ASN A 111 11.596 20.136 15.036 1.00 26.62 N ATOM 884 CA ASN A 111 11.149 19.105 14.114 1.00 26.48 C ATOM 885 C ASN A 111 9.620 19.130 14.153 1.00 26.27 C ATOM 886 O ASN A 111 9.027 19.027 15.230 1.00 26.54 O ATOM 887 CB ASN A 111 11.688 17.729 14.493 1.00 26.20 C ATOM 888 CG ASN A 111 11.422 16.678 13.422 1.00 27.86 C ATOM 889 OD1 ASN A 111 11.012 15.561 13.719 1.00 31.94 O ATOM 890 ND2 ASN A 111 11.667 17.033 12.168 1.00 30.40 N ATOM 891 N VAL A 112 9.002 19.325 12.995 1.00 25.61 N ATOM 892 CA VAL A 112 7.551 19.533 12.909 1.00 25.33 C ATOM 893 C VAL A 112 6.957 18.565 11.899 1.00 26.24 C ATOM 894 O VAL A 112 7.488 18.396 10.783 1.00 26.15 O ATOM 895 CB VAL A 112 7.156 20.998 12.520 1.00 25.14 C ATOM 896 CG1 VAL A 112 5.680 21.252 12.817 1.00 24.25 C ATOM 897 CG2 VAL A 112 8.000 22.027 13.258 1.00 23.28 C ATOM 898 N GLY A 113 5.874 17.907 12.309 1.00 25.77 N ATOM 899 CA GLY A 113 5.091 17.079 11.414 1.00 26.26 C ATOM 900 C GLY A 113 3.716 17.694 11.261 1.00 26.37 C ATOM 901 O GLY A 113 3.363 18.620 11.994 1.00 25.97 O ATOM 902 N LYS A 114 2.956 17.206 10.291 1.00 26.89 N ATOM 903 CA LYS A 114 1.572 17.648 10.095 1.00 27.84 C ATOM 904 C LYS A 114 0.662 16.543 9.556 1.00 28.08 C ATOM 905 O LYS A 114 1.138 15.562 8.980 1.00 28.02 O ATOM 906 CB LYS A 114 1.512 18.859 9.159 1.00 27.59 C ATOM 907 CG LYS A 114 2.112 18.613 7.789 1.00 29.91 C ATOM 908 CD LYS A 114 1.861 19.787 6.876 1.00 31.07 C ATOM 909 CE LYS A 114 1.141 19.334 5.622 1.00 33.88 C ATOM 910 NZ LYS A 114 0.555 20.487 4.875 1.00 32.65 N ATOM 911 N ALA A 115 -0.648 16.719 9.750 1.00 28.28 N ATOM 912 CA ALA A 115 -1.650 15.906 9.080 1.00 28.60 C ATOM 913 C ALA A 115 -2.322 16.796 8.047 1.00 29.05 C ATOM 914 O ALA A 115 -2.458 17.999 8.269 1.00 29.62 O ATOM 915 CB ALA A 115 -2.667 15.361 10.072 1.00 28.57 C ATOM 916 N PRO A 116 -2.732 16.219 6.902 1.00 29.31 N ATOM 917 CA PRO A 116 -3.391 17.019 5.877 1.00 29.50 C ATOM 918 C PRO A 116 -4.792 17.485 6.279 1.00 29.69 C ATOM 919 O PRO A 116 -5.467 16.815 7.059 1.00 29.82 O ATOM 920 CB PRO A 116 -3.461 16.062 4.679 1.00 29.61 C ATOM 921 CG PRO A 116 -3.415 14.730 5.257 1.00 29.26 C ATOM 922 CD PRO A 116 -2.596 14.807 6.496 1.00 29.19 C ATOM 923 N PHE A 117 -5.193 18.634 5.742 1.00 29.44 N ATOM 924 CA PHE A 117 -6.483 19.250 5.991 1.00 29.64 C ATOM 925 C PHE A 117 -7.561 18.635 5.095 1.00 29.79 C ATOM 926 O PHE A 117 -7.313 18.337 3.918 1.00 28.97 O ATOM 927 CB PHE A 117 -6.368 20.740 5.692 1.00 29.97 C ATOM 928 CG PHE A 117 -7.646 21.511 5.888 1.00 30.88 C ATOM 929 CD1 PHE A 117 -7.999 21.999 7.149 1.00 31.13 C ATOM 930 CD2 PHE A 117 -8.492 21.769 4.810 1.00 32.33 C ATOM 931 CE1 PHE A 117 -9.180 22.733 7.330 1.00 31.90 C ATOM 932 CE2 PHE A 117 -9.677 22.505 4.986 1.00 32.23 C ATOM 933 CZ PHE A 117 -10.018 22.991 6.246 1.00 29.97 C ATOM 934 N GLY A 118 -8.753 18.448 5.655 1.00 29.42 N ATOM 935 CA GLY A 118 -9.904 18.044 4.858 1.00 29.83 C ATOM 936 C GLY A 118 -10.167 16.563 4.668 1.00 29.79 C ATOM 937 O GLY A 118 -11.027 16.201 3.876 1.00 30.21 O ATOM 938 N TYR A 119 -9.434 15.703 5.373 1.00 30.38 N ATOM 939 CA