Browse entries in the PDBbind-CN Database
HEADER TRANSFERASE/DNA 08-AUG-00 1FJX TITLE STRUCTURE OF TERNARY COMPLEX OF HHAI METHYLTRANSFERASE MUTANT (T250G) TITLE 2 IN COMPLEX WITH DNA AND ADOHCY COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA (5'-D(*TP*GP*AP*TP*AP*GP*CP*GP*CP*TP*AP*TP*C)-3'); COMPND 3 CHAIN: C, D; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: HHAI DNA METHYLTRANSFERASE; COMPND 7 CHAIN: A; COMPND 8 EC: 2.1.1.73; COMPND 9 ENGINEERED: YES; COMPND 10 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: CHEMICALLY SYNTHESIZED; SOURCE 4 MOL_ID: 2; SOURCE 5 ORGANISM_SCIENTIFIC: HAEMOPHILUS HAEMOLYTICUS; SOURCE 6 ORGANISM_TAXID: 726; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS ADOMET-DEPENDENT METHYLTRANSFERASE FOLD PROTEIN-DNA-COFACTOR COMPLEX, KEYWDS 2 TRANSFERASE-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR G.VILKAITIS,A.DONG,E.WEINHOLD,X.CHENG,S.KLIMASAUSKAS REVDAT 5 14-MAR-18 1FJX 1 SEQADV REVDAT 4 31-JAN-18 1FJX 1 REMARK REVDAT 3 24-FEB-09 1FJX 1 VERSN REVDAT 2 26-SEP-01 1FJX 3 ATOM CONECT REVDAT 1 15-DEC-00 1FJX 0 JRNL AUTH G.VILKAITIS,A.DONG,E.WEINHOLD,X.CHENG,S.KLIMASAUSKAS JRNL TITL FUNCTIONAL ROLES OF THE CONSERVED THREONINE 250 IN THE JRNL TITL 2 TARGET RECOGNITION DOMAIN OF HHAI DNA METHYLTRANSFERASE. JRNL REF J.BIOL.CHEM. V. 275 38722 2000 JRNL REFN ISSN 0021-9258 JRNL PMID 11102456 REMARK 2 REMARK 2 RESOLUTION. 2.26 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.26 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 82.9 REMARK 3 NUMBER OF REFLECTIONS : 24065 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 SET) : 0.207 REMARK 3 FREE R VALUE : 0.283 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 8.000 REMARK 3 FREE R VALUE TEST SET COUNT : 1896 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2599 REMARK 3 NUCLEIC ACID ATOMS : 526 REMARK 3 HETEROGEN ATOMS : 36 REMARK 3 SOLVENT ATOMS : 235 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : NULL REMARK 3 BOND ANGLES (DEGREES) : NULL REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL REMARK 3 IMPROPER ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : NULL REMARK 3 TOPOLOGY FILE 1 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1FJX COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 10-AUG-00. REMARK 100 THE DEPOSITION ID IS D_1000011654. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : 298 REMARK 200 PH : 5.6 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : NSLS REMARK 200 BEAMLINE : X26C REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.1 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 67597 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.260 REMARK 200 RESOLUTION RANGE LOW (A) : 20.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 82.9 REMARK 200 DATA REDUNDANCY : 2.800 REMARK 200 R MERGE (I) : 0.05600 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : 13.2000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.26 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.30 REMARK 200 COMPLETENESS FOR SHELL (%) : 32.7 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : 0.28800 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: NULL REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 63.10 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.33 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 2.7 M AMMONIUM SULFATE 20% (W/V) REMARK 280 GLUCOSE 50 MM SODIUM CITRATE, PH 5.6, VAPOR DIFFUSION, HANGING REMARK 280 DROP, TEMPERATURE 16K, TEMPERATURE 289.0K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: H 3 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z REMARK 290 3555 -X+Y,-X,Z REMARK 290 4555 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z REMARK 290 6555 -X,-X+Y,-Z REMARK 290 7555 X+2/3,Y+1/3,Z+1/3 REMARK 290 8555 -Y+2/3,X-Y+1/3,Z+1/3 REMARK 290 9555 -X+Y+2/3,-X+1/3,Z+1/3 REMARK 290 10555 Y+2/3,X+1/3,-Z+1/3 REMARK 290 11555 X-Y+2/3,-Y+1/3,-Z+1/3 REMARK 290 12555 -X+2/3,-X+Y+1/3,-Z+1/3 REMARK 290 13555 X+1/3,Y+2/3,Z+2/3 REMARK 290 14555 -Y+1/3,X-Y+2/3,Z+2/3 REMARK 290 15555 -X+Y+1/3,-X+2/3,Z+2/3 REMARK 290 16555 Y+1/3,X+2/3,-Z+2/3 REMARK 290 17555 X-Y+1/3,-Y+2/3,-Z+2/3 REMARK 290 18555 -X+1/3,-X+Y+2/3,-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 0.00000 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 0.00000 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 0.00000 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 0.00000 REMARK 290 SMTRY1 7 1.000000 0.000000 0.000000 49.23000 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 28.42295 REMARK 290 SMTRY3 7 0.000000 0.000000 1.000000 107.74000 REMARK 290 SMTRY1 8 -0.500000 -0.866025 0.000000 49.23000 REMARK 290 SMTRY2 8 0.866025 -0.500000 0.000000 28.42295 REMARK 290 SMTRY3 8 0.000000 0.000000 1.000000 107.74000 REMARK 290 SMTRY1 9 -0.500000 0.866025 0.000000 49.23000 REMARK 290 SMTRY2 9 -0.866025 -0.500000 0.000000 28.42295 REMARK 290 SMTRY3 9 0.000000 0.000000 1.000000 107.74000 REMARK 290 SMTRY1 10 -0.500000 0.866025 0.000000 49.23000 REMARK 290 SMTRY2 10 0.866025 0.500000 0.000000 28.42295 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 107.74000 REMARK 290 SMTRY1 11 1.000000 0.000000 0.000000 49.23000 REMARK 290 SMTRY2 11 0.000000 -1.000000 0.000000 28.42295 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 107.74000 REMARK 290 SMTRY1 12 -0.500000 -0.866025 0.000000 49.23000 REMARK 290 SMTRY2 12 -0.866025 0.500000 0.000000 28.42295 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 107.74000 REMARK 290 SMTRY1 13 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 13 0.000000 1.000000 0.000000 56.84591 REMARK 290 SMTRY3 13 0.000000 0.000000 1.000000 215.48000 REMARK 290 SMTRY1 14 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 14 0.866025 -0.500000 0.000000 56.84591 REMARK 290 SMTRY3 14 0.000000 0.000000 1.000000 215.48000 REMARK 290 SMTRY1 15 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 15 -0.866025 -0.500000 0.000000 56.84591 REMARK 290 SMTRY3 15 0.000000 0.000000 1.000000 215.48000 REMARK 290 SMTRY1 16 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 16 0.866025 0.500000 0.000000 56.84591 REMARK 290 SMTRY3 16 0.000000 0.000000 -1.000000 215.48000 REMARK 290 SMTRY1 17 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 17 0.000000 -1.000000 0.000000 56.84591 REMARK 290 SMTRY3 17 0.000000 0.000000 -1.000000 215.48000 REMARK 290 SMTRY1 18 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 18 -0.866025 0.500000 0.000000 56.84591 REMARK 290 SMTRY3 18 0.000000 0.000000 -1.000000 215.48000 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 300 REMARK: THE BIOLOGICAL ASSEMBLY IS A TERNARY COMPLEX FROM HHAI REMARK 300 METHYLTRANSFERASE, A PALINDROMIC OLIGONUCLEOTIDE, AND S-ADENOSYL-L- REMARK 300 HOMOCYSTEINE (ADOHCY) 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: TRIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: C, D, 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 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 GLN A 217 CG CD OE1 NE2 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 HH22 ARG A 165 H2 HOH A 416 1.26 REMARK 500 HH21 ARG A 272 H2 HOH A 545 1.31 REMARK 500 HZ1 LYS A 122 H1 HOH A 408 1.32 REMARK 500 HD1 HIS A 275 H ARG A 277 1.32 REMARK 500 HE ARG A 277 H1 HOH A 409 1.32 REMARK 500 H1 HOH A 380 O HOH A 555 1.57 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 TYR A 37 143.31 -176.37 REMARK 500 ASP A 60 104.74 -28.37 REMARK 500 ASN A 65 103.20 -52.40 REMARK 500 PRO A 80 153.59 -43.06 REMARK 500 GLN A 90 33.43 88.36 REMARK 500 LYS A 112 73.81 23.34 REMARK 500 ASP A 128 49.39 36.77 REMARK 500 ASP A 144 41.19 76.23 REMARK 500 PRO A 160 75.41 -68.90 REMARK 500 HIS A 204 -9.52 -59.47 REMARK 500 PHE A 259 46.37 -108.65 REMARK 500 LYS A 261 -7.53 61.01 REMARK 500 SER A 305 -168.10 -66.44 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 DC C 413 0.06 SIDE CHAIN REMARK 500 TYR A 157 0.06 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 600 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 601 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SAH A 328 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3MHT RELATED DB: PDB REMARK 900 3MHT CONTAINS THE WILD TYPE HHAI METHYLTRANSFERASE, THE SAME DNA REMARK 900 SEQUENCE USED AND THE SAME COFACTOR ADOHCY DBREF 1FJX A 1 327 UNP P05102 MTH1_HAEHA 1 327 DBREF 1FJX C 401 413 PDB 1FJX 1FJX 401 413 DBREF 1FJX D 421 433 PDB 1FJX 1FJX 421 433 SEQADV 1FJX GLY A 250 UNP P05102 THR 250 ENGINEERED MUTATION SEQRES 1 C 13 DT DG DA DT DA DG DC DG DC DT DA DT DC SEQRES 1 D 13 DT DG DA DT DA DG DC DG DC DT DA DT DC SEQRES 1 A 327 MET ILE GLU ILE LYS ASP LYS GLN LEU THR GLY LEU ARG SEQRES 2 A 327 PHE ILE ASP LEU PHE ALA GLY LEU GLY GLY PHE ARG LEU SEQRES 3 A 327 ALA LEU GLU SER CYS GLY ALA GLU CYS VAL TYR SER ASN SEQRES 4 A 327 GLU TRP ASP LYS TYR ALA GLN GLU VAL TYR GLU MET ASN SEQRES 5 A 327 PHE GLY GLU LYS PRO GLU GLY ASP ILE THR GLN VAL ASN SEQRES 6 A 327 GLU LYS THR ILE PRO ASP HIS ASP ILE LEU CYS ALA GLY SEQRES 7 A 327 PHE PRO CYS GLN ALA PHE SER ILE SER GLY LYS GLN LYS SEQRES 8 A 327 GLY PHE GLU ASP SER ARG GLY THR LEU PHE PHE ASP ILE SEQRES 9 A 327 ALA ARG ILE VAL ARG GLU LYS LYS PRO LYS VAL VAL PHE SEQRES 10 A 327 MET GLU ASN VAL LYS ASN PHE ALA SER HIS ASP ASN GLY SEQRES 11 A 327 ASN THR LEU GLU VAL VAL LYS ASN