TYR A 119 -9.712 14.268 5.337 1.00 31.10 C ATOM 940 C TYR A 119 -10.161 13.800 6.708 1.00 31.27 C ATOM 941 O TYR A 119 -9.811 14.406 7.731 1.00 30.68 O ATOM 942 CB TYR A 119 -8.473 13.451 4.943 1.00 31.98 C ATOM 943 CG TYR A 119 -7.864 13.862 3.637 1.00 33.37 C ATOM 944 CD1 TYR A 119 -6.877 14.839 3.591 1.00 33.85 C ATOM 945 CD2 TYR A 119 -8.296 13.290 2.437 1.00 35.09 C ATOM 946 CE1 TYR A 119 -6.327 15.238 2.378 1.00 36.32 C ATOM 947 CE2 TYR A 119 -7.755 13.678 1.228 1.00 36.26 C ATOM 948 CZ TYR A 119 -6.772 14.648 1.206 1.00 34.75 C ATOM 949 OH TYR A 119 -6.237 15.035 0.015 1.00 35.64 O ATOM 950 N TYR A 120 -10.917 12.707 6.729 1.00 30.80 N ATOM 951 CA TYR A 120 -11.091 11.980 7.964 1.00 30.82 C ATOM 952 C TYR A 120 -9.811 11.195 8.172 1.00 30.76 C ATOM 953 O TYR A 120 -9.193 10.723 7.214 1.00 31.06 O ATOM 954 CB TYR A 120 -12.323 11.065 7.925 1.00 30.75 C ATOM 955 CG TYR A 120 -13.601 11.793 7.625 1.00 30.40 C ATOM 956 CD1 TYR A 120 -14.148 12.681 8.552 1.00 31.45 C ATOM 957 CD2 TYR A 120 -14.270 11.597 6.420 1.00 30.57 C ATOM 958 CE1 TYR A 120 -15.319 13.354 8.289 1.00 31.88 C ATOM 959 CE2 TYR A 120 -15.446 12.281 6.133 1.00 31.57 C ATOM 960 CZ TYR A 120 -15.970 13.156 7.082 1.00 31.57 C ATOM 961 OH TYR A 120 -17.136 13.848 6.832 1.00 31.68 O ATOM 962 N LYS A 121 -9.412 11.076 9.429 1.00 30.71 N ATOM 963 CA LYS A 121 -8.179 10.433 9.797 1.00 30.48 C ATOM 964 C LYS A 121 -8.384 9.533 11.000 1.00 30.79 C ATOM 965 O LYS A 121 -8.943 9.967 12.014 1.00 30.00 O ATOM 966 CB LYS A 121 -7.147 11.503 10.174 1.00 30.88 C ATOM 967 CG LYS A 121 -6.131 11.859 9.114 1.00 31.15 C ATOM 968 CD LYS A 121 -6.282 13.256 8.574 1.00 28.83 C ATOM 969 CE LYS A 121 -6.471 14.324 9.649 1.00 26.22 C ATOM 970 NZ LYS A 121 -7.324 15.378 9.042 1.00 24.57 N ATOM 971 N ALA A 122 -7.920 8.284 10.906 1.00 30.49 N ATOM 972 CA ALA A 122 -7.657 7.508 12.119 1.00 30.51 C ATOM 973 C ALA A 122 -6.463 8.166 12.775 1.00 30.45 C ATOM 974 O ALA A 122 -5.586 8.666 12.070 1.00 30.58 O ATOM 975 CB ALA A 122 -7.363 6.034 11.801 1.00 30.59 C ATOM 976 N PHE A 123 -6.447 8.221 14.103 1.00 30.19 N ATOM 977 CA PHE A 123 -5.279 8.706 14.810 1.00 30.59 C ATOM 978 C PHE A 123 -5.198 8.100 16.182 1.00 31.45 C ATOM 979 O PHE A 123 -6.222 7.799 16.795 1.00 31.95 O ATOM 980 CB PHE A 123 -5.210 10.255 14.846 1.00 30.93 C ATOM 981 CG PHE A 123 -6.175 10.918 15.804 1.00 29.78 C ATOM 982 CD1 PHE A 123 -7.474 11.213 15.409 1.00 29.94 C ATOM 983 CD2 PHE A 123 -5.762 11.300 17.083 1.00 30.47 C ATOM 984 CE1 PHE A 123 -8.374 11.854 16.285 1.00 29.72 C ATOM 985 CE2 PHE A 123 -6.655 11.944 17.973 1.00 29.79 C ATOM 986 CZ PHE A 123 -7.961 12.214 17.563 1.00 30.04 C ATOM 987 N LYS A 124 -3.974 7.898 16.648 1.00 31.94 N ATOM 988 CA LYS A 124 -3.715 7.394 17.981 1.00 33.07 C ATOM 989 C LYS A 124 -2.865 8.444 18.668 1.00 32.59 C ATOM 990 O LYS A 124 -1.986 9.041 18.052 1.00 33.08 O ATOM 991 CB LYS A 124 -2.957 6.051 17.932 1.00 32.76 C ATOM 992 CG LYS A 124 -3.734 4.922 17.286 1.00 34.54 C ATOM 993 CD LYS A 124 -2.853 3.699 16.948 1.00 34.65 C ATOM 994 CE LYS A 124 -3.630 2.697 16.073 