THR MET ASN GLU LEU SEQRES 12 A 327 ASP TYR SER PHE HIS ALA LYS VAL LEU ASN ALA LEU ASP SEQRES 13 A 327 TYR GLY ILE PRO GLN LYS ARG GLU ARG ILE TYR MET ILE SEQRES 14 A 327 CYS PHE ARG ASN ASP LEU ASN ILE GLN ASN PHE GLN PHE SEQRES 15 A 327 PRO LYS PRO PHE GLU LEU ASN THR PHE VAL LYS ASP LEU SEQRES 16 A 327 LEU LEU PRO ASP SER GLU VAL GLU HIS LEU VAL ILE ASP SEQRES 17 A 327 ARG LYS ASP LEU VAL MET THR ASN GLN GLU ILE GLU GLN SEQRES 18 A 327 THR THR PRO LYS THR VAL ARG LEU GLY ILE VAL GLY LYS SEQRES 19 A 327 GLY GLY GLN GLY GLU ARG ILE TYR SER THR ARG GLY ILE SEQRES 20 A 327 ALA ILE GLY LEU SER ALA TYR GLY GLY GLY ILE PHE ALA SEQRES 21 A 327 LYS THR GLY GLY TYR LEU VAL ASN GLY LYS THR ARG LYS SEQRES 22 A 327 LEU HIS PRO ARG GLU CYS ALA ARG VAL MET GLY TYR PRO SEQRES 23 A 327 ASP SER TYR LYS VAL HIS PRO SER THR SER GLN ALA TYR SEQRES 24 A 327 LYS GLN PHE GLY ASN SER VAL VAL ILE ASN VAL LEU GLN SEQRES 25 A 327 TYR ILE ALA TYR ASN ILE GLY SER SER LEU ASN PHE LYS SEQRES 26 A 327 PRO TYR HET SO4 A 600 5 HET SO4 A 601 5 HET SAH A 328 32 HETNAM SO4 SULFATE ION HETNAM SAH S-ADENOSYL-L-HOMOCYSTEINE FORMUL 4 SO4 2(O4 S 2-) FORMUL 6 SAH C14 H20 N6 O5 S FORMUL 7 HOH *235(H2 O) HELIX 1 1 GLY A 22 CYS A 31 1 10 HELIX 2 2 ASP A 42 GLY A 54 1 13 HELIX 3 3 ASP A 60 VAL A 64 5 5 HELIX 4 4 ASN A 65 ILE A 69 5 5 HELIX 5 5 LYS A 91 ASP A 95 5 5 HELIX 6 6 ASP A 95 THR A 99 5 5 HELIX 7 7 LEU A 100 LYS A 112 1 13 HELIX 8 8 ASN A 123 ALA A 125 5 3 HELIX 9 9 SER A 126 ASN A 129 5 4 HELIX 10 10 GLY A 130 LEU A 143 1 14 HELIX 11 11 LEU A 155 TYR A 157 5 3 HELIX 12 12 ASN A 173 ASN A 176 5 4 HELIX 13 13 PHE A 191 LEU A 196 1 6 HELIX 14 14 PRO A 198 VAL A 202 5 5 HELIX 15 15 VAL A 202 LEU A 205 5 4 HELIX 16 16 HIS A 275 MET A 283 1 9 HELIX 17 17 SER A 294 SER A 305 1 12 HELIX 18 18 VAL A 307 PHE A 324 1 18 SHEET 1 A 6 GLU A 34 SER A 38 0 SHEET 2 A 6 ARG A 13 LEU A 17 1 N PHE A 14 O GLU A 34 SHEET 3 A 6 ILE A 74 GLY A 78 1 N ILE A 74 O ARG A 13 SHEET 4 A 6 VAL A 115 VAL A 121 1 O VAL A 115 N LEU A 75 SHEET 5 A 6 GLU A 164 PHE A 171 -1 N ILE A 166 O ASN A 120 SHEET 6 A 6 HIS A 148 ASN A 153 -1 O HIS A 148 N ILE A 169 SHEET 1 B 5 VAL A 213 MET A 214 0 SHEET 2 B 5 ARG A 228 ILE A 231 -1 O ILE A 231 N VAL A 213 SHEET 3 B 5 ARG A 240 SER A 243 -1 N ILE A 241 O GLY A 230 SHEET 4 B 5 GLY A 264 VAL A 267 1 O GLY A 264 N TYR A 242 SHEET 5 B 5 LYS A 270 LYS A 273 -1 O LYS A 270 N VAL A 267 SITE 1 AC1 4 LYS A 193 ARG A 245 LYS A 290 HOH A 462 SITE 1 AC2 2 PRO A 198 ASP A 199 SITE 1 AC3 19 PHE A 18 ALA A 19 GLY A 20 LEU A 21 SITE 2 AC3 19 GLY A 23 ASN A 39 GLU A 40 TRP A 41 SITE 3 AC3 19 ASP A 60 ILE A 61 GLY A 78 PRO A 80 SITE 4 AC3 19 ASN A 304 SER A 305 HOH A 332 HOH A 333 SITE 5 AC3 19 HOH A 371 HOH A 374 HOH A 396 CRYST1 98.460 98.460 323.220 90.00 90.00 120.00 H 3 2 36 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 0.010156 0.005864 0.000000 0.00000 SCALE2 0.000000 0.011728 0.000000 0.00000 SCALE3 0.000000 0.000000 0.003094 0.00000 ATOM 1 O5' DT C 401 -23.932 19.009 98.963 1.00 61.29 O ATOM 2 C5' DT C 401 -23.652 20.415 98.840 1.00 54.17 C ATOM 3 C4' DT C 401 -22.335 20.807 99.481 1.00 53.27 C ATOM 4 O4' DT C 401 -21.237 20.418 98.628 1.00 57.70 O ATOM 5 C3' DT C 401 -22.129 22.296 99.737 1.00 51.04 C ATOM 6 O3' DT C 401 -22.684 22.653 101.003 1.00 42.10 O ATOM 7 C2' DT C 401 -20.618 22.420 99.777 1.00 55.69 C ATOM 8 C1' DT C 401 -20.134 21.298 98.858 1.00 58.74 C ATOM 9 N1 DT C 401 -19.583 21.722 97.555 1.00 59.03 N ATOM 10 C2 DT C 401 -18.601 20.933 97.001 1.00 61.94 C ATOM 11 O2 DT C 401 -18.204 19.899 97.524 1.00 65.19 O ATOM 12 N3 DT C 401 -18.104 21.386 95.809 1.00 61.53 N ATOM 13 C4 DT C 401 -18.478 22.514 95.125 1.00 60.07 C ATOM 14 O4 DT C 401 -17.931 22.778 94.060 1.00 62.94 O ATOM 15 C5 DT C 401 -19.520 23.303 95.760 1.00 59.13 C ATOM 16 C7 DT C 401 -19.991 24.561 95.100 1.00 61.08 C ATOM 17 C6 DT C 401 -20.017 22.867 96.926 1.00 58.80 C ATOM 18 H3 DT C 401 -17.371 20.828 95.401 1.00 0.00 H ATOM 19 HO5' DT C 401 -23.164 18.533 98.638 1.00 0.00 H ATOM 20 P DG C 402 -22.921 24.192 101.370 1.00 32.82 P ATOM 21 OP1 DG C 402 -21.757 25.009 100.920 1.00 38.33 O ATOM 22 OP2 DG C 402 -23.331 24.219 102.796 1.00 38.51 O ATOM 23 O5' DG C 402 -24.168 24.604 100.479 1.00 32.76 O ATOM 24 C5' DG C 402 -25.331 23.791 100.428 1.00 23.90 C ATOM 25 C4' DG C 402 -26.549 24.675 100.380 1.00 21.57 C ATOM 26 O4' DG C 402 -26.497 25.502 101.553 1.00 23.33 O ATOM 27 C3' DG C 402 -26.636 25.641 99.204 1.00 19.38 C ATOM 28 O3' DG C 402 -28.024 25.753 98.937 1.00 13.88 O ATOM 29 C2' DG C 402 -26.039 26.930 99.758 1.00 17.99 C ATOM 30 C1' DG C 402 -26.414 26.879 101.228 1.00 18.82 C ATOM 31 N9 DG C 402 -25.505 27.496 102.198 1.00 13.53 N ATOM 32 C8 DG C 402 -24.137 27.516 102.164 1.00 11.76 C ATOM 33 N7 DG C 402 -23.607 28.051 103.226 1.00 10.03 N ATOM 34 C5 DG C 402 -24.692 28.415 104.000 1.00 11.47 C ATOM 35 C6 DG C 402 -24.736 29.015 105.269 1.00 16.74 C ATOM 36 O6 DG C 402 -23.786 29.311 105.996 1.00 22.07 O ATOM 37 N1 DG C 402 -26.052 29.256 105.690 1.00 12.42 N ATOM 38 C2 DG C 402 -27.170 28.933 104.966 1.00 10.60 C ATOM 39 N2 DG C 402 -28.361 29.246 105.500 1.00 7.08 N ATOM 40 N3 DG C 402 -27.136 28.343 103.782 1.00 15.80 N ATOM 41 C4 DG C 402 -25.872 28.115 103.366 1.00 14.10 C ATOM 42 H1 DG C 402 -26.179 29.715 106.586 1.00 0.00 H ATOM 43 H21 DG C 402 -29.210 29.015 104.994 1.00 0.00 H ATOM 44 H22 DG C 402 -28.410 29.713 106.399 1.00 0.00 H ATOM 45 P DA C 403 -28.559 26.827 97.906 1.00 18.42 P ATOM 46 OP1 DA C 403 -29.621 26.169 97.139 1.00 18.73 O ATOM 47 OP2 DA C 403 -27.434 27.456 97.202 1.00 15.87 O ATOM 48 O5' DA C 403 -29.269 27.862 98.864 1.00 15.41 O ATOM 49 C5' DA C 403 -30.410 27.449 99.640 1.00 21.70 C ATOM 50 C4' DA C 403 -31.051 28.626 100.336 1.00 16.68 C ATOM 51 O4' DA C 403 -30.144 29.155 101.338 1.00 16.29 O ATOM 52 C3' DA C 403 -31.439 29.798 99.444 1.00 16.04 C ATOM 53 O3' DA C 403 -32.675 30.347 99.909 1.00 20.63 O ATOM 54 C2' DA C 403 -30.317 30.785 99.683 1.00 19.55 C ATOM 55 C1' DA C 403 -29.923 30.530 101.126 1.00 15.62 C ATOM 56 N9 DA C 403 -28.513 30.804 101.402 1.00 17.80 N ATOM 57 C8 DA C 403 -27.456 30.476 100.605 1.00 16.82 C ATOM 58 N7 DA C 403 -26.294 30.809 101.108 1.00 22.16 N ATOM 59 C5 DA C 403 -26.607 31.405 102.319 1.00 17.48 C ATOM 60 C6 DA C 403 -25.803 31.929 103.344 1.00 19.23 C ATOM 61 N6 DA C 403 -24.455 31.905 103.332 1.00 20.28 N ATOM 62 N1 DA C 403 -26.424 32.463 104.407 1.00 18.99 N ATOM 63 C2 DA C 403 -27.761 32.440 104.444 1.00 13.31 C ATOM 64 N3 DA C 403 -28.615 31.946 103.565 1.00 17.47 N ATOM 65 C4 DA C 403 -27.968 31.427 102.507 1.00 16.98 C ATOM 66 H61 DA C 403 -23.959 31.474 102.561 1.00 0.00 H ATOM 67 H62 DA C 403 -23.931 32.311 104.098 1.00 0.00 H ATOM 68 P DT C 404 -33.375 31.541 99.092 1.00 17.58 P ATOM 69 OP1 DT C 404 -34.835 31.418 99.233 1.00 24.29 O ATOM 70 OP2 DT C 404 -32.776 31.577 97.744 1.00 25.11 O ATOM 71 O5' DT C 404 -32.943 32.820 99.923 1.00 15.06 O ATOM 72 C5' DT C 404 -33.246 32.859 101.315 1.00 18.97 C ATOM 73 C4' DT C 404 -32.689 34.095 101.979 1.00 18.57 C ATOM 74 O4' DT C 404 -31.279 33.974 102.286 1.00 14.03 O ATOM 75 C3' DT C 404 -32.898 35.442 101.282 1.00 23.18 C ATOM 76 O3' DT C 404 -33.573 36.369 102.147 1.00 25.14 O ATOM 77 C2' DT C 404 -31.481 35.892 100.967 1.00 20.19 C ATOM 78 C1' DT C 404 -30.655 35.223 102.058 1.00 15.44 C ATOM 79 N1 DT C 404 -29.229 34.974 101.734 1.00 18.24 N ATOM 80 C2 DT C 404 -28.282 35.419 102.637 1.00 17.01 C ATOM 81 O2 DT C 404 -28.561 36.046 103.648 1.00 22.58 O ATOM 82 N3 DT C 404 -26.992 35.107 102.310 1.00 17.74 N ATOM 83 C4 DT C 404 -26.553 34.399 101.208 1.00 18.90 C ATOM 84 O4 DT C 404 -25.349 34.130 101.084 1.00 24.58 O ATOM 85 C5 DT C 404 -27.588 34.001 100.287 1.00 17.11 C ATOM 86 C7 DT C 404 -27.202 33.258 99.053 1.00 20.81 C ATOM 87 C6 DT C 404 -28.860 34.311 100.584 1.00 15.69 C ATOM 88 H3 DT C 404 -26.286 35.442 102.954 1.00 0.00 H ATOM 89 P DA C 405 -34.376 37.627 101.530 1.00 28.22 P ATOM 90 OP1 DA C 405 -35.688 37.722 102.203 1.00 26.70 O ATOM 91 OP2 DA C 405 -34.316 37.576 100.042 1.00 34.18 O ATOM 92 O5' DA C 405 -33.493 38.851 102.032 1.00 31.04 O ATOM 93 C5' DA C 405 -33.042 38.914 103.405 1.00 29.68 C ATOM 94 C4' DA C 405 -31.863 39.852 103.528 1.00 28.43 C ATOM 95 O4' DA C 405 -30.646 39.228 103.059 1.00 29.29 O ATOM 96 C3' DA C 405 -31.996 41.166 102.758 1.00 22.22 C ATOM 97 O3' DA C 405 -31.405 42.202 103.522 1.00 22.99 O ATOM 98 C2' DA C 405 -31.096 40.958 101.557 1.00 25.98 C ATOM 99 C1' DA C 405 -29.999 40.109 102.153 1.00 24.93 C ATOM 100 N9 DA C 405 -29.185 39.322 101.226 1.00 19.00 N ATOM 101 C8 DA C 405 -29.497 38.778 100.006 1.00 18.53 C ATOM 102 N7 DA C 405 -28.496 38.145 99.436 1.00 16.02 N ATOM 103 C5 DA C 405 -27.456 38.278 100.341 1.00 15.13 C ATOM 104 C6 DA C 405 -26.126 37.847 100.325 1.00 13.62 C ATOM 105 N6 DA C 405 -25.560 37.170 99.321 1.00 13.61 N ATOM 106 N1 DA C 405 -25.364 38.145 101.393 1.00 20.89 N ATOM 107 C2 DA C 405 -25.898 38.853 102.392 1.00 16.29 C ATOM 108 N3 DA C 405 -27.129 39.325 102.521 1.00 17.37 N ATOM 109 C4 DA C 405 -27.868 38.996 101.451 1.00 16.26 C ATOM 110 H61 DA C 405 -26.090 36.952 98.489 1.00 0.00 H ATOM 111 H62 DA C 405 -24.593 36.868 99.377 1.00 0.00 H ATOM 112 P DG C 406 -32.242 43.521 103.837 1.00 21.63 P ATOM 113 OP1 DG C 406 -33.106 43.179 104.984 1.00 27.03 O ATOM 114 OP2 DG C 406 -32.846 44.029 102.586 1.00 21.72 O ATOM 115 O5' DG C 406 -31.126 44.549 104.296 1.00 22.78 O ATOM 116 C5' DG C 406 -30.366 44.324 105.480 1.00 22.95 C ATOM 117 C4' DG C 406 -29.003 44.960 105.347 1.00 21.16 C ATOM 118 O4' DG C 406 -28.089 44.108 104.619 1.00 21.71 O ATOM 119 C3' DG C 406 -29.003 46.297 104.615 1.00 24.09 C ATOM 120 O3' DG C 406 -28.083 47.181 105.255 1.00 30.14 O ATOM 121 C2' DG C 406 -28.510 45.935 103.227 1.00 13.96 C ATOM 122 C1' DG C 406 -27.554 44.809 103.524 1.00 17.99 C ATOM 123 N9 DG C 406 -27.348 43.857 102.448 1.00 14.93 N ATOM 124 C8 DG C 406 -28.280 43.355 101.577 1.00 12.99 C ATOM 125 N7 DG C 406 -27.775 42.497 100.733 1.00 17.09 N ATOM 126 C5 DG C 406 -26.422 42.431 101.082 1.00 20.33 C ATOM 127 C6 DG C 406 -25.371 41.659 100.560 1.00 14.61 C ATOM 128 O6 DG C 406 -25.394 40.852 99.650 1.00 23.79 O ATOM 129 N1 DG C 406 -24.187 41.880 101.226 1.00 15.33 N ATOM 130 C2 DG C 406 -24.021 42.733 102.266 1.00 15.90 C ATOM 131 N2 DG C 406 -22.789 42.782 102.786 1.00 19.68 N ATOM 132 N3 DG C 406 -24.987 43.470 102.764 1.00 20.25 N ATOM 133 C4 DG C 406 -26.160 43.267 102.142 1.00 16.84 C ATOM 134 H1 DG C 406 -23.369 41.381 100.894 1.00 0.00 H ATOM 135 H21 DG C 406 -22.601 43.375 103.578 1.00 0.00 H ATOM 136 H22 DG C 406 -22.045 42.233 102.378 1.00 0.00 H ATOM 137 P DC C 407 -28.062 48.726 104.863 1.00 28.01 P ATOM 138 OP1 DC C 407 -27.335 49.408 105.941 1.00 31.85 O ATOM 139 OP2 DC C 407 -29.439 49.157 104.522 1.00 30.47 O ATOM 140 O5' DC C 407 -27.208 48.736 103.517 1.00 33.00 O ATOM 141 C5' DC C 407 -25.831 49.184 103.497 1.00 32.25 C ATOM 142 C4' DC C 407 -24.880 48.046 103.809 1.00 31.56 C ATOM 143 O4' DC C 407 -25.193 46.846 103.070 1.00 35.91 O ATOM 144 C3' DC C 407 -23.430 48.351 103.478 1.00 32.96 C ATOM 145 O3' DC C 407 -22.639 47.731 104.456 1.00 41.57 O ATOM 146 C2' DC C 407 -23.189 47.628 102.171 1.00 28.45 C ATOM 147 C1' DC C 407 -24.084 46.430 102.294 1.00 24.43 C ATOM 148 N1 DC C 407 -24.599 45.980 101.005 1.00 20.63 N ATOM 149 C2 DC C 407 -23.766 45.288 100.180 1.00 19.29 C ATOM 150 O2 DC C 407 -22.607 45.089 100.552 1.00 18.88 O ATOM 151 N3 DC C 407 -24.232 44.849 98.989 1.00 23.56 N ATOM 152 C4 DC C 407 -25.496 45.096 98.636 1.00 21.35 C ATOM 153 N4 DC C 407 -25.931 44.653 97.459 1.00 23.53 N ATOM 154 C5 DC C 407 -26.372 45.812 99.474 1.00 21.73 C ATOM 155 C6 DC C 407 -25.888 46.237 100.640 1.00 20.29 C ATOM 156 H41 DC C 407 -26.900 44.802 97.196 1.00 0.00 H ATOM 157 H42 DC C 407 -25.314 44.187 96.825 1.00 0.00 H ATOM 158 P DG C 408 -21.572 48.602 105.248 1.00 48.23 P ATOM 159 OP1 DG C 408 -20.767 47.640 106.061 1.00 42.52 O ATOM 160 OP2 DG C 408 -22.287 49.725 105.904 1.00 47.82 O ATOM 161 O5' DG C 408 -20.709 49.247 104.081 1.00 43.43 O ATOM 162 C5' DG C 408 -19.516 48.614 103.620 1.00 35.21 C ATOM 163 C4' DG C 408 -19.060 49.305 102.368 1.00 26.78 C ATOM 164 O4' DG C 408 -19.999 49.033 101.313 1.00 21.69 O ATOM 165 C3' DG C 408 -19.049 50.822 102.524 1.00 27.55 C ATOM 166 O3' DG C 408 -17.986 51.321 101.719 1.00 35.96 O ATOM 167 C2' DG C 408 -20.347 51.246 101.867 1.00 24.24 C ATOM 168 C1' DG C 408 -20.350 50.262 100.734 1.00 21.49 C ATOM 169 N9 DG C 408 -21.577 50.068 99.981 1.00 23.64 N ATOM 170 C8 DG C 408 -22.807 50.637 100.189 1.00 23.87 C ATOM 171 N7 DG C 408 -23.715 50.197 99.360 1.00 27.61 N ATOM 172 C5 DG C 408 -23.034 49.299 98.551 1.00 22.61 C ATOM 173 C6 DG C 408 -23.496 48.490 97.498 1.00 19.23 C ATOM 174 O6 DG C 408 -24.649 48.382 97.067 1.00 17.90 O ATOM 175 N1 DG C 408 -22.463 47.730 96.944 1.00 13.48 N ATOM 176 C2 DG C 408 -21.150 47.745 97.367 1.00 16.03 C ATOM 177 N2 DG C 408 -20.284 46.983 96.692 1.00 11.19 N ATOM 178 N3 DG C 408 -20.720 48.472 98.373 1.00 15.88 N ATOM 179 C4 DG C 408 -21.707 49.226 98.909 1.00 20.99 C ATOM 180 H1 DG C 408 -22.700 47.133 96.175 1.00 0.00 H ATOM 181 H21 DG C 408 -19.305 46.955 96.953 1.00 0.00 H ATOM 182 H22 DG C 408 -20.604 46.420 95.918 1.00 0.00 H ATOM 183 P DC C 409 -16.802 52.180 102.380 1.00 35.07 P ATOM 184 OP1 DC C 409 -16.146 51.330 103.393 1.00 33.00 O ATOM 185 OP2 DC C 409 -17.301 53.517 102.743 1.00 35.62 O ATOM 186 O5' DC C 409 -15.780 52.349 101.178 1.00 33.65 O ATOM 187 C5' DC C 409 -15.083 51.201 100.683 1.00 38.03 C ATOM 188 C4' DC C 409 -15.324 51.015 99.205 1.00 34.45 C ATOM 189 O4' DC C 409 -16.681 50.654 98.912 1.00 33.34 O ATOM 190 C3' DC C 409 -15.044 52.190 98.275 1.00 37.24 C ATOM 191 O3' DC C 409 -13.631 52.232 98.016 1.00 44.76 O ATOM 192 C2' DC C 409 -15.805 51.795 97.021 1.00 37.17 C ATOM 193 C1' DC C 409 -16.816 50.750 97.502 1.00 33.27 C ATOM 194 N1 DC C 409 -18.218 51.027 97.162 1.00 27.31 N ATOM 195 C2 DC C 409 -18.772 50.308 96.126 1.00 29.65 C ATOM 196 O2 DC C 409 -18.085 49.427 95.575 1.00 30.01 O ATOM 197 N3 DC C 409 -20.045 50.574 95.737 1.00 29.59 N ATOM 198 C4 DC C 409 -20.747 51.524 96.362 1.00 24.98 C ATOM 199 N4 DC C 409 -21.987 51.774 95.925 1.00 19.93 N ATOM 200 C5 DC C 409 -20.210 52.256 97.454 1.00 23.18 C ATOM 201 C6 DC C 409 -18.954 51.976 97.820 1.00 26.33 C ATOM 202 H41 DC C 409 -22.534 52.499 96.371 1.00 0.00 H ATOM 203 H42 DC C 409 -22.376 51.236 95.162 1.00 0.00 H ATOM 204 P DT C 410 -13.027 53.347 97.034 1.00 44.22 P ATOM 205 OP1 DT C 410 -11.548 53.350 97.299 1.00 45.16 O ATOM 206 OP2 DT C 410 -13.793 54.596 97.205 1.00 46.48 O ATOM 207 O5' DT C 410 -13.367 52.752 95.599 1.00 40.47 O ATOM 208 C5' DT C 410 -13.064 51.379 95.307 1.00 42.61 C ATOM 209 C4' DT C 410 -13.308 51.093 93.848 1.00 41.39 C ATOM 210 O4' DT C 410 -14.725 50.952 93.585 1.00 41.66 O ATOM 211 C3' DT C 410 -12.797 52.195 92.926 1.00 38.42 C ATOM 212 O3' DT C 410 -12.220 51.592 91.772 1.00 39.24 O ATOM 213 C2' DT C 410 -14.055 52.964 92.569 1.00 38.38 C ATOM 214 C1' DT C 410 -15.133 51.888 92.597 1.00 38.08 C ATOM 215 N1 DT C 410 -16.496 52.369 92.952 1.00 31.79 N ATOM 216 C2 DT C 410 -17.551 51.953 92.183 1.00 29.03 C ATOM 217 O2 DT C 410 -17.426 51.162 91.264 1.00 32.69 O ATOM 218 N3 DT C 410 -18.766 52.479 92.546 1.00 26.52 N ATOM 219 C4 DT C 410 -19.032 53.327 93.613 1.00 31.50 C ATOM 220 O4 DT C 410 -20.198 53.711 93.847 1.00 30.65 O ATOM 221 C5 DT C 410 -17.891 53.686 94.388 1.00 31.43 C ATOM 222 C7 DT C 410 -18.095 54.549 95.590 1.00 31.85 C ATOM 223 C6 DT C 410 -16.691 53.212 94.017 1.00 32.97 C ATOM 224 H3 DT C 410 -19.563 52.227 91.973 1.00 0.00 H ATOM 225 P DA C 411 -11.359 52.474 90.751 1.00 37.51 P ATOM 226 OP1 DA C 411 -10.118 51.726 90.485 1.00 31.35 O ATOM 227 OP2 DA C 411 -11.311 53.884 91.229 1.00 43.06 O ATOM 228 O5' DA C 411 -12.242 52.494 89.440 1.00 37.50 O ATOM 229 C5' DA C 411 -12.751 51.294 88.870 1.00 27.40 C ATOM 230 C4' DA C 411 -13.620 51.641 87.693 1.00 24.49 C ATOM 231 O4' DA C 411 -14.877 52.178 88.158 1.00 23.66 O ATOM 232 C3' DA C 411 -13.000 52.719 86.813 1.00 28.13 C ATOM 233 O3' DA C 411 -13.210 52.368 85.459 1.00 34.19 O ATOM 234 C2' DA C 411 -13.728 53.994 87.221 1.00 28.33 C ATOM 235 C1' DA C 411 -15.083 53.506 87.696 1.00 22.97 C ATOM 236 N9 DA C 411 -15.693 54.260 88.798 1.00 22.10 N ATOM 237 C8 DA C 411 -15.088 54.872 89.868 1.00 22.22 C ATOM 238 N7 DA C 411 -15.937 55.368 90.747 1.00 22.04 N ATOM 239 C5 DA C 411 -17.185 55.080 90.207 1.00 19.24 C ATOM 240 C6 DA C 411 -18.505 55.308 90.667 1.00 18.26 C ATOM 241 N6 DA C 411 -18.818 55.868 91.832 1.00 19.61 N ATOM 242 N1 DA C 411 -19.518 54.912 89.873 1.00 17.23 N ATOM 243 C2 DA C 411 -19.230 54.315 88.717 1.00 17.15 C ATOM 244 N3 DA C 411 -18.044 54.021 88.190 1.00 21.41 N ATOM 245 C4 DA C 411 -17.047 54.432 88.995 1.00 21.16 C ATOM 246 H61 DA C 411 -19.784 56.065 92.057 1.00 0.00 H ATOM 247 H62 DA C 411 -18.105 56.062 92.521 1.00 0.00 H ATOM 248 P DT C 412 -12.828 53.395 84.295 1.00 38.58 P ATOM 249 OP1 DT C 412 -12.644 52.524 83.084 1.00 39.56 O ATOM 250 OP2 DT C 412 -11.716 54.291 84.731 1.00 37.15 O ATOM 251 O5' DT C 412 -14.180 54.222 84.140 1.00 35.30 O ATOM 252 C5' DT C 412 -15.399 53.560 83.741 1.00 33.24 C ATOM 253 C4' DT C 412 -16.435 54.575 83.327 1.00 34.06 C ATOM 254 O4' DT C 412 -17.152 55.087 84.474 1.00 33.08 O ATOM 255 C3' DT C 412 -15.836 55.789 82.623 1.00 38.69 C ATOM 256 O3' DT C 412 -16.675 56.219 81.549 1.00 48.69 O ATOM 257 C2' DT C 412 -15.816 56.847 83.708 1.00 35.93 C ATOM 258 C1' DT C 412 -17.048 56.497 84.516 1.00 30.67 C ATOM 259 N1 DT C 412 -17.019 56.934 85.934 1.00 26.62 N ATOM 260 C2 DT C 412 -18.230 57.081 86.564 1.00 24.55 C ATOM 261 O2 DT C 412 -19.292 56.811 86.028 1.00 29.83 O ATOM 262 N3 DT C 412 -18.165 57.558 87.847 1.00 25.91 N ATOM 263 C4 DT C 412 -17.038 57.882 88.566 1.00 26.37 C ATOM 264 O4 DT C 412 -17.150 58.312 89.723 1.00 29.34 O ATOM 265 C5 DT C 412 -15.787 57.682 87.861 1.00 28.92 C ATOM 266 C7 DT C 412 -14.497 58.000 88.565 1.00 30.21 C ATOM 267 C6 DT C 412 -15.840 57.222 86.592 1.00 28.17 C ATOM 268 H3 DT C 412 -19.051 57.699 88.314 1.00 0.00 H ATOM 269 P DC C 413 -16.040 57.052 80.324 1.00 53.01 P ATOM 270 OP1 DC C 413 -16.327 56.277 79.087 1.00 53.04 O ATOM 271 OP2 DC C 413 -14.642 57.395 80.671 1.00 51.73 O ATOM 272 O5' DC C 413 -16.876 58.410 80.305 1.00 55.20 O ATOM 273 C5' DC C 413 -18.304 58.412 80.041 1.00 60.52 C ATOM 274 C4' DC C 413 -18.916 59.748 80.408 1.00 61.07 C ATOM 275 O4' DC C 413 -19.107 59.846 81.845 1.00 60.32 O ATOM 276 C3' DC C 413 -18.103 60.983 79.979 1.00 61.80 C ATOM 277 O3' DC C 413 -18.889 62.094 79.522 1.00 58.79 O ATOM 278 C2' DC C 413 -17.448 61.444 81.265 1.00 61.62 