1.00 37.46 C ATOM 995 NZ LYS A 124 -2.961 1.355 15.935 1.00 38.99 N ATOM 996 N ILE A 125 -3.115 8.655 19.947 1.00 32.40 N ATOM 997 CA ILE A 125 -2.331 9.586 20.742 1.00 32.82 C ATOM 998 C ILE A 125 -2.251 9.062 22.167 1.00 33.13 C ATOM 999 O ILE A 125 -3.172 8.402 22.633 1.00 33.61 O ATOM 1000 CB ILE A 125 -2.943 11.033 20.694 1.00 32.93 C ATOM 1001 CG1 ILE A 125 -2.053 12.060 21.415 1.00 32.55 C ATOM 1002 CG2 ILE A 125 -4.381 11.040 21.224 1.00 32.51 C ATOM 1003 CD1 ILE A 125 -2.562 13.514 21.281 1.00 32.50 C ATOM 1004 N SER A 126 -1.140 9.327 22.841 1.00 33.99 N ATOM 1005 CA SER A 126 -1.003 9.030 24.257 1.00 34.53 C ATOM 1006 C SER A 126 -0.563 10.291 24.978 1.00 35.27 C ATOM 1007 O SER A 126 0.554 10.750 24.778 1.00 35.65 O ATOM 1008 CB SER A 126 0.024 7.910 24.478 1.00 34.63 C ATOM 1009 OG SER A 126 0.456 7.859 25.836 1.00 33.66 O ATOM 1010 N CYS A 127 -1.433 10.845 25.821 1.00 36.16 N ATOM 1011 CA CYS A 127 -1.141 12.096 26.508 1.00 36.33 C ATOM 1012 C CYS A 127 -0.464 11.793 27.813 1.00 36.41 C ATOM 1013 O CYS A 127 -1.002 11.042 28.622 1.00 36.36 O ATOM 1014 CB CYS A 127 -2.425 12.906 26.766 1.00 36.31 C ATOM 1015 SG CYS A 127 -2.225 14.336 27.876 1.00 38.75 S ATOM 1016 N LYS A 128 0.717 12.373 28.016 1.00 36.30 N ATOM 1017 CA LYS A 128 1.432 12.246 29.285 1.00 36.59 C ATOM 1018 C LYS A 128 0.532 12.859 30.343 1.00 37.05 C ATOM 1019 O LYS A 128 -0.303 13.695 30.028 1.00 37.26 O ATOM 1020 CB LYS A 128 2.775 12.983 29.232 1.00 36.47 C ATOM 1021 CG LYS A 128 3.644 12.644 28.030 1.00 35.90 C ATOM 1022 CD LYS A 128 4.941 13.444 28.086 1.00 36.27 C ATOM 1023 CE LYS A 128 5.832 13.142 26.894 1.00 36.26 C ATOM 1024 NZ LYS A 128 6.494 11.820 27.065 1.00 36.05 N ATOM 1025 N GLY A 129 0.673 12.466 31.597 1.00 37.26 N ATOM 1026 CA GLY A 129 -0.304 12.935 32.586 1.00 37.53 C ATOM 1027 C GLY A 129 -0.129 14.328 33.167 1.00 37.39 C ATOM 1028 O GLY A 129 -0.940 14.757 33.972 1.00 37.05 O ATOM 1029 N HIS A 130 0.919 15.039 32.754 1.00 37.51 N ATOM 1030 CA HIS A 130 1.453 16.159 33.550 1.00 37.50 C ATOM 1031 C HIS A 130 0.577 17.403 33.535 1.00 36.65 C ATOM 1032 O HIS A 130 -0.255 17.543 32.642 1.00 36.88 O ATOM 1033 CB HIS A 130 2.881 16.485 33.104 1.00 37.73 C ATOM 1034 CG HIS A 130 3.700 15.269 32.827 1.00 39.63 C ATOM 1035 ND1 HIS A 130 3.766 14.210 33.706 1.00 41.14 N ATOM 1036 CD2 HIS A 130 4.471 14.931 31.769 1.00 40.49 C ATOM 1037 CE1 HIS A 130 4.544 13.270 33.200 1.00 43.32 C ATOM 1038 NE2 HIS A 130 4.987 13.685 32.026 1.00 43.21 N ATOM 1039 N PRO A 131 0.754 18.303 34.530 1.00 36.14 N ATOM 1040 CA PRO A 131 -0.052 19.517 34.576 1.00 35.65 C ATOM 1041 C PRO A 131 0.012 20.380 33.299 1.00 35.20 C ATOM 1042 O PRO A 131 -1.008 20.949 32.909 1.00 35.19 O ATOM 1043 CB PRO A 131 0.513 20.273 35.784 1.00 35.42 C ATOM 1044 CG PRO A 131 1.133 19.216 36.639 1.00 36.00 C ATOM 1045 CD PRO A 131 1.692 18.235 35.671 1.00 36.18 C ATOM 1046 N LEU A 132 1.173 20.455 32.651 1.00 34.05 N ATOM 1047 CA LEU A 132 1.318 21.277 31.429 1.00 33.73 C ATOM 1048 C LEU A 132 1.135 20.488 30.127 1.00 32.93 C ATOM 1049 O LEU A 132 1.372 21.021 