C ATOM 279 C1' DC C 413 -18.497 61.049 82.307 1.00 62.67 C ATOM 280 N1 DC C 413 -17.998 60.855 83.700 1.00 58.83 N ATOM 281 C2 DC C 413 -18.930 60.746 84.739 1.00 57.00 C ATOM 282 O2 DC C 413 -20.144 60.659 84.457 1.00 57.44 O ATOM 283 N3 DC C 413 -18.488 60.732 86.018 1.00 55.19 N ATOM 284 C4 DC C 413 -17.182 60.775 86.277 1.00 54.49 C ATOM 285 N4 DC C 413 -16.802 60.793 87.553 1.00 60.77 N ATOM 286 C5 DC C 413 -16.215 60.808 85.241 1.00 53.06 C ATOM 287 C6 DC C 413 -16.658 60.841 83.981 1.00 55.53 C ATOM 288 HO3' DC C 413 -19.424 62.398 80.263 1.00 0.00 H ATOM 289 H41 DC C 413 -17.500 60.761 88.295 1.00 0.00 H ATOM 290 H42 DC C 413 -15.809 60.822 87.794 1.00 0.00 H TER 291 DC C 413 ATOM 292 O5' DT D 421 -16.572 64.871 92.718 1.00 44.93 O ATOM 293 C5' DT D 421 -17.947 65.210 92.901 1.00 34.52 C ATOM 294 C4' DT D 421 -18.296 66.438 92.087 1.00 32.41 C ATOM 295 O4' DT D 421 -17.780 66.298 90.752 1.00 34.98 O ATOM 296 C3' DT D 421 -19.787 66.634 91.893 1.00 34.59 C ATOM 297 O3' DT D 421 -20.315 67.375 92.980 1.00 42.91 O ATOM 298 C2' DT D 421 -19.876 67.422 90.600 1.00 28.91 C ATOM 299 C1' DT D 421 -18.633 66.996 89.844 1.00 27.92 C ATOM 300 N1 DT D 421 -18.791 66.179 88.620 1.00 21.61 N ATOM 301 C2 DT D 421 -20.011 66.150 87.973 1.00 19.68 C ATOM 302 O2 DT D 421 -21.020 66.688 88.400 1.00 21.92 O ATOM 303 N3 DT D 421 -20.012 65.446 86.805 1.00 16.74 N ATOM 304 C4 DT D 421 -18.949 64.780 86.234 1.00 17.30 C ATOM 305 O4 DT D 421 -19.097 64.202 85.166 1.00 26.20 O ATOM 306 C5 DT D 421 -17.715 64.820 86.975 1.00 14.93 C ATOM 307 C7 DT D 421 -16.517 64.098 86.430 1.00 16.94 C ATOM 308 C6 DT D 421 -17.698 65.510 88.113 1.00 15.86 C ATOM 309 H3 DT D 421 -20.891 65.418 86.305 1.00 0.00 H ATOM 310 HO5' DT D 421 -16.444 64.763 91.771 1.00 0.00 H ATOM 311 P DG D 422 -21.766 68.043 92.848 1.00 53.59 P ATOM 312 OP1 DG D 422 -21.580 69.317 92.090 1.00 56.10 O ATOM 313 OP2 DG D 422 -22.440 68.058 94.173 1.00 58.20 O ATOM 314 O5' DG D 422 -22.585 67.033 91.944 1.00 54.14 O ATOM 315 C5' DG D 422 -23.709 67.481 91.197 1.00 53.37 C ATOM 316 C4' DG D 422 -24.539 66.292 90.792 1.00 49.35 C ATOM 317 O4' DG D 422 -23.654 65.318 90.182 1.00 46.43 O ATOM 318 C3' DG D 422 -25.229 65.562 91.943 1.00 48.76 C ATOM 319 O3' DG D 422 -26.526 65.183 91.479 1.00 50.37 O ATOM 320 C2' DG D 422 -24.310 64.381 92.235 1.00 42.06 C ATOM 321 C1' DG D 422 -23.672 64.087 90.897 1.00 39.52 C ATOM 322 N9 DG D 422 -22.299 63.585 90.957 1.00 31.61 N ATOM 323 C8 DG D 422 -21.456 63.607 92.038 1.00 33.51 C ATOM 324 N7 DG D 422 -20.285 63.069 91.793 1.00 29.61 N ATOM 325 C5 DG D 422 -20.373 62.658 90.466 1.00 27.08 C ATOM 326 C6 DG D 422 -19.424 61.990 89.642 1.00 23.90 C ATOM 327 O6 DG D 422 -18.294 61.586 89.944 1.00 26.08 O ATOM 328 N1 DG D 422 -19.906 61.792 88.352 1.00 23.89 N ATOM 329 C2 DG D 422 -21.157 62.177 87.912 1.00 25.49 C ATOM 330 N2 DG D 422 -21.461 61.913 86.631 1.00 22.92 N ATOM 331 N3 DG D 422 -22.059 62.784 88.681 1.00 28.22 N ATOM 332 C4 DG D 422 -21.605 62.991 89.934 1.00 28.04 C ATOM 333 H1 DG D 422 -19.322 61.288 87.695 1.00 0.00 H ATOM 334 H21 DG D 422 -22.370 62.179 86.282 1.00 0.00 H ATOM 335 H22 DG D 422 -20.801 61.454 86.008 1.00 0.00 H ATOM 336 P DA D 423 -27.420 64.139 92.308 1.00 48.88 P ATOM 337 OP1 DA D 423 -28.818 64.640 92.214 1.00 51.28 O ATOM 338 OP2 DA D 423 -26.816 63.843 93.639 1.00 51.78 O ATOM 339 O5' DA D 423 -27.359 62.832 91.414 1.00 46.86 O ATOM 340 C5' DA D 423 -27.779 62.881 90.053 1.00 41.76 C ATOM 341 C4' DA D 423 -27.689 61.509 89.435 1.00 40.26 C ATOM 342 O4' DA D 423 -26.301 61.145 89.260 1.00 38.60 O ATOM 343 C3' DA D 423 -28.322 60.396 90.265 1.00 44.59 C ATOM 344 O3' DA D 423 -29.085 59.535 89.402 1.00 45.39 O ATOM 345 C2' DA D 423 -27.123 59.687 90.886 1.00 39.70 C ATOM 346 C1' DA D 423 -26.050 59.878 89.828 1.00 33.77 C ATOM 347 N9 DA D 423 -24.683 59.865 90.337 1.00 26.69 N ATOM 348 C8 DA D 423 -24.259 60.225 91.591 1.00 27.30 C ATOM 349 N7 DA D 423 -22.978 60.024 91.792 1.00 22.70 N ATOM 350 C5 DA D 423 -22.523 59.514 90.584 1.00 23.63 C ATOM 351 C6 DA D 423 -21.249 59.070 90.164 1.00 24.53 C ATOM 352 N6 DA D 423 -20.166 59.079 90.952 1.00 18.71 N ATOM 353 N1 DA D 423 -21.130 58.612 88.891 1.00 24.02 N ATOM 354 C2 DA D 423 -22.221 58.604 88.109 1.00 20.50 C ATOM 355 N3 DA D 423 -23.473 58.989 88.396 1.00 24.57 N ATOM 356 C4 DA D 423 -23.555 59.435 89.666 1.00 23.81 C ATOM 357 H61 DA D 423 -20.248 59.408 91.902 1.00 0.00 H ATOM 358 H62 DA D 423 -19.270 58.758 90.607 1.00 0.00 H ATOM 359 P DT D 424 -29.634 58.133 89.960 1.00 46.91 P ATOM 360 OP1 DT D 424 -31.041 57.990 89.481 1.00 47.11 O ATOM 361 OP2 DT D 424 -29.335 58.001 91.424 1.00 42.75 O ATOM 362 O5' DT D 424 -28.713 57.080 89.194 1.00 47.03 O ATOM 363 C5' DT D 424 -28.390 57.287 87.813 1.00 37.97 C ATOM 364 C4' DT D 424 -27.484 56.194 87.302 1.00 34.41 C ATOM 365 O4' DT D 424 -26.097 56.414 87.670 1.00 29.52 O ATOM 366 C3' DT D 424 -27.839 54.789 87.787 1.00 31.34 C ATOM 367 O3' DT D 424 -27.695 53.878 86.712 1.00 29.79 O ATOM 368 C2' DT D 424 -26.748 54.481 88.793 1.00 32.28 C ATOM 369 C1' DT D 424 -25.565 55.220 88.196 1.00 27.29 C ATOM 370 N1 DT D 424 -24.537 55.567 89.170 1.00 24.81 N ATOM 371 C2 DT D 424 -23.222 55.274 88.874 1.00 23.89 C ATOM 372 O2 DT D 424 -22.871 54.720 87.849 1.00 26.72 O ATOM 373 N3 DT D 424 -22.324 55.644 89.853 1.00 22.79 N ATOM 374 C4 DT D 424 -22.619 56.235 91.074 1.00 30.41 C ATOM 375 O4 DT D 424 -21.720 56.531 91.868 1.00 38.36 O ATOM 376 C5 DT D 424 -24.013 56.477 91.319 1.00 28.67 C ATOM 377 C7 DT D 424 -24.422 57.088 92.618 1.00 29.32 C ATOM 378 C6 DT D 424 -24.888 56.145 90.361 1.00 26.68 C ATOM 379 H3 DT D 424 -21.347 55.444 89.674 1.00 0.00 H ATOM 380 P DA D 425 -28.515 52.511 86.708 1.00 28.10 P ATOM 381 OP1 DA D 425 -29.498 52.659 85.612 1.00 28.52 O ATOM 382 OP2 DA D 425 -28.924 52.079 88.068 1.00 23.48 O ATOM 383 O5' DA D 425 -27.446 51.441 86.267 1.00 30.24 O ATOM 384 C5' DA D 425 -26.583 51.688 85.168 1.00 27.73 C ATOM 385 C4' DA D 425 -25.310 50.915 85.399 1.00 31.70 C ATOM 386 O4' DA D 425 -24.553 51.535 86.457 1.00 26.89 O ATOM 387 C3' DA D 425 -25.582 49.498 85.888 1.00 29.21 C ATOM 388 O3' DA D 425 -24.595 48.655 85.357 1.00 32.95 O ATOM 389 C2' DA D 425 -25.414 49.593 87.387 1.00 25.99 C ATOM 390 C1' DA D 425 -24.288 50.601 87.469 1.00 24.78 C ATOM 391 N9 DA D 425 -24.193 51.329 88.718 1.00 20.98 N ATOM 392 C8 DA D 425 -25.188 51.930 89.432 1.00 19.20 C ATOM 393 N7 DA D 425 -24.773 52.488 90.552 1.00 24.20 N ATOM 394 C5 DA D 425 -23.413 52.215 90.573 1.00 18.91 C ATOM 395 C6 DA D 425 -22.390 52.507 91.498 1.00 18.62 C ATOM 396 N6 DA D 425 -22.595 53.156 92.648 1.00 21.90 N ATOM 397 N1 DA D 425 -21.127 52.085 91.209 1.00 17.78 N ATOM 398 C2 DA D 425 -20.927 51.421 90.060 1.00 21.58 C ATOM 399 N3 DA D 425 -21.811 51.085 89.117 1.00 26.07 N ATOM 400 C4 DA D 425 -23.043 51.508 89.446 1.00 20.55 C ATOM 401 H61 DA D 425 -23.529 53.432 92.891 1.00 0.00 H ATOM 402 H62 DA D 425 -21.825 53.381 93.279 1.00 0.00 H ATOM 403 P DG D 426 -24.799 47.079 85.490 1.00 35.33 P ATOM 404 OP1 DG D 426 -24.739 46.597 84.125 1.00 35.09 O ATOM 405 OP2 DG D 426 -26.022 46.892 86.269 1.00 32.01 O ATOM 406 O5' DG D 426 -23.525 46.601 86.307 1.00 34.54 O ATOM 407 C5' DG D 426 -22.211 46.923 85.816 1.00 32.63 C ATOM 408 C4' DG D 426 -21.129 46.502 86.772 1.00 28.01 C ATOM 409 O4' DG D 426 -21.093 47.415 87.881 1.00 25.98 O ATOM 410 C3' DG D 426 -21.249 45.098 87.376 1.00 24.21 C ATOM 411 O3' DG D 426 -19.953 44.524 87.535 1.00 20.93 O ATOM 412 C2' DG D 426 -21.780 45.367 88.757 1.00 20.39 C ATOM 413 C1' DG D 426 -21.165 46.701 89.088 1.00 20.75 C ATOM 414 N9 DG D 426 -21.952 47.493 90.023 1.00 22.40 N ATOM 415 C8 DG D 426 -23.315 47.688 90.027 1.00 17.64 C ATOM 416 N7 DG D 426 -23.715 48.398 91.041 1.00 19.30 N ATOM 417 C5 DG D 426 -22.542 48.708 91.731 1.00 21.79 C ATOM 418 C6 DG D 426 -22.323 49.461 92.926 1.00 22.24 C ATOM 419 O6 DG D 426 -23.150 50.082 93.617 1.00 23.71 O ATOM 420 N1 DG D 426 -20.978 49.467 93.279 1.00 19.85 N ATOM 421 C2 DG D 426 -19.972 48.875 92.561 1.00 17.50 C ATOM 422 N2 DG D 426 -18.739 48.992 93.051 1.00 18.26 N ATOM 423 N3 DG D 426 -20.156 48.217 91.451 1.00 18.10 N ATOM 424 C4 DG D 426 -21.454 48.161 91.101 1.00 19.50 C ATOM 425 H1 DG D 426 -20.721 49.919 94.151 1.00 0.00 H ATOM 426 H21 DG D 426 -17.951 48.608 92.540 1.00 0.00 H ATOM 427 H22 DG D 426 -18.573 49.452 93.939 1.00 0.00 H ATOM 428 P DC D 427 -19.300 43.681 86.354 1.00 17.94 P ATOM 429 OP1 DC D 427 -17.890 43.459 86.655 1.00 17.48 O ATOM 430 OP2 DC D 427 -19.671 44.360 85.119 1.00 18.00 O ATOM 431 O5' DC D 427 -19.991 42.257 86.394 1.00 12.02 O ATOM 432 C5' DC D 427 -19.500 41.258 87.294 1.00 10.34 C ATOM 433 C4' DC D 427 -20.204 39.943 87.080 1.00 8.15 C ATOM 434 O4' DC D 427 -19.815 39.346 85.825 1.00 13.80 O ATOM 435 C3' DC D 427 -19.853 38.882 88.106 1.00 10.79 C ATOM 436 O3' DC D 427 -20.673 39.080 89.250 1.00 13.38 O ATOM 437 C2' DC D 427 -20.199 37.600 87.372 1.00 5.59 C ATOM 438 C1' DC D 427 -19.979 37.941 85.912 1.00 7.39 C ATOM 439 N1 DC D 427 -18.843 37.300 85.238 1.00 13.60 N ATOM 440 C2 DC D 427 -18.755 37.442 83.853 1.00 19.01 C ATOM 441 O2 DC D 427 -19.634 38.091 83.281 1.00 24.28 O ATOM 442 N3 DC D 427 -17.717 36.862 83.179 1.00 16.95 N ATOM 443 C4 DC D 427 -16.798 36.179 83.848 1.00 14.21 C ATOM 444 N4 DC D 427 -15.808 35.635 83.163 1.00 12.55 N ATOM 