29.043 1.00 32.89 O ATOM 1050 CB LEU A 132 2.673 22.003 31.415 1.00 33.92 C ATOM 1051 CG LEU A 132 3.033 22.952 32.563 1.00 34.65 C ATOM 1052 CD1 LEU A 132 4.471 23.458 32.406 1.00 37.01 C ATOM 1053 CD2 LEU A 132 2.054 24.118 32.650 1.00 36.00 C ATOM 1054 N ALA A 133 0.698 19.232 30.244 1.00 31.89 N ATOM 1055 CA ALA A 133 0.642 18.294 29.121 1.00 31.67 C ATOM 1056 C ALA A 133 -0.661 18.316 28.326 1.00 31.15 C ATOM 1057 O ALA A 133 -0.775 17.599 27.344 1.00 30.92 O ATOM 1058 CB ALA A 133 0.944 16.863 29.596 1.00 31.31 C ATOM 1059 N GLU A 134 -1.631 19.124 28.753 1.00 30.96 N ATOM 1060 CA GLU A 134 -2.936 19.206 28.074 1.00 31.08 C ATOM 1061 C GLU A 134 -3.540 20.603 28.282 1.00 30.61 C ATOM 1062 O GLU A 134 -4.195 20.869 29.303 1.00 30.17 O ATOM 1063 CB GLU A 134 -3.870 18.088 28.567 1.00 30.95 C ATOM 1064 CG GLU A 134 -5.227 18.020 27.915 1.00 32.98 C ATOM 1065 CD GLU A 134 -6.193 17.185 28.730 1.00 37.43 C ATOM 1066 OE1 GLU A 134 -7.011 17.776 29.472 1.00 37.52 O ATOM 1067 OE2 GLU A 134 -6.112 15.937 28.654 1.00 39.23 O ATOM 1068 N LEU A 135 -3.289 21.485 27.309 1.00 29.89 N ATOM 1069 CA LEU A 135 -3.543 22.926 27.450 1.00 29.41 C ATOM 1070 C LEU A 135 -4.307 23.487 26.256 1.00 29.28 C ATOM 1071 O LEU A 135 -4.233 22.935 25.144 1.00 29.15 O ATOM 1072 CB LEU A 135 -2.220 23.699 27.605 1.00 29.51 C ATOM 1073 CG LEU A 135 -1.253 23.283 28.724 1.00 29.99 C ATOM 1074 CD1 LEU A 135 0.117 23.934 28.531 1.00 30.65 C ATOM 1075 CD2 LEU A 135 -1.835 23.626 30.116 1.00 29.02 C ATOM 1076 N SER A 136 -5.029 24.582 26.478 1.00 27.85 N ATOM 1077 CA SER A 136 -5.755 25.224 25.390 1.00 27.70 C ATOM 1078 C SER A 136 -5.479 26.725 25.342 1.00 27.18 C ATOM 1079 O SER A 136 -5.277 27.378 26.377 1.00 27.20 O ATOM 1080 CB SER A 136 -7.264 24.903 25.423 1.00 27.58 C ATOM 1081 OG SER A 136 -7.936 25.556 26.478 1.00 29.29 O ATOM 1082 N ARG A 137 -5.442 27.260 24.128 1.00 26.65 N ATOM 1083 CA ARG A 137 -5.075 28.659 23.904 1.00 27.03 C ATOM 1084 C ARG A 137 -6.017 29.261 22.863 1.00 27.10 C ATOM 1085 O ARG A 137 -6.371 28.601 21.891 1.00 25.67 O ATOM 1086 CB ARG A 137 -3.622 28.765 23.406 1.00 26.45 C ATOM 1087 CG ARG A 137 -2.542 28.127 24.287 1.00 27.70 C ATOM 1088 CD ARG A 137 -2.193 29.055 25.430 1.00 29.66 C ATOM 1089 NE ARG A 137 -1.105 28.593 26.287 1.00 29.90 N ATOM 1090 CZ ARG A 137 -1.261 28.016 27.479 1.00 32.04 C ATOM 1091 NH1 ARG A 137 -2.477 27.781 27.985 1.00 29.98 N ATOM 1092 NH2 ARG A 137 -0.186 27.681 28.175 1.00 31.70 N ATOM 1093 N THR A 138 -6.430 30.502 23.104 1.00 27.41 N ATOM 1094 CA THR A 138 -7.223 31.288 22.166 1.00 28.70 C ATOM 1095 C THR A 138 -6.325 32.382 21.623 1.00 29.48 C ATOM 1096 O THR A 138 -5.762 33.168 22.388 1.00 29.31 O ATOM 1097 CB THR A 138 -8.433 31.957 22.844 1.00 28.19 C ATOM 1098 OG1 THR A 138 -9.327 30.950 23.320 1.00 30.08 O ATOM 1099 CG2 THR A 138 -9.174 32.862 21.873 1.00 28.08 C ATOM 1100 N ILE A 139 -6.192 32.420 20.300 1.00 29.96 N ATOM 1101 CA ILE A 139 -5.307 33.370 19.642 1.00 30.78 C ATOM 1102 C ILE A 139 -6.079 34.040 18.535 1.00 31.23 C ATOM 1103 O ILE A 139 -6.529 33.384 17.607 1.00 30.22 O ATOM 1104 CB ILE A 139 -4.043 32.675 19.073 1.00 31.32 C ATOM 1105 CG1 ILE A 139 -3.291 31.926 20.182 1.00 32.25 C ATOM 1106 CG2 ILE A 139 -3.113 33.711 18.435 1.00 31.47 C ATOM 1107 CD1 ILE A 139 -2.724 30.611 19.747 1.00 33.16 C ATOM 1108 N VAL A 140 -6.232 35.356 18.637 1.00 32.76 N ATOM 1109 CA VAL A 140 -7.009 36.125 17.654 1.00 34.22 C ATOM 1110 C VAL A 140 -6.286 37.401 17.238 1.00 35.56 C ATOM 1111 O VAL A 140 -5.485 37.941 18.008 1.00 35.12 O ATOM 1112 CB VAL A 140 -8.430 36.470 18.174 1.00 34.33 C ATOM 1113 CG1 VAL A 140 -9.252 35.216 18.337 1.00 33.75 C ATOM 1114 CG2 VAL A 140 -8.368 37.245 19.478 1.00 34.28 C ATOM 1115 N PRO A 141 -6.561 37.888 16.017 1.00 37.15 N ATOM 1116 CA PRO A 141 -5.884 39.119 15.616 1.00 38.61 C ATOM 1117 C PRO A 141 -6.421 40.308 16.399 1.00 40.19 C ATOM 1118 O PRO A 141 -7.584 40.305 16.798 1.00 40.44 O ATOM 1119 CB PRO A 141 -6.213 39.245 14.123 1.00 38.52 C ATOM 1120 CG PRO A 141 -7.440 38.445 13.915 1.00 38.32 C ATOM 1121 CD PRO A 141 -7.464 37.366 14.970 1.00 37.06 C ATOM 1122 N GLU A 142 -5.567 41.290 16.670 1.00 42.34 N ATOM 1123 CA GLU A 142 -6.053 42.586 17.142 1.00 44.68 C ATOM 1124 C GLU A 142 -6.854 43.213 15.993 1.00 45.77 C ATOM 1125 O GLU A 142 -6.443 43.158 14.815 1.00 45.74 O ATOM 1126 CB GLU A 142 -4.902 43.494 17.565 1.00 44.66 C ATOM 1127 CG GLU A 142 -4.315 43.136 18.910 1.00 46.79 C ATOM 1128 CD GLU A 142 -2.809 43.329 18.946 1.00 49.69 C ATOM 1129 OE1 GLU A 142 -2.352 44.476 18.709 1.00 50.09 O ATOM 1130 OE2 GLU A 142 -2.088 42.327 19.203 1.00 50.80 O ATOM 1131 N GLU A 143 -8.003 43.782 16.340 1.00 47.21 N ATOM 1132 CA GLU A 143 -8.955 44.277 15.341 1.00 48.60 C ATOM 1133 C GLU A 143 -8.582 45.671 14.797 1.00 49.21 C ATOM 1134 O GLU A 143 -9.170 46.146 13.813 1.00 49.75 O ATOM 1135 CB GLU A 143 -10.387 44.248 15.901 1.00 48.60 C ATOM 1136 CG GLU A 143 -10.867 42.871 16.385 1.00 49.82 C ATOM 1137 CD GLU A 143 -10.590 42.616 17.871 1.00 53.44 C ATOM 1138 OE1 GLU A 143 -9.457 42.905 18.334 1.00 53.92 O ATOM 1139 OE2 GLU A 143 -11.509 42.125 18.580 1.00 52.61 O ATOM 1140 OXT GLU A 143 -7.675 46.357 15.302 1.00 49.56 O TER 1141 GLU A 143 HETATM 1142 O HOH A 144 1.897 34.976 6.472 1.00 23.60 O HETATM 1143 O HOH A 145 -17.812 31.029 10.550 1.00 22.33 O HETATM 1144 O HOH A 146 4.287 40.823 6.027 1.00 24.29 O HETATM 1145 O HOH A 147 -2.635 19.642 31.440 1.00 32.49 O HETATM 1146 O HOH A 148 -14.332 33.680 14.707 1.00 27.97 O HETATM 1147 O HOH A 149 1.710 33.199 26.528 1.00 29.63 O HETATM 1148 O HOH A 150 10.520 18.762 10.269 1.00 31.44 O HETATM 1149 O HOH A 151 -13.411 37.631 9.789 1.00 33.92 O HETATM 1150 O HOH A 152 6.345 24.751 5.274 1.00 39.27 O HETATM 1151 O HOH A 153 -17.025 34.732 13.743 1.00 28.57 O HETATM 1152 O HOH A 154 -3.284 32.883 24.435 1.00 41.62 O HETATM 1153 O HOH A 155 2.659 20.048 2.929 1.00 33.71 O HETATM 1154 O HOH A 156 -2.161 38.347 6.671 1.00 38.36 O HETATM 1155 O HOH A 157 -2.273 35.136 3.702 1.00 28.79 O HETATM 1156 O HOH A 158 0.913 20.839 26.387 1.00 31.16 O HETATM 1157 O HOH A 159 7.179 32.581 9.982 1.00 40.11 O HETATM 1158 