445 C5 DC D 427 -16.866 36.024 85.274 1.00 13.03 C ATOM 446 C6 DC D 427 -17.893 36.601 85.920 1.00 14.23 C ATOM 447 H41 DC D 427 -15.761 35.756 82.166 1.00 0.00 H ATOM 448 H42 DC D 427 -15.114 35.082 83.644 1.00 0.00 H ATOM 449 P DG D 428 -20.105 38.797 90.720 1.00 15.49 P ATOM 450 OP1 DG D 428 -18.999 37.830 90.710 1.00 18.44 O ATOM 451 OP2 DG D 428 -21.286 38.524 91.536 1.00 12.00 O ATOM 452 O5' DG D 428 -19.498 40.188 91.180 1.00 16.79 O ATOM 453 C5' DG D 428 -18.096 40.440 91.145 1.00 10.17 C ATOM 454 C4' DG D 428 -17.602 40.880 92.506 1.00 11.83 C ATOM 455 O4' DG D 428 -18.489 41.864 93.090 1.00 17.27 O ATOM 456 C3' DG D 428 -17.464 39.786 93.553 1.00 11.06 C ATOM 457 O3' DG D 428 -16.354 40.150 94.353 1.00 17.49 O ATOM 458 C2' DG D 428 -18.700 39.957 94.396 1.00 14.25 C ATOM 459 C1' DG D 428 -18.912 41.449 94.378 1.00 12.46 C ATOM 460 N9 DG D 428 -20.318 41.788 94.528 1.00 9.89 N ATOM 461 C8 DG D 428 -21.336 41.436 93.681 1.00 11.63 C ATOM 462 N7 DG D 428 -22.512 41.799 94.118 1.00 17.12 N ATOM 463 C5 DG D 428 -22.251 42.437 95.313 1.00 11.65 C ATOM 464 C6 DG D 428 -23.127 43.005 96.224 1.00 13.65 C ATOM 465 O6 DG D 428 -24.344 43.077 96.150 1.00 15.40 O ATOM 466 N1 DG D 428 -22.454 43.531 97.325 1.00 10.50 N ATOM 467 C2 DG D 428 -21.092 43.508 97.491 1.00 14.45 C ATOM 468 N2 DG D 428 -20.614 44.003 98.641 1.00 21.07 N ATOM 469 N3 DG D 428 -20.253 43.009 96.610 1.00 16.13 N ATOM 470 C4 DG D 428 -20.895 42.472 95.564 1.00 13.35 C ATOM 471 H1 DG D 428 -23.011 43.962 98.051 1.00 0.00 H ATOM 472 H21 DG D 428 -19.619 43.996 98.812 1.00 0.00 H ATOM 473 H22 DG D 428 -21.230 44.400 99.337 1.00 0.00 H ATOM 474 P DC D 429 -15.891 39.213 95.559 1.00 21.75 P ATOM 475 OP1 DC D 429 -14.411 39.310 95.627 1.00 28.45 O ATOM 476 OP2 DC D 429 -16.529 37.900 95.449 1.00 24.17 O ATOM 477 O5' DC D 429 -16.440 39.934 96.868 1.00 26.45 O ATOM 478 C5' DC D 429 -15.917 41.213 97.276 1.00 21.41 C ATOM 479 C4' DC D 429 -16.335 41.532 98.693 1.00 19.10 C ATOM 480 O4' DC D 429 -17.754 41.807 98.784 1.00 20.03 O ATOM 481 C3' DC D 429 -16.043 40.431 99.709 1.00 21.13 C ATOM 482 O3' DC D 429 -15.591 41.029 100.931 1.00 25.26 O ATOM 483 C2' DC D 429 -17.404 39.806 99.928 1.00 20.46 C ATOM 484 C1' DC D 429 -18.334 40.993 99.787 1.00 18.09 C ATOM 485 N1 DC D 429 -19.688 40.612 99.355 1.00 18.47 N ATOM 486 C2 DC D 429 -20.788 40.966 100.154 1.00 15.74 C ATOM 487 O2 DC D 429 -20.618 41.609 101.212 1.00 22.90 O ATOM 488 N3 DC D 429 -22.016 40.598 99.758 1.00 15.80 N ATOM 489 C4 DC D 429 -22.174 39.929 98.620 1.00 11.13 C ATOM 490 N4 DC D 429 -23.410 39.603 98.269 1.00 15.18 N ATOM 491 C5 DC D 429 -21.079 39.564 97.787 1.00 8.41 C ATOM 492 C6 DC D 429 -19.870 39.913 98.194 1.00 11.46 C ATOM 493 H41 DC D 429 -23.575 39.085 97.421 1.00 0.00 H ATOM 494 H42 DC D 429 -24.189 39.864 98.852 1.00 0.00 H ATOM 495 P DT D 430 -14.993 40.117 102.109 1.00 28.73 P ATOM 496 OP1 DT D 430 -14.069 40.981 102.886 1.00 30.20 O ATOM 497 OP2 DT D 430 -14.524 38.834 101.546 1.00 23.21 O ATOM 498 O5' DT D 430 -16.256 39.812 103.026 1.00 29.54 O ATOM 499 C5' DT D 430 -17.018 40.887 103.610 1.00 25.00 C ATOM 500 C4' DT D 430 -18.189 40.314 104.369 1.00 24.47 C ATOM 501 O4' DT D 430 -19.324 40.023 103.522 1.00 27.35 O ATOM 502 C3' DT D 430 -17.853 39.011 105.077 1.00 26.81 C ATOM 503 O3' DT D 430 -18.581 39.004 106.287 1.00 35.43 O ATOM 504 C2' DT D 430 -18.500 37.956 104.203 1.00 27.20 C ATOM 505 C1' DT D 430 -19.745 38.695 103.777 1.00 24.54 C ATOM 506 N1 DT D 430 -20.444 38.174 102.582 1.00 27.20 N ATOM 507 C2 DT D 430 -21.803 38.390 102.522 1.00 26.33 C ATOM 508 O2 DT D 430 -22.406 39.034 103.355 1.00 31.05 O ATOM 509 N3 DT D 430 -22.430 37.827 101.447 1.00 23.87 N ATOM 510 C4 DT D 430 -21.859 37.093 100.435 1.00 23.18 C ATOM 511 O4 DT D 430 -22.574 36.641 99.548 1.00 24.08 O ATOM 512 C5 DT D 430 -20.412 36.922 100.536 1.00 22.72 C ATOM 513 C7 DT D 430 -19.687 36.156 99.481 1.00 19.37 C ATOM 514 C6 DT D 430 -19.787 37.471 101.590 1.00 25.64 C ATOM 515 H3 DT D 430 -23.426 37.984 101.388 1.00 0.00 H ATOM 516 P DA D 431 -17.822 38.804 107.681 1.00 34.52 P ATOM 517 OP1 DA D 431 -16.946 39.992 107.909 1.00 36.49 O ATOM 518 OP2 DA D 431 -17.232 37.440 107.656 1.00 30.53 O ATOM 519 O5' DA D 431 -19.044 38.925 108.683 1.00 29.23 O ATOM 520 C5' DA D 431 -19.748 40.170 108.761 1.00 30.03 C ATOM 521 C4' DA D 431 -21.211 39.939 109.045 1.00 28.30 C ATOM 522 O4' DA D 431 -21.907 39.496 107.859 1.00 28.72 O ATOM 523 C3' DA D 431 -21.504 38.915 110.139 1.00 31.52 C ATOM 524 O3' DA D 431 -22.526 39.423 110.996 1.00 38.62 O ATOM 525 C2' DA D 431 -22.000 37.703 109.375 1.00 31.62 C ATOM 526 C1' DA D 431 -22.647 38.304 108.131 1.00 27.42 C ATOM 527 N9 DA D 431 -22.542 37.437 106.958 1.00 22.22 N ATOM 528 C8 DA D 431 -21.393 36.841 106.500 1.00 22.46 C ATOM 529 N7 DA D 431 -21.555 36.138 105.417 1.00 21.01 N ATOM 530 C5 DA D 431 -22.909 36.266 105.132 1.00 19.45 C ATOM 531 C6 DA D 431 -23.697 35.747 104.100 1.00 16.20 C ATOM 532 N6 DA D 431 -23.222 34.978 103.131 1.00 24.21 N ATOM 533 N1 DA D 431 -25.002 36.051 104.096 1.00 15.55 N ATOM 534 C2 DA D 431 -25.474 36.821 105.083 1.00 16.07 C ATOM 535 N3 DA D 431 -24.833 37.374 106.110 1.00 19.37 N ATOM 536 C4 DA D 431 -23.527 37.049 106.077 1.00 17.76 C ATOM 537 H61 DA D 431 -22.242 34.733 103.137 1.00 0.00 H ATOM 538 H62 DA D 431 -23.837 34.642 102.403 1.00 0.00 H ATOM 539 P DT D 432 -22.747 38.779 112.443 1.00 33.03 P ATOM 540 OP1 DT D 432 -22.984 39.891 113.399 1.00 37.71 O ATOM 541 OP2 DT D 432 -21.644 37.822 112.667 1.00 34.78 O ATOM 542 O5' DT D 432 -24.113 38.004 112.254 1.00 33.68 O ATOM 543 C5' DT D 432 -25.193 38.688 111.623 1.00 34.77 C ATOM 544 C4' DT D 432 -26.258 37.718 111.184 1.00 25.30 C ATOM 545 O4' DT D 432 -25.949 37.071 109.929 1.00 27.20 O ATOM 546 C3' DT D 432 -26.601 36.631 112.190 1.00 19.01 C ATOM 547 O3' DT D 432 -27.997 36.684 112.436 1.00 22.68 O ATOM 548 C2' DT D 432 -26.197 35.353 111.475 1.00 23.67 C ATOM 549 C1' DT D 432 -26.335 35.708 110.000 1.00 20.58 C ATOM 550 N1 DT D 432 -25.508 34.927 109.015 1.00 19.66 N ATOM 551 C2 DT D 432 -26.133 34.448 107.858 1.00 23.11 C ATOM 552 O2 DT D 432 -27.323 34.615 107.599 1.00 26.08 O ATOM 553 N3 DT D 432 -25.305 33.760 107.004 1.00 21.70 N ATOM 554 C4 DT D 432 -23.959 33.501 107.172 1.00 24.90 C ATOM 555 O4 DT D 432 -23.340 32.890 106.303 1.00 34.25 O ATOM 556 C5 DT D 432 -23.375 34.006 108.389 1.00 22.63 C ATOM 557 C7 DT D 432 -21.922 33.742 108.643 1.00 20.95 C ATOM 558 C6 DT D 432 -24.162 34.691 109.240 1.00 18.86 C ATOM 559 H3 DT D 432 -25.724 33.425 106.148 1.00 0.00 H ATOM 560 P DC D 433 -28.567 36.177 113.832 1.00 23.03 P ATOM 561 OP1 DC D 433 -29.700 37.052 114.169 1.00 27.56 O ATOM 562 OP2 DC D 433 -27.456 36.037 114.782 1.00 25.27 O ATOM 563 O5' DC D 433 -29.168 34.758 113.459 1.00 23.97 O ATOM 564 C5' DC D 433 -30.439 34.676 112.802 1.00 20.62 C ATOM 565 C4' DC D 433 -30.571 33.391 112.015 1.00 17.70 C ATOM 566 O4' DC D 433 -29.626 33.350 110.935 1.00 18.53 O ATOM 567 C3' DC D 433 -30.377 32.060 112.722 1.00 12.43 C ATOM 568 O3' DC D 433 -31.597 31.651 113.355 1.00 21.99 O ATOM 569 C2' DC D 433 -30.170 31.124 111.548 1.00 18.37 C ATOM 570 C1' DC D 433 -29.610 32.017 110.435 1.00 18.07 C ATOM 571 N1 DC D 433 -28.245 31.684 109.996 1.00 13.95 N ATOM 572 C2 DC D 433 -28.063 31.099 108.726 1.00 17.21 C ATOM 573 O2 DC D 433 -29.065 30.892 108.008 1.00 20.60 O ATOM 574 N3 DC D 433 -26.809 30.764 108.319 1.00 17.71 N ATOM 575 C4 DC D 433 -25.766 30.969 109.134 1.00 18.08 C ATOM 576 N4 DC D 433 -24.549 30.586 108.726 1.00 16.60 N ATOM 577 C5 DC D 433 -25.921 31.564 110.418 1.00 21.35 C ATOM 578 C6 DC D 433 -27.169 31.917 110.803 1.00 21.10 C ATOM 579 HO3' DC D 433 -32.263 31.545 112.672 1.00 0.00 H ATOM 580 H41 DC D 433 -23.762 30.704 109.352 1.00 0.00 H ATOM 581 H42 DC D 433 -24.408 30.185 107.806 1.00 0.00 H TER 582 DC D 433 ATOM 583 N MET A 1 -30.270 32.506 71.805 1.00 24.10 N ATOM 584 CA MET A 1 -29.315 32.327 70.685 1.00 24.68 C ATOM 585 C MET A 1 -30.061 32.365 69.377 1.00 26.67 C ATOM 586 O MET A 1 -31.284 32.430 69.383 1.00 31.41 O ATOM 587 CB MET A 1 -28.579 31.014 70.826 1.00 25.38 C ATOM 588 CG MET A 1 -29.458 29.804 71.002 1.00 16.52 C ATOM 589 SD MET A 1 -28.391 28.388 71.272 1.00 20.84 S ATOM 590 CE MET A 1 -27.201 28.632 70.001 1.00 15.52 C ATOM 591 H1 MET A 1 -31.080 31.876 71.641 1.00 0.00 H ATOM 592 H2 MET A 1 -30.671 33.465 71.798 1.00 0.00 H ATOM 593 H3 MET A 1 -29.815 32.295 72.719 1.00 0.00 H ATOM 594 N ILE A 2 -29.334 32.321 68.266 1.00 23.93 N ATOM 595 CA ILE A 2 -29.946 32.369 66.955 1.00 20.91 C ATOM 596 C ILE A 2 -29.487 31.186 66.149 1.00 22.36 C ATOM 597 O ILE A 2 -28.463 30.588 66.448 1.00 19.33 O ATOM 598 CB ILE A 2 -29.525 33.625 66.212 1.00 17.89 C ATOM 599 CG1 ILE A 2 -28.019 33.618 65.973 1.00 16.33 C ATOM 600 CG2 ILE A 2 -29.890 34.840 67.010 1.00 19.12 C ATOM 601 CD1 ILE A 2 -27.571 34.733 65.062 1.00 12.38 C ATOM 602 H ILE A 2 -28.354 32.243 68.282 1.00 0.00 H ATOM 603 N GLU A 3 -30.227 30.830 65.117 1.00 31.29 N ATOM 604 CA GLU A 3 -29.786 29.698 64.311 1.00 40.40 C ATOM 605 C GLU A 3 -28.744 30.200 63.322 1.00 39.21 C ATOM 606 O GLU A 3 -28.864 31.287 62.778 1.00 39.41 O ATOM 607 CB GLU A 3 -30.943 29.022 63.564 1.00 48.61 C ATOM 608 CG GLU A 3 -30.663 27.533 63.221 1.00 58.78 C ATOM 609 CD GLU A 3 -31.646 26.916 62.210 1.00 67.66 C ATOM 610 OE1 GLU A 3 -31.273 