O HOH A 160 -5.498 31.813 25.640 1.00 41.65 O HETATM 1159 O HOH A 161 -12.278 33.252 19.082 1.00 31.12 O HETATM 1160 O HOH A 162 3.260 16.239 -3.232 1.00 39.75 O HETATM 1161 O HOH A 163 -18.536 33.067 12.311 1.00 29.30 O HETATM 1162 O HOH A 164 -5.424 25.322 29.137 1.00 34.50 O HETATM 1163 O HOH A 165 3.765 19.693 33.831 1.00 34.53 O HETATM 1164 O HOH A 166 -8.797 13.365 12.847 1.00 38.04 O HETATM 1165 O HOH A 167 -9.874 20.451 10.084 1.00 34.11 O HETATM 1166 O HOH A 168 5.004 31.230 8.306 1.00 31.31 O HETATM 1167 O HOH A 169 0.071 29.985 3.297 1.00 31.69 O HETATM 1168 O HOH A 170 5.487 19.164 4.529 1.00 45.87 O HETATM 1169 O HOH A 171 -17.078 22.783 15.231 1.00 39.63 O HETATM 1170 O HOH A 172 3.298 33.870 8.402 1.00 31.02 O HETATM 1171 O HOH A 173 10.769 15.951 22.197 1.00 31.53 O HETATM 1172 O HOH A 174 1.525 29.450 25.228 1.00 34.25 O HETATM 1173 O HOH A 175 -5.785 32.953 2.588 1.00 36.23 O HETATM 1174 O HOH A 176 0.662 22.983 5.599 1.00 37.29 O HETATM 1175 O HOH A 177 3.558 7.569 4.856 1.00 50.51 O HETATM 1176 O HOH A 178 6.110 18.949 31.802 1.00 49.91 O HETATM 1177 O HOH A 179 0.000 1.757 15.663 1.00 45.76 O HETATM 1178 O HOH A 180 -12.602 25.861 22.545 1.00 37.88 O HETATM 1179 O HOH A 181 -2.623 31.110 28.995 1.00 31.78 O HETATM 1180 O HOH A 182 -12.333 27.891 0.866 1.00 39.24 O HETATM 1181 O HOH A 183 -20.200 29.218 18.551 1.00 46.92 O HETATM 1182 O HOH A 184 4.293 21.252 35.842 1.00 36.29 O HETATM 1183 O HOH A 185 0.063 22.606 8.131 1.00 27.77 O HETATM 1184 O HOH A 186 -8.610 23.326 11.235 1.00 36.59 O HETATM 1185 O HOH A 187 -5.204 28.518 0.923 1.00 37.45 O HETATM 1186 O HOH A 188 -12.541 25.550 7.841 1.00 43.23 O HETATM 1187 O HOH A 189 2.612 14.071 36.598 1.00 46.96 O HETATM 1188 O HOH A 190 4.832 15.787 8.462 1.00 34.71 O HETATM 1189 O HOH A 191 2.976 21.072 -0.554 1.00 46.44 O HETATM 1190 O HOH A 192 -17.703 15.522 -0.930 1.00 60.77 O HETATM 1191 O HOH A 193 -17.198 28.842 19.210 1.00 42.86 O HETATM 1192 O HOH A 194 -14.041 40.300 16.018 1.00 46.59 O HETATM 1193 O HOH A 195 -10.630 24.830 11.072 1.00 41.63 O HETATM 1194 O HOH A 196 -2.583 17.054 31.406 1.00 35.04 O HETATM 1195 O HOH A 197 -5.424 29.982 27.779 1.00 43.07 O HETATM 1196 O HOH A 198 9.098 31.449 12.796 1.00 38.13 O HETATM 1197 O HOH A 199 9.852 11.572 16.208 1.00 45.96 O HETATM 1198 O HOH A 200 -1.916 24.042 5.115 1.00 33.51 O HETATM 1199 O HOH A 201 1.435 5.512 10.817 1.00 52.88 O HETATM 1200 O HOH A 202 0.995 15.229 6.124 1.00 42.17 O HETATM 1201 O HOH A 203 7.182 12.846 30.762 1.00 44.56 O HETATM 1202 O HOH A 204 15.041 30.323 15.931 1.00 44.67 O HETATM 1203 O HOH A 205 8.028 35.104 10.087 1.00 42.10 O HETATM 1204 O HOH A 206 0.283 8.939 -4.130 1.00 60.91 O HETATM 1205 O HOH A 207 8.945 17.797 8.504 1.00 32.49 O HETATM 1206 O HOH A 208 3.935 2.990 6.047 1.00 45.48 O HETATM 1207 O HOH A 209 4.744 30.759 5.218 1.00 35.34 O HETATM 1208 O HOH A 210 -4.338 40.476 6.313 1.00 42.48 O HETATM 1209 O HOH A 211 -9.171 18.601 8.427 1.00 38.63 O HETATM 1210 O HOH A 212 5.994 34.505 15.430 1.00 38.51 O HETATM 1211 O HOH A 213 -11.234 23.760 0.271 1.00 44.12 O HETATM 1212 O HOH A 214 -4.866 36.615 20.731 1.00 36.26 O HETATM 1213 O HOH A 215 -11.611 16.561 8.542 1.00 44.00 O HETATM 1214 O HOH A 216 2.807 22.874 2.035 1.00 56.87 O HETATM 1215 O HOH A 217 -16.691 33.238 3.987 1.00 36.90 O HETATM 1216 O HOH A 218 -4.568 6.787 3.007 1.00 44.70 O HETATM 1217 O HOH A 219 -0.406 15.388 36.636 1.00 38.89 O HETATM 1218 O HOH A 220 -4.886 -0.652 15.660 1.00 55.41 O HETATM 1219 O HOH A 221 9.877 3.551 19.098 1.00 51.65 O HETATM 1220 O HOH A 222 -8.110 9.915 0.767 1.00 43.07 O HETATM 1221 O HOH A 223 -13.669 5.622 0.148 1.00 45.06 O HETATM 1222 O HOH A 224 -11.549 18.316 11.958 1.00 36.97 O HETATM 1223 O HOH A 225 -2.160 1.647 0.338 1.00 53.96 O HETATM 1224 O HOH A 226 -4.727 5.240 -1.045 1.00 44.73 O HETATM 1225 O HOH A 227 -12.394 13.796 -2.328 1.00 52.22 O HETATM 1226 O HOH A 228 -1.900 44.659 13.931 1.00 59.03 O HETATM 1227 O HOH A 229 -6.036 39.807 4.618 1.00 47.16 O HETATM 1228 O HOH A 230 9.360 27.418 30.533 1.00 48.26 O HETATM 1229 O HOH A 231 3.180 13.395 8.580 1.00 42.93 O HETATM 1230 O HOH A 232 0.977 7.115 32.393 1.00 53.81 O HETATM 1231 O HOH A 233 5.667 40.853 9.684 1.00 45.99 O HETATM 1232 O HOH A 234 -1.256 3.276 -3.165 1.00 45.12 O HETATM 1233 O HOH A 235 -11.257 12.467 11.355 1.00 35.56 O HETATM 1234 O HOH A 236 -1.115 5.310 10.341 1.00 49.93 O HETATM 1235 O HOH A 237 5.623 26.679 33.131 1.00 46.13 O HETATM 1236 O HOH A 238 5.124 4.477 22.428 1.00 45.73 O HETATM 1237 O HOH A 239 -2.904 27.051 30.785 1.00 49.87 O HETATM 1238 O HOH A 240 -1.865 20.995 8.411 1.00 39.27 O HETATM 1239 O HOH A 241 -16.891 37.363 12.982 1.00 42.01 O HETATM 1240 O HOH A 242 7.647 14.122 10.805 1.00 54.54 O HETATM 1241 O HOH A 243 -1.239 32.186 26.839 1.00 42.72 O HETATM 1242 O HOH A 244 -0.299 27.562 1.794 1.00 60.30 O HETATM 1243 O HOH A 245 -8.367 16.810 10.732 1.00 42.95 O HETATM 1244 O HOH A 246 -1.970 4.475 -0.466 1.00 61.43 O HETATM 1245 O HOH A 247 5.564 19.690 37.628 1.00 53.69 O HETATM 1246 O HOH A 248 13.929 28.808 18.347 1.00 47.99 O HETATM 1247 O HOH A 249 -2.763 0.696 18.912 1.00 59.09 O HETATM 1248 O HOH A 250 7.084 36.255 18.057 1.00 55.43 O HETATM 1249 O HOH A 251 0.969 40.362 17.502 1.00 49.95 O HETATM 1250 O HOH A 252 19.050 20.148 22.926 1.00 48.02 O HETATM 1251 O HOH A 253 8.040 12.701 1.162 1.00 45.48 O HETATM 1252 O HOH A 254 7.532 7.468 22.812 1.00 59.31 O HETATM 1253 O HOH A 255 8.667 28.596 27.602 1.00 54.39 O HETATM 1254 O HOH A 256 -16.120 35.514 4.864 1.00 49.15 O HETATM 1255 O HOH A 257 1.437 35.018 20.989 1.00 50.92 O HETATM 1256 O HOH A 258 8.255 16.576 5.723 1.00 53.60 O HETATM 1257 O HOH A 259 8.918 14.636 29.643 1.00 61.40 O HETATM 1258 O HOH A 260 0.336 42.963 9.895 1.00 59.88 O HETATM 1259 O HOH A 261 8.805 15.490 25.111 1.00 39.41 O HETATM 1260 O HOH A 262 -18.291 18.305 3.788 1.00 45.63 O HETATM 1261 O HOH A 263 -12.239 18.650 7.160 1.00 53.62 O HETATM 1262 O HOH A 264 0.846 14.463 -4.820 1.00 50.14 O HETATM 1263 O HOH A 265 -12.566 9.358 -0.011 1.00 38.41 O HETATM 1264 O HOH A 266 8.874 32.717 26.791 1.00 56.15 O HETATM 1265 O HOH A 267 