25.904 61.566 1.00 69.65 O ATOM 611 OE2 GLU A 3 -32.784 27.428 62.057 1.00 70.28 O ATOM 612 H GLU A 3 -31.043 31.368 64.920 1.00 0.00 H ATOM 613 N ILE A 4 -27.713 29.405 63.099 1.00 39.78 N ATOM 614 CA ILE A 4 -26.643 29.769 62.180 1.00 39.78 C ATOM 615 C ILE A 4 -26.593 28.701 61.105 1.00 40.25 C ATOM 616 O ILE A 4 -26.086 27.613 61.347 1.00 44.82 O ATOM 617 CB ILE A 4 -25.301 29.836 62.958 1.00 35.16 C ATOM 618 CG1 ILE A 4 -25.272 31.130 63.776 1.00 36.93 C ATOM 619 CG2 ILE A 4 -24.098 29.678 62.030 1.00 34.26 C ATOM 620 CD1 ILE A 4 -24.102 31.255 64.701 1.00 38.63 C ATOM 621 H ILE A 4 -27.648 28.535 63.539 1.00 0.00 H ATOM 622 N LYS A 5 -27.139 28.979 59.928 1.00 43.21 N ATOM 623 CA LYS A 5 -27.120 27.955 58.874 1.00 47.59 C ATOM 624 C LYS A 5 -25.810 27.713 58.098 1.00 45.43 C ATOM 625 O LYS A 5 -25.570 26.592 57.651 1.00 47.30 O ATOM 626 CB LYS A 5 -28.358 28.038 57.959 1.00 52.63 C ATOM 627 CG LYS A 5 -29.585 27.311 58.567 1.00 61.07 C ATOM 628 CD LYS A 5 -30.783 27.153 57.613 1.00 63.39 C ATOM 629 CE LYS A 5 -31.886 26.289 58.251 1.00 64.46 C ATOM 630 NZ LYS A 5 -33.090 26.152 57.388 1.00 65.70 N ATOM 631 H LYS A 5 -27.538 29.870 59.821 1.00 0.00 H ATOM 632 HZ1 LYS A 5 -32.800 25.734 56.478 1.00 0.00 H ATOM 633 HZ2 LYS A 5 -33.472 27.099 57.203 1.00 0.00 H ATOM 634 HZ3 LYS A 5 -33.820 25.557 57.822 1.00 0.00 H ATOM 635 N ASP A 6 -24.971 28.735 57.918 1.00 45.20 N ATOM 636 CA ASP A 6 -23.683 28.524 57.248 1.00 43.36 C ATOM 637 C ASP A 6 -22.708 28.329 58.395 1.00 38.24 C ATOM 638 O ASP A 6 -22.150 29.272 58.940 1.00 41.66 O ATOM 639 CB ASP A 6 -23.286 29.707 56.353 1.00 51.54 C ATOM 640 CG ASP A 6 -23.924 29.629 54.960 1.00 62.21 C ATOM 641 OD1 ASP A 6 -23.581 28.705 54.179 1.00 65.06 O ATOM 642 OD2 ASP A 6 -24.776 30.490 54.644 1.00 69.91 O ATOM 643 H ASP A 6 -25.186 29.625 58.263 1.00 0.00 H ATOM 644 N LYS A 7 -22.609 27.085 58.822 1.00 32.90 N ATOM 645 CA LYS A 7 -21.778 26.692 59.939 1.00 27.38 C ATOM 646 C LYS A 7 -20.307 26.862 59.634 1.00 29.74 C ATOM 647 O LYS A 7 -19.712 26.087 58.902 1.00 32.18 O ATOM 648 CB LYS A 7 -22.133 25.266 60.304 1.00 21.87 C ATOM 649 CG LYS A 7 -23.643 25.121 60.405 1.00 21.30 C ATOM 650 CD LYS A 7 -24.063 24.429 61.658 1.00 26.10 C ATOM 651 CE LYS A 7 -25.483 24.766 62.038 1.00 22.00 C ATOM 652 NZ LYS A 7 -25.805 23.920 63.221 1.00 37.82 N ATOM 653 H LYS A 7 -23.117 26.395 58.336 1.00 0.00 H ATOM 654 HZ1 LYS A 7 -25.092 24.076 63.970 1.00 0.00 H ATOM 655 HZ2 LYS A 7 -25.730 22.925 62.917 1.00 0.00 H ATOM 656 HZ3 LYS A 7 -26.751 24.089 63.616 1.00 0.00 H ATOM 657 N GLN A 8 -19.720 27.896 60.210 1.00 28.63 N ATOM 658 CA GLN A 8 -18.333 28.192 59.958 1.00 25.53 C ATOM 659 C GLN A 8 -17.330 27.348 60.689 1.00 23.66 C ATOM 660 O GLN A 8 -16.212 27.222 60.223 1.00 27.71 O ATOM 661 CB GLN A 8 -18.051 29.648 60.274 1.00 24.92 C ATOM 662 CG GLN A 8 -18.806 30.617 59.409 1.00 24.67 C ATOM 663 CD GLN A 8 -18.457 30.480 57.961 1.00 23.21 C ATOM 664 OE1 GLN A 8 -17.316 30.707 57.560 1.00 24.26 O ATOM 665 NE2 GLN A 8 -19.431 30.080 57.158 1.00 29.11 N ATOM 666 H GLN A 8 -20.277 28.463 60.780 1.00 0.00 H ATOM 667 HE21 GLN A 8 -20.284 29.880 57.572 1.00 0.00 H ATOM 668 HE22 GLN A 8 -19.278 30.027 56.181 1.00 0.00 H ATOM 669 N LEU A 9 -17.706 26.743 61.804 1.00 22.37 N ATOM 670 CA LEU A 9 -16.725 25.980 62.570 1.00 22.41 C ATOM 671 C LEU A 9 -16.849 24.479 62.464 1.00 23.18 C ATOM 672 O LEU A 9 -16.251 23.752 63.235 1.00 20.89 O ATOM 673 CB LEU A 9 -16.797 26.391 64.037 1.00 18.53 C ATOM 674 CG LEU A 9 -16.809 27.879 64.361 1.00 15.48 C ATOM 675 CD1 LEU A 9 -16.910 28.075 65.851 1.00 9.61 C ATOM 676 CD2 LEU A 9 -15.546 28.509 63.841 1.00 16.63 C ATOM 677 H LEU A 9 -18.636 26.797 62.099 1.00 0.00 H ATOM 678 N THR A 10 -17.488 24.025 61.405 1.00 30.31 N ATOM 679 CA THR A 10 -17.766 22.606 61.194 1.00 35.61 C ATOM 680 C THR A 10 -16.757 21.505 61.530 1.00 37.17 C ATOM 681 O THR A 10 -17.116 20.515 62.176 1.00 44.37 O ATOM 682 CB THR A 10 -18.340 22.350 59.782 1.00 36.75 C ATOM 683 OG1 THR A 10 -19.284 23.379 59.445 1.00 39.60 O ATOM 684 CG2 THR A 10 -19.077 21.035 59.755 1.00 35.28 C ATOM 685 H THR A 10 -17.796 24.649 60.731 1.00 0.00 H ATOM 686 HG1 THR A 10 -18.931 24.246 59.205 1.00 0.00 H ATOM 687 N GLY A 11 -15.513 21.622 61.104 1.00 33.94 N ATOM 688 CA GLY A 11 -14.616 20.523 61.419 1.00 33.15 C ATOM 689 C GLY A 11 -13.773 20.669 62.665 1.00 35.10 C ATOM 690 O GLY A 11 -13.074 19.736 63.065 1.00 37.73 O ATOM 691 H GLY A 11 -15.215 22.398 60.599 1.00 0.00 H ATOM 692 N LEU A 12 -13.907 21.818 63.314 1.00 33.38 N ATOM 693 CA LEU A 12 -13.119 22.184 64.480 1.00 26.73 C ATOM 694 C LEU A 12 -13.509 21.573 65.817 1.00 23.92 C ATOM 695 O LEU A 12 -14.675 21.353 66.080 1.00 27.89 O ATOM 696 CB LEU A 12 -13.117 23.708 64.564 1.00 26.46 C ATOM 697 CG LEU A 12 -12.874 24.295 63.173 1.00 18.86 C ATOM 698 CD1 LEU A 12 -13.133 25.767 63.129 1.00 27.36 C ATOM 699 CD2 LEU A 12 -11.461 24.002 62.764 1.00 23.46 C ATOM 700 H LEU A 12 -14.623 22.425 63.030 1.00 0.00 H ATOM 701 N ARG A 13 -12.505 21.307 66.650 1.00 24.37 N ATOM 702 CA ARG A 13 -12.664 20.742 68.004 1.00 24.60 C ATOM 703 C ARG A 13 -12.355 21.889 68.975 1.00 21.09 C ATOM 704 O ARG A 13 -11.481 22.712 68.690 1.00 19.79 O ATOM 705 CB ARG A 13 -11.644 19.605 68.268 1.00 28.06 C ATOM 706 CG ARG A 13 -11.895 18.236 67.580 1.00 32.51 C ATOM 707 CD ARG A 13 -10.698 17.218 67.717 1.00 33.71 C ATOM 708 NE ARG A 13 -10.593 16.585 69.036 1.00 40.24 N ATOM 709 CZ ARG A 13 -9.792 15.563 69.334 1.00 42.12 C ATOM 710 NH1 ARG A 13 -9.002 15.042 68.406 1.00 51.59 N ATOM 711 NH2 ARG A 13 -9.809 15.028 70.552 1.00 40.14 N ATOM 712 H ARG A 13 -11.606 21.533 66.355 1.00 0.00 H ATOM 713 HE ARG A 13 -11.141 16.947 69.759 1.00 0.00 H ATOM 714 HH11 ARG A 13 -9.023 15.408 67.473 1.00 0.00 H ATOM 715 HH12 ARG A 13 -8.411 14.265 68.616 1.00 0.00 H ATOM 716 HH21 ARG A 13 -10.428 15.384 71.252 1.00 0.00 H ATOM 717 HH22 ARG A 13 -9.210 14.255 70.755 1.00 0.00 H ATOM 718 N PHE A 14 -13.021 21.918 70.127 1.00 17.60 N ATOM 719 CA PHE A 14 -12.791 22.966 71.101 1.00 15.46 C ATOM 720 C PHE A 14 -12.973 22.472 72.518 1.00 13.41 C ATOM 721 O PHE A 14 -13.645 21.475 72.739 1.00 16.20 O ATOM 722 CB PHE A 14 -13.713 24.162 70.820 1.00 16.25 C ATOM 723 CG PHE A 14 -15.148 23.961 71.235 1.00 9.05 C ATOM 724 CD1 PHE A 14 -15.561 24.286 72.506 1.00 11.10 C ATOM 725 CD2 PHE A 14 -16.091 23.514 70.334 1.00 10.99 C ATOM 726 CE1 PHE A 14 -16.891 24.174 72.876 1.00 7.54 C ATOM 727 CE2 PHE A 14 -17.435 23.396 70.698 1.00 5.04 C ATOM 728 CZ PHE A 14 -17.826 23.726 71.959 1.00 12.68 C ATOM 729 H PHE A 14 -13.691 21.234 70.343 1.00 0.00 H ATOM 730 N ILE A 15 -12.295 23.120 73.465 1.00 16.82 N ATOM 731 CA ILE A 15 -12.402 22.760 74.884 1.00 15.38 C ATOM 732 C ILE A 15 -13.130 23.863 75.658 1.00 13.92 C ATOM 733 O ILE A 15 -12.944 25.057 75.402 1.00 13.22 O ATOM 734 CB ILE A 15 -11.028 22.471 75.552 1.00 18.08 C ATOM 735 CG1 ILE A 15 -10.140 23.716 75.509 1.00 18.65 C ATOM 736 CG2 ILE A 15 -10.395 21.191 74.952 1.00 10.21 C ATOM 737 CD1 ILE A 15 -8.930 23.627 76.380 1.00 16.25 C ATOM 738 H ILE A 15 -11.758 23.896 73.215 1.00 0.00 H ATOM 739 N ASP A 16 -13.938 23.441 76.621 1.00 11.57 N ATOM 740 CA ASP A 16 -14.750 24.336 77.423 1.00 13.28 C ATOM 741 C ASP A 16 -14.109 24.540 78.788 1.00 16.18 C ATOM 742 O ASP A 16 -14.394 23.806 79.736 1.00 17.45 O ATOM 743 CB ASP A 16 -16.118 23.679 77.580 1.00 15.37 C ATOM 744 CG ASP A 16 -17.250 24.659 77.706 1.00 15.51 C ATOM 745 OD1 ASP A 16 -18.400 24.181 77.838 1.00 12.82 O ATOM 746 OD2 ASP A 16 -17.011 25.876 77.672 1.00 16.25 O ATOM 747 H ASP A 16 -13.993 22.485 76.810 1.00 0.00 H ATOM 748 N LEU A 17 -13.178 25.476 78.882 1.00 18.65 N ATOM 749 CA LEU A 17 -12.539 25.724 80.168 1.00 16.33 C ATOM 750 C LEU A 17 -13.498 26.567 80.997 1.00 14.29 C ATOM 751 O LEU A 17 -14.239 27.360 80.450 1.00 18.89 O ATOM 752 CB LEU A 17 -11.184 26.419 79.987 1.00 11.64 C ATOM 753 CG LEU A 17 -10.110 25.562 79.330 1.00 11.86 C ATOM 754 CD1 LEU A 17 -8.776 26.254 79.449 1.00 15.09 C ATOM 755 CD2 LEU A 17 -10.054 24.222 80.007 1.00 7.55 C ATOM 756 H LEU A 17 -12.960 26.028 78.099 1.00 0.00 H ATOM 757 N PHE A 18 -13.543 26.338 82.299 1.00 10.14 N ATOM 758 CA PHE A 18 -14.433 27.094 83.169 1.00 14.96 C ATOM 759 C PHE A 18 -15.834 27.060 82.592 1.00 17.00 C ATOM 760 O PHE A 18 -16.537 28.054 82.589 1.00 19.37 O ATOM 761 CB PHE A 18 -13.969 28.541 83.291 1.00 13.45 C ATOM 762 CG PHE A 18 -12.526 28.670 83.609 1.00 12.90 C ATOM 763 CD1 PHE A 18 -11.617 28.970 82.621 1.00 12.05 C ATOM 764 CD2 PHE A 18 -12.064 28.416 84.879 1.00 9.99 C ATOM 765 CE1 PHE A 18 -10.281 29.006 82.892 1.00 12.72 C ATOM 766 CE2 PHE A 18 -10.723 28.452 85.156 1.00 10.15 C ATOM 767 CZ PHE A 18 -9.832 28.743 84.164 1.00 13.28 C ATOM 768 H PHE A 18 -13.056 25.563 82.666 1.00 0.00 H ATOM 769 N ALA A 19 -16.228 25.884 82.136 1.00 17.52 N ATOM 770 CA ALA A 19 -17.508 25.653 81.515 1.00 12.29 C ATOM 771 C ALA A 19 -18.701 26.408 82.081 1.00 13.12 C ATOM 772 O ALA A 19 -19.522 26.921 81.331 1.00 20.78 O ATOM 773 CB ALA A 19 -17.775 24.191 81.511 1.00 3.58 C ATOM 774 H ALA A 19 -15.593 25.141 82.193 1.00 0.00 H ATOM 775 N GLY A 20 -18.812 26.464 83.399 1.00 13.45 N ATOM 776 CA GLY A 20 -19.947 27.126 84.010 1.00 9.81 C ATOM 777 C GLY A 20 -21.232 26.457 83.538 1.00 11.77 C ATOM 778 O GLY A 20 -21.424 25.274 83.767 1.00 14.52 O ATOM 779 H GLY A 20 -18.093 26.006 83.850 1.00 0.00 H ATOM 780 N LEU A 21 -22.123 27.209 82.901 1.00 16.89 N ATOM 781 CA LEU A 21 -23.390 26.668 82.401 1.00 15.09 C ATOM 782 C LEU A 21 -23.204 26.065 81.040 1.00 16.05 C ATOM 783 O LEU A 21 -24.113 25.428 80.509 1.00 17.77 O ATOM 784 CB LEU A 21 -24.437 27.764 82.248 1.00 11.48 C ATOM 785 CG LEU A 21 -25.169 28.338 83.450 1.00 6.64 C ATOM 786 CD1 LEU A 21 -26.052 29.434 82.950 1.00 2.78 C ATOM 787 CD2 LEU A 21 -26.008 27.279 84.117 1.00 15.17 C ATOM 788 H LEU A 21 -21.935 28.169 82.736 1.00 0.00 H ATOM 789 N GLY A 22 -22.059 26.348 80.438 1.00 17.23 N ATOM 790 CA GLY A 22 -21.773 25.829 79.117 1.00 19.42 C ATOM 791 C GLY A 22 -22.113 26.770 77.978 1.00 18.92 C ATOM 792 O GLY A 22 -22.161 26.353 76.816 1.00 20.48 O ATOM 793 H GLY A 22 -21.415 26.938 80.891 1.00 0.00 H ATOM 794 N GLY A 23 -22.309 28.047 78.288 1.00 19.92 N ATOM 795 CA GLY A 23 -22.625 29.005 77.250 1.00 18.58 C ATOM 796 C GLY A 23 -21.628 28.997 76.099 1.00 17.86 C ATOM 797 O GLY A 23 -21.978 29.262 74.962 1.00 21.08 O ATOM 798 H GLY A 23 -22.238 28.373 79.214 1.00 0.00 H ATOM 799 N PHE A 24 -20.373 28.705 76.377 1.00 17.35 N ATOM 800 CA PHE A 24 -19.395 28.699 75.311 1.00 18.27 C ATOM 801 C PHE A 24 -19.637 27.525 74.409 1.00 19.26 C ATOM 802 O PHE A 24 -19.430 27.601 73.195 1.00 23.34 O ATOM 803 CB PHE A 24 -17.970 28.652 75.855 1.00 17.26 C ATOM 804 CG PHE A 24 -17.277 29.972 75.838 1.00 9.96 C ATOM 805 CD1 PHE A 24 -17.344 30.809 76.922 1.00 8.20 C ATOM 806 CD2 PHE A 24 -16.570 30.385 74.725 1.00 12.92 C ATOM 807 CE1 PHE A 24 -16.721 32.043 76.904 1.00 5.53 C ATOM 808 CE2 PHE A 24 -15.942 31.619 74.702 1.00 10.14 C ATOM 809 CZ PHE A 24 -16.016 32.446 75.785 1.00 3.90 C ATOM 810 H PHE A 24 -20.175 28.504 77.320 1.00 0.00 H ATOM 811 N ARG A 25 -20.145 26.454 74.985 1.00 17.26 N ATOM 812 CA ARG A 25 -20.405 25.283 74.195 1.00 19.40 C ATOM 813 C ARG A 25 -21.612 25.488 73.268 1.00 18.12 C ATOM 814 O ARG A 25 -21.574 25.137 72.092 1.00 19.06 O ATOM 815 CB ARG A 25 -20.612 24.074 75.093 1.00 21.55 C ATOM 816 CG ARG A 25 -20.440 22.795 74.329 1.00 25.77 C ATOM 817 CD ARG A 25 -21.374 21.769 74.811 1.00 23.74 C ATOM 818 NE ARG A 25 -20.733 20.904 75.773 1.00 29.79 N ATOM 819 CZ ARG A 25 -20.517 19.611 75.580 1.00 24.21 C ATOM 820 NH1 ARG A 25 -20.886 19.029 74.463 1.00 24.46 N ATOM 821 NH2 ARG A 25 -19.969 18.892 76.534 1.00 29.74 N ATOM 822 H ARG A 25 -20.358 26.455 75.943 1.00 0.00 H ATOM 823 HE ARG A 25 -20.446 21.291 76.629 1.00 0.00 H ATOM 824 HH11 ARG A 25 -21.368 19.534 73.758 1.00 0.00 H ATOM 825 HH12 ARG A 25 -20.713 18.050 74.344 1.00 0.00 H ATOM 826 HH21 ARG A 25 -19.813 17.923 76.352 1.00 0.00 H ATOM 827 HH22 ARG A 25 -19.708 19.294 77.413 1.00 0.00 H ATOM 828 N LEU A 26 -22.683 26.064 73.788 1.00 16.18 N ATOM 829 CA LEU A 26 -23.852 26.301 72.969 1.00 12.61 C ATOM 830 C LEU A 26 -23.510 27.128 71.745 1.00 16.49 C ATOM 831 O LEU A 26 -23.919 26.805 70.623 1.00 22.79 O ATOM 832 CB LEU A 26 -24.932 27.006 73.781 1.00 10.85 C ATOM 833 CG LEU A 26 -25.692 26.137 74.789 1.00 15.86 C ATOM 834 CD1 LEU A 26 -26.582 27.019 75.641 1.00 12.70 C ATOM 835 CD2 LEU A 26 -26.529 25.087 74.051 1.00 13.40 C ATOM 836 H LEU A 26 -22.677 26.304 74.742 1.00 0.00 H ATOM 837 N ALA A 27 -22.761 28.203 71.959 1.00 19.50 N ATOM 838 CA ALA A 27 -22.362 29.099 70.882 1.00 15.90 C ATOM 839 C ALA A 27 -21.523 28.415 69.814 1.00 17.47 C ATOM 840 O ALA A 27 -21.921 28.369 68.657 1.00 19.94 O ATOM 841 CB ALA A 27 -21.631 30.261 71.441 1.00 16.14 C ATOM 842 H ALA A 27 -22.470 28.410 72.876 1.00 0.00 H ATOM 843 N LEU A 28 -20.376 27.860 70.181 1.00 16.16 N ATOM 844 CA LEU A 28 -19.547 27.216 69.175 1.00 14.19 C ATOM 845 C LEU A 28 -20.277 26.044 68.531 1.00 16.99 C ATOM 846 O LEU A 28 -20.129 25.833 67.334 1.00 20.73 O ATOM 847 CB LEU A 28 -18.224 26.733 69.743 1.00 10.29 C ATOM 848 CG LEU A 28 -17.252 27.665 70.461 1.00 10.83 C ATOM 849 CD1 LEU A 28 -15.904 27.449 69.843 1.00 11.82 C ATOM 850 CD2 LEU A 28 -17.640 29.101 70.366 1.00 15.77 C ATOM 851 H LEU A 28 -20.079 27.865 71.117 1.00 0.00 H ATOM 852 N GLU A 29 -21.064 25.288 69.298 1.00 13.35 N ATOM 853 CA GLU A 29 -21.796 24.156 68.727 1.00 13.90 C ATOM 854 C GLU A 29 -22.794 24.606 67.697 1.00 15.90 C ATOM 855 O GLU A 29 -23.019 23.925 66.716 1.00 20.85 O ATOM 856 CB GLU A 29 -22.506 23.315 69.780 1.00 13.57 C ATOM 857 CG GLU A 29 -21.701 22.100 70.194 1.00 18.38 C ATOM 858 CD GLU A 29 -22.335 21.291 71.318 1.00 23.16 C ATOM 859 OE1 GLU A 29 -23.569 21.375 71.505 1.00 25.21 O ATOM 860 OE2 GLU A 29 -21.596 20.553 72.011 1.00 19.83 O ATOM 861 H GLU A 29 -21.140 25.477 70.257 1.00 0.00 H ATOM 862 N SER A 30 -23.392 25.763 67.897 1.00 16.05 N ATOM 863 CA SER A 30 -24.342 26.231 66.914 1.00 16.32 C ATOM 864 C SER A 30 -23.623 26.628 65.621 1.00 20.22 C ATOM 865 O SER A 30 -24.265 26.787 64.590 1.00 23.49 O ATOM 866 CB SER A 30 -25.176 27.385 67.464 1.00 12.09 C ATOM 867 OG SER A 30 -24.430 28.577 67.536 1.00 15.95 O ATOM 868 H SER A 30 -23.231 26.297 68.700 1.00 0.00 H ATOM 869 HG SER A 30 -23.602 28.442 68.004 1.00 0.00 H ATOM 870 N CYS A 31 -22.306 26.835 65.679 1.00 21.79 N ATOM 871 CA CYS A 31 -21.537 27.172 64.477 1.00 23.57 C ATOM 872 C CYS A 31 -20.942 25.925 63.820 1.00 26.11 C ATOM 873 O CYS A 31 -20.134 26.027 62.887 1.00 32.02 O ATOM 874 CB CYS A 31 -20.418 28.154 64.789 1.00 18.41 C ATOM 875 SG CYS A 31 -20.984 29.827 64.873 1.00 23.81 S ATOM 876 H CYS A 31 -21.823 26.810 66.532 1.00 0.00 H ATOM 877 N GLY A 32 -21.292 24.754 64.344 1.00 26.65 N ATOM 878 CA GLY A 32 -20.804 23.516 63.783 1.00 20.53 C ATOM 879 C GLY A 32 -19.634 22.859 64.495 1.00 27.89 C ATOM 880 O GLY A 32 -19.339 21.694 64.215 1.00 30.86 O ATOM 881 H GLY A 32 -21.892 24.696 65.112 1.00 0.00 H ATOM 882 N ALA A 33 -18.978 23.561 65.423 1.00 27.29 N ATOM 883 CA ALA A 33 -17.812 22.996 66.113 1.00 24.41 C ATOM 884 C ALA A 33 -18.138 21.817 67.038 1.00 25.84 C ATOM 885 O ALA A 33 -19.315 21.525 67.285 1.00 27.87 O ATOM 886 CB ALA A 33 -17.065 24.083 66.852 1.00 20.46 C ATOM 887 H ALA A 33 -19.293 24.446 65.672 1.00 0.00 H ATOM 888 N GLU A 34 -17.101 21.147 67.557 1.00 29.24 N ATOM 889 CA GLU A 34 -17.260 19.983 68.451 1.00 25.49 C ATOM 890 C GLU A 34 -16.524 20.115 69.790 1.00 22.91 C ATOM 891 O GLU A 34 -15.342 20.448 69.806 1.00 24.69 O ATOM 892 CB GLU A 34 -16.779 18.714 67.745 1.00 28.48 C ATOM 893 CG GLU A 34 -16.965 17.441 68.556 1.00 35.41 C ATOM 894 CD GLU A 34 -16.305 16.234 67.925 1.00 37.66 C ATOM 895 OE1 GLU A 34 -15.738 15.411 68.676 1.00 39.16 O ATOM 896 OE2 GLU A 34 -16.356 16.103 66.683 1.00 45.81 O ATOM 897 H GLU A 34 -16.198 21.433 67.319 1.00 0.00 H ATOM 898 N CYS A 35 -17.225 19.860 70.902 1.00 23.58 N ATOM 899 CA CYS A 35 -16.629 19.949 72.234 1.00 19.15 C ATOM 900 C CYS A 35 -16.022 18.618 72.623 1.00 21.46 C ATOM 901 O CYS A 35 -16.712 17.603 72.714 1.00 22.48 O ATOM 902 CB CYS A 35 -17.634 20.379 73.288 1.00 14.04 C ATOM 903 SG CYS A 35 -16.810 20.680 74.863 1.00 23.67 S ATOM 904 H CYS A 35 -18.155 19.583 70.793 1.00 0.00 H ATOM 905 N VAL A 36 -14.729 18.628 72.893 1.00 20.48 N ATOM 906 CA VAL A 36 -14.040 17.401 73.233 1.00 18.59 C ATOM 907 C VAL A 36 -13.529 17.347 74.667 1.00 21.33 C ATOM 908 O VAL A 36 -12.855 16.387 75.052 1.00 24.07 O ATOM 909 CB VAL A 36 -12.871 17.187 72.259 1.00 17.47 C ATOM 910 CG1 VAL A 36 -13.393 16.805 70.902 1.00 13.45 C ATOM 911 CG2 VAL A 36 -12.074 18.460 72.122 1.00 20.92 C ATOM 912 H VAL A 36 -14.255 19.491 72.869 1.00 0.00 H ATOM 913 N TYR A 37 -13.908 18.335 75.469 1.00 21.02 N ATOM 914 CA TYR A 37 -13.455 18.423 76.842 1.00 19.20 C ATOM 915 C TYR A 37 -14.114 19.596 77.541 1.00 24.29 C ATOM 916 O TYR A 37 -14.296 20.668 76.960 1.00 30.98 O ATOM 917 CB TYR A 37 -11.958 18.667 76.838 1.00 17.82 C ATOM 918 CG TYR A 37 -11.366 18.850 78.197 1.00 22.70 C ATOM 919 CD1 TYR A 37 -11.295 17.776 79.097 1.00 25.49 C ATOM 920 CD2 TYR A 37 -10.857 20.082 78.597 1.00 20.30 C ATOM 921 CE1 TYR A 37 -10.725 17.929 80.377 1.00 20.76 C ATOM 922 CE2 TYR A 37 -10.284 20.245 79.872 1.00 19.61 C ATOM 923 CZ TYR A 37 -10.226 19.162 80.747 1.00 18.79 C ATOM 924 OH TYR A 37 -9.679 19.308 81.995 1.00 21.86 O ATOM 925 H TYR A 37 -14.505 19.039 75.140 1.00 0.00 H ATOM 926 HH TYR A 37 -9.654 18.438 82.387 1.00 0.00 H ATOM 927 N SER A 38 -14.431 19.421 78.808 1.00 22.86 N ATOM 928 CA SER A 38 -15.016 20.502 79.544 1.00 19.23 C ATOM 929 C SER A 38 -14.357 20.476 80.888 1.00 19.69 C ATOM 930 O SER A 38 -13.876 19.430 81.314 1.00 18.26 O ATOM 931 CB SER A 38 -16.535 20.348 79.642 1.00 20.80 C ATOM 932 OG SER A 38 -16.930 19.005 79.839 1.00 26.81 O ATOM 933 H SER A 38 -14.229 18.578 79.265 1.00 0.00 H ATOM 934 HG SER A 38 -17.116 18.681 78.949 1.00 0.00 H ATOM 935 N ASN A 39 -14.209 21.647 81.489 1.00 16.44 N ATOM 936 CA ASN A 39 -13.618 21.754 82.798 1.00 17.37 C ATOM 937 C ASN A 39 -14.388 22.803 83.591 1.00 18.65 C ATOM 938 O ASN A 39 -14.629 23.905 83.121 1.00 23.22 O ATOM 939 CB ASN A 39 -12.145 22.128 82.706 1.00 16.19 C ATOM 940 CG ASN A 39 -11.478 22.110 84.038 1.00 12.81 C ATOM 941 OD1 ASN A 39 -11.549 23.072 84.795 1.00 20.39 O ATOM 942 ND2 ASN A 39 -10.826 21.015 84.344 1.00 12.97 N ATOM 943 H ASN A 39 -14.506 22.486 81.078 1.00 0.00 H ATOM 944 HD21 ASN A 39 -10.784 20.303 83.678 1.00 0.00 H ATOM 945 HD22 ASN A 39 -10.396 20.988 85.229 1.00 0.00 H ATOM 946 N GLU A 40 -14.778 22.443 84.801 1.00 19.26 N ATOM 947 CA GLU