12.452 23.170 22.853 1.00 50.72 O HETATM 1266 O HOH A 268 13.570 15.502 16.893 1.00 42.04 O HETATM 1267 O HOH A 269 2.189 0.838 15.753 1.00 55.76 O HETATM 1268 O HOH A 270 -2.672 37.353 4.250 1.00 45.86 O HETATM 1269 O HOH A 271 -7.819 28.714 26.427 1.00 44.48 O HETATM 1270 O HOH A 272 4.391 17.194 29.916 1.00 43.40 O HETATM 1271 O HOH A 273 2.147 2.745 19.475 1.00 48.49 O HETATM 1272 O HOH A 274 -14.727 14.873 -2.616 1.00 54.12 O HETATM 1273 O HOH A 275 -4.283 42.903 7.049 1.00 54.51 O HETATM 1274 O HOH A 276 -1.081 35.367 22.134 1.00 42.72 O HETATM 1275 O HOH A 277 -18.119 35.193 16.186 1.00 47.67 O HETATM 1276 O HOH A 278 -14.832 28.293 21.510 1.00 65.18 O HETATM 1277 O HOH A 279 4.861 13.553 10.561 1.00 45.59 O HETATM 1278 O HOH A 280 8.365 17.564 30.466 1.00 43.88 O HETATM 1279 O HOH A 281 -12.181 20.606 8.957 1.00 45.62 O HETATM 1280 O HOH A 282 -6.377 35.942 3.354 1.00 49.87 O HETATM 1281 O HOH A 283 -18.404 13.036 4.622 1.00 44.96 O HETATM 1282 O HOH A 284 1.478 40.767 11.536 1.00 49.31 O HETATM 1283 O HOH A 285 7.135 8.278 26.690 1.00 43.24 O HETATM 1284 O HOH A 286 -8.757 2.563 12.832 1.00 54.90 O HETATM 1285 O HOH A 287 -14.494 33.688 17.353 1.00 45.59 O HETATM 1286 O HOH A 288 -8.172 19.462 -3.765 1.00 53.07 O HETATM 1287 O HOH A 289 12.239 12.160 18.775 1.00 53.64 O HETATM 1288 O HOH A 290 -17.331 19.777 0.652 1.00 46.17 O HETATM 1289 O HOH A 291 8.761 11.842 12.880 1.00 61.55 O HETATM 1290 O HOH A 292 -16.184 38.389 16.372 1.00 53.26 O HETATM 1291 O HOH A 293 -7.330 5.031 3.833 1.00 47.11 O HETATM 1292 O HOH A 294 5.598 14.512 1.162 1.00 60.71 O HETATM 1293 O HOH A 295 13.174 14.389 20.144 1.00 49.70 O HETATM 1294 O HOH A 296 -18.809 11.957 -5.813 1.00 48.14 O HETATM 1295 O HOH A 297 -3.456 0.742 8.220 1.00 58.32 O HETATM 1296 O HOH A 298 -8.462 36.542 5.032 1.00 34.45 O HETATM 1297 O HOH A 299 -2.852 46.109 11.481 1.00 54.64 O HETATM 1298 O HOH A 300 13.216 16.922 25.979 1.00 46.53 O HETATM 1299 O HOH A 301 -0.880 0.354 7.358 1.00 65.85 O HETATM 1300 O HOH A 302 -11.089 12.337 -7.101 1.00 51.27 O HETATM 1301 O HOH A 303 -6.877 14.093 -2.910 1.00 48.71 O HETATM 1302 O HOH A 304 -1.629 25.550 32.905 1.00 60.08 O HETATM 1303 O HOH A 305 -11.844 12.458 -4.530 1.00 56.05 O HETATM 1304 O HOH A 306 7.194 37.871 22.759 1.00 58.06 O HETATM 1305 O HOH A 307 5.078 13.517 4.586 1.00 48.35 O HETATM 1306 O HOH A 308 -14.381 10.813 -1.652 1.00 47.53 O HETATM 1307 O HOH A 309 -19.395 12.575 -2.550 1.00 47.62 O HETATM 1308 O HOH A 310 6.983 32.487 23.129 1.00 54.04 O HETATM 1309 O HOH A 311 -11.544 34.462 -3.784 1.00 50.12 O HETATM 1310 O HOH A 312 -3.566 12.457 24.659 1.00 41.18 O HETATM 1311 O HOH A 313 -3.271 22.073 6.097 1.00 33.26 O HETATM 1312 O HOH A 314 -2.935 5.283 22.168 0.50 31.88 O HETATM 1313 O HOH A 315 3.276 37.034 20.049 1.00 42.86 O HETATM 1314 O HOH A 316 -0.606 7.720 28.114 1.00 44.03 O HETATM 1315 O HOH A 317 -11.128 34.706 15.661 1.00 48.15 O HETATM 1316 O HOH A 318 -15.379 38.550 11.566 1.00 46.54 O HETATM 1317 O HOH A 319 -4.480 5.528 13.588 1.00 39.88 O MASTER 294 0 0 5 10 0 0 6 1316 1 0 11 END