A 40 -15.543 23.323 85.659 1.00 17.97 C ATOM 948 C GLU A 40 -15.539 22.636 87.008 1.00 17.17 C ATOM 949 O GLU A 40 -15.878 21.474 87.066 1.00 17.64 O ATOM 950 CB GLU A 40 -16.963 23.408 85.117 1.00 11.18 C ATOM 951 CG GLU A 40 -17.937 23.956 86.079 1.00 6.52 C ATOM 952 CD GLU A 40 -17.574 25.325 86.517 1.00 10.63 C ATOM 953 OE1 GLU A 40 -17.710 26.237 85.698 1.00 16.16 O ATOM 954 OE2 GLU A 40 -17.163 25.506 87.682 1.00 17.58 O ATOM 955 H GLU A 40 -14.529 21.562 85.170 1.00 0.00 H ATOM 956 N TRP A 41 -15.201 23.339 88.092 1.00 19.18 N ATOM 957 CA TRP A 41 -15.139 22.694 89.423 1.00 17.46 C ATOM 958 C TRP A 41 -16.301 22.760 90.387 1.00 18.14 C ATOM 959 O TRP A 41 -16.278 22.064 91.405 1.00 17.96 O ATOM 960 CB TRP A 41 -13.891 23.127 90.192 1.00 21.45 C ATOM 961 CG TRP A 41 -13.904 24.521 90.775 1.00 20.89 C ATOM 962 CD1 TRP A 41 -14.867 25.486 90.626 1.00 26.24 C ATOM 963 CD2 TRP A 41 -12.900 25.089 91.614 1.00 19.83 C ATOM 964 NE1 TRP A 41 -14.518 26.616 91.327 1.00 24.78 N ATOM 965 CE2 TRP A 41 -13.313 26.398 91.942 1.00 22.41 C ATOM 966 CE3 TRP A 41 -11.681 24.620 92.120 1.00 19.96 C ATOM 967 CZ2 TRP A 41 -12.557 27.237 92.761 1.00 23.07 C ATOM 968 CZ3 TRP A 41 -10.929 25.450 92.932 1.00 19.10 C ATOM 969 CH2 TRP A 41 -11.367 26.747 93.243 1.00 22.98 C ATOM 970 H TRP A 41 -14.954 24.282 87.996 1.00 0.00 H ATOM 971 HE1 TRP A 41 -15.041 27.461 91.358 1.00 0.00 H ATOM 972 N ASP A 42 -17.259 23.643 90.117 1.00 17.69 N ATOM 973 CA ASP A 42 -18.415 23.826 90.981 1.00 16.99 C ATOM 974 C ASP A 42 -19.382 22.667 90.844 1.00 20.56 C ATOM 975 O ASP A 42 -19.944 22.451 89.772 1.00 26.69 O ATOM 976 CB ASP A 42 -19.125 25.123 90.625 1.00 20.41 C ATOM 977 CG ASP A 42 -20.057 25.579 91.705 1.00 21.40 C ATOM 978 OD1 ASP A 42 -19.595 26.307 92.605 1.00 30.73 O ATOM 979 OD2 ASP A 42 -21.242 25.208 91.671 1.00 22.28 O ATOM 980 H ASP A 42 -17.186 24.148 89.290 1.00 0.00 H ATOM 981 N LYS A 43 -19.646 21.982 91.948 1.00 17.60 N ATOM 982 CA LYS A 43 -20.542 20.833 91.953 1.00 18.08 C ATOM 983 C LYS A 43 -21.921 21.060 91.294 1.00 20.83 C ATOM 984 O LYS A 43 -22.442 20.201 90.575 1.00 21.47 O ATOM 985 CB LYS A 43 -20.666 20.292 93.396 1.00 20.23 C ATOM 986 CG LYS A 43 -22.001 19.620 93.782 1.00 24.32 C ATOM 987 CD LYS A 43 -21.961 18.954 95.167 1.00 28.88 C ATOM 988 CE LYS A 43 -23.332 18.383 95.576 1.00 33.88 C ATOM 989 NZ LYS A 43 -23.258 17.152 96.472 1.00 36.18 N ATOM 990 H LYS A 43 -19.171 22.246 92.751 1.00 0.00 H ATOM 991 HZ1 LYS A 43 -22.766 17.394 97.356 1.00 0.00 H ATOM 992 HZ2 LYS A 43 -22.735 16.405 95.969 1.00 0.00 H ATOM 993 HZ3 LYS A 43 -24.222 16.831 96.679 1.00 0.00 H ATOM 994 N TYR A 44 -22.489 22.239 91.497 1.00 21.53 N ATOM 995 CA TYR A 44 -23.796 22.556 90.951 1.00 15.38 C ATOM 996 C TYR A 44 -23.701 22.897 89.467 1.00 19.75 C ATOM 997 O TYR A 44 -24.627 22.623 88.705 1.00 23.74 O ATOM 998 CB TYR A 44 -24.390 23.714 91.737 1.00 12.96 C ATOM 999 CG TYR A 44 -24.523 23.477 93.234 1.00 5.13 C ATOM 1000 CD1 TYR A 44 -23.551 23.891 94.125 1.00 4.85 C ATOM 1001 CD2 TYR A 44 -25.681 22.937 93.762 1.00 12.96 C ATOM 1002 CE1 TYR A 44 -23.748 23.786 95.519 1.00 2.81 C ATOM 1003 CE2 TYR A 44 -25.880 22.834 95.125 1.00 8.12 C ATOM 1004 CZ TYR A 44 -24.919 23.267 95.993 1.00 4.23 C ATOM 1005 OH TYR A 44 -25.213 23.244 97.335 1.00 12.50 O ATOM 1006 H TYR A 44 -22.018 22.893 92.046 1.00 0.00 H ATOM 1007 HH TYR A 44 -26.096 22.901 97.486 1.00 0.00 H ATOM 1008 N ALA A 45 -22.568 23.447 89.046 1.00 19.76 N ATOM 1009 CA ALA A 45 -22.379 23.809 87.651 1.00 18.85 C ATOM 1010 C ALA A 45 -22.266 22.500 86.939 1.00 18.96 C ATOM 1011 O ALA A 45 -22.947 22.258 85.957 1.00 22.00 O ATOM 1012 CB ALA A 45 -21.113 24.600 87.483 1.00 18.23 C ATOM 1013 H ALA A 45 -21.826 23.550 89.671 1.00 0.00 H ATOM 1014 N GLN A 46 -21.475 21.615 87.530 1.00 22.04 N ATOM 1015 CA GLN A 46 -21.237 20.282 86.989 1.00 22.18 C ATOM 1016 C GLN A 46 -22.522 19.513 86.752 1.00 22.86 C ATOM 1017 O GLN A 46 -22.637 18.749 85.797 1.00 27.18 O ATOM 1018 CB GLN A 46 -20.336 19.490 87.932 1.00 17.38 C ATOM 1019 CG GLN A 46 -18.914 20.022 87.995 1.00 14.15 C ATOM 1020 CD GLN A 46 -18.022 19.166 88.847 1.00 14.75 C ATOM 1021 OE1 GLN A 46 -18.477 18.534 89.786 1.00 20.21 O ATOM 1022 NE2 GLN A 46 -16.743 19.136 88.529 1.00 22.68 N ATOM 1023 H GLN A 46 -21.017 21.870 88.353 1.00 0.00 H ATOM 1024 HE21 GLN A 46 -16.414 19.663 87.769 1.00 0.00 H ATOM 1025 HE22 GLN A 46 -16.183 18.566 89.086 1.00 0.00 H ATOM 1026 N GLU A 47 -23.484 19.711 87.641 1.00 24.52 N ATOM 1027 CA GLU A 47 -24.759 19.038 87.546 1.00 19.99 C ATOM 1028 C GLU A 47 -25.617 19.631 86.451 1.00 22.27 C ATOM 1029 O GLU A 47 -26.345 18.903 85.795 1.00 27.72 O ATOM 1030 CB GLU A 47 -25.496 19.127 88.866 1.00 18.88 C ATOM 1031 CG GLU A 47 -24.730 18.583 90.030 1.00 10.43 C ATOM 1032 CD GLU A 47 -25.443 18.791 91.362 1.00 17.16 C ATOM 1033 OE1 GLU A 47 -26.305 19.690 91.505 1.00 17.35 O ATOM 1034 OE2 GLU A 47 -25.136 18.037 92.295 1.00 24.09 O ATOM 1035 H GLU A 47 -23.296 20.294 88.403 1.00 0.00 H ATOM 1036 N VAL A 48 -25.552 20.945 86.257 1.00 23.08 N ATOM 1037 CA VAL A 48 -26.350 21.585 85.211 1.00 23.25 C ATOM 1038 C VAL A 48 -25.736 21.249 83.867 1.00 19.98 C ATOM 1039 O VAL A 48 -26.438 21.124 82.875 1.00 21.75 O ATOM 1040 CB VAL A 48 -26.323 23.099 85.301 1.00 24.44 C ATOM 1041 CG1 VAL A 48 -27.504 23.675 84.574 1.00 28.90 C ATOM 1042 CG2 VAL A 48 -26.305 23.517 86.708 1.00 32.91 C ATOM 1043 H VAL A 48 -24.940 21.485 86.803 1.00 0.00 H ATOM 1044 N TYR A 49 -24.413 21.161 83.837 1.00 19.09 N ATOM 1045 CA TYR A 49 -23.694 20.852 82.618 1.00 19.74 C ATOM 1046 C TYR A 49 -23.903 19.388 82.267 1.00 23.63 C ATOM 1047 O TYR A 49 -23.900 19.030 81.091 1.00 33.25 O ATOM 1048 CB TYR A 49 -22.210 21.186 82.779 1.00 15.48 C ATOM 1049 CG TYR A 49 -21.410 21.259 81.491 1.00 16.30 C ATOM 1050 CD1 TYR A 49 -21.157 22.481 80.876 1.00 14.25 C ATOM 1051 CD2 TYR A 49 -20.837 20.115 80.930 1.00 14.86 C ATOM 1052 CE1 TYR A 49 -20.337 22.563 79.734 1.00 18.16 C ATOM 1053 CE2 TYR A 49 -20.024 20.189 79.788 1.00 13.82 C ATOM 1054 CZ TYR A 49 -19.780 21.411 79.205 1.00 13.27 C ATOM 1055 OH TYR A 49 -18.974 21.488 78.108 1.00 8.70 O ATOM 1056 H TYR A 49 -23.901 21.338 84.647 1.00 0.00 H ATOM 1057 HH TYR A 49 -19.008 22.350 77.722 1.00 0.00 H ATOM 1058 N GLU A 50 -24.069 18.536 83.270 1.00 22.39 N ATOM 1059 CA GLU A 50 -24.327 17.128 83.000 1.00 23.85 C ATOM 1060 C GLU A 50 -25.776 16.964 82.538 1.00 23.70 C ATOM 1061 O GLU A 50 -26.069 16.205 81.627 1.00 30.36 O ATOM 1062 CB GLU A 50 -24.066 16.281 84.240 1.00 28.67 C ATOM 1063 CG GLU A 50 -24.211 14.780 84.005 1.00 33.53 C ATOM 1064 CD GLU A 50 -23.318 13.968 84.908 1.00 38.48 C ATOM 1065 OE1 GLU A 50 -22.891 14.525 85.948 1.00 42.05 O ATOM 1066 OE2 GLU A 50 -23.029 12.791 84.567 1.00 41.14 O ATOM 1067 H GLU A 50 -23.957 18.832 84.201 1.00 0.00 H ATOM 1068 N MET A 51 -26.663 17.740 83.133 1.00 19.84 N ATOM 1069 CA MET A 51 -28.085 17.745 82.835 1.00 17.25 C ATOM 1070 C MET A 51 -28.349 18.189 81.397 1.00 20.64 C ATOM 1071 O MET A 51 -29.279 17.717 80.741 1.00 25.15 O ATOM 1072 CB MET A 51 -28.734 18.727 83.811 1.00 20.58 C ATOM 1073 CG MET A 51 -30.222 18.674 84.002 1.00 24.73 C ATOM 1074 SD MET A 51 -30.631 19.880 85.297 1.00 30.52 S ATOM 1075 CE MET A 51 -29.795 19.135 86.673 1.00 28.95 C ATOM 1076 H MET A 51 -26.339 18.328 83.845 1.00 0.00 H ATOM 1077 N ASN A 52 -27.555 19.129 80.910 1.00 21.74 N ATOM 1078 CA ASN A 52 -27.753 19.619 79.562 1.00 21.57 C ATOM 1079 C ASN A 52 -26.858 18.996 78.484 1.00 24.74 C ATOM 1080 O ASN A 52 -27.275 18.895 77.328 1.00 27.56 O ATOM 1081 CB ASN A 52 -27.618 21.140 79.520 1.00 19.34 C ATOM 1082 CG ASN A 52 -28.766 21.846 80.177 1.00 19.74 C ATOM 1083 OD1 ASN A 52 -29.852 21.909 79.624 1.00 22.85 O ATOM 1084 ND2 ASN A 52 -28.524 22.433 81.342 1.00 24.13 N ATOM 1085 H ASN A 52 -26.856 19.510 81.490 1.00 0.00 H ATOM 1086 HD21 ASN A 52 -29.283 22.884 81.782 1.00 0.00 H ATOM 1087 HD22 ASN A 52 -27.617 22.409 81.730 1.00 0.00 H ATOM 1088 N PHE A 53 -25.634 18.590 78.834 1.00 25.94 N ATOM 1089 CA PHE A 53 -24.714 18.025 77.844 1.00 21.74 C ATOM 1090 C PHE A 53 -24.335 16.587 78.091 1.00 23.45 C ATOM 1091 O PHE A 53 -23.472 16.042 77.397 1.00 23.80 O ATOM 1092 CB PHE A 53 -23.453 18.861 77.773 1.00 15.70 C ATOM 1093 CG PHE A 53 -23.718 20.278 77.493 1.00 10.42 C ATOM 1094 CD1 PHE A 53 -23.779 21.190 78.509 1.00 13.53 C ATOM 1095 CD2 PHE A 53 -23.950 20.705 76.208 1.00 13.64 C ATOM 1096 CE1 PHE A 53 -24.074 22.518 78.240 1.00 11.35 C ATOM 1097 CE2 PHE A 53 -24.241 22.023 75.932 1.00 6.72 C ATOM 1098 CZ PHE A 53 -24.304 22.928 76.943 1.00 8.66 C ATOM 1099 H PHE A 53 -25.308 18.669 79.756 1.00 0.00 H ATOM 1100 N GLY A 54 -24.927 15.992 79.120 1.00 22.80 N ATOM 1101 CA GLY A 54 -24.635 14.605 79.437 1.00 28.46 C ATOM 1102 C GLY A 54 -23.212 14.308 79.880 1.00 31.75 C ATOM 1103 O GLY A 54 -22.862 13.143 80.055 1.00 35.10 O ATOM 1104 H GLY A 54 -25.568 16.466 79.692 1.00 0.00 H ATOM 1105 N GLU A 55 -22.399 15.346 80.066 1.00 32.47 N ATOM 1106 CA GLU A 55 -21.018 15.186 80.489 1.00 31.41 C ATOM 1107 C GLU A 55 -20.850 15.915 81.790 1.00 30.47 C ATOM 1108 O GLU A 55 -21.491 16.933 82.026 1.00 29.97 O ATOM 1109 CB GLU A 55 -20.050 15.894 79.537 1.00 37.15 C ATOM 1110 CG GLU A 55 -19.982 15.450 78.087 1.00 45.57 C ATOM 1111 CD GLU A 55 -18.906 16.229 77.303 1.00 50.07 C ATOM 1112 OE1 GLU A 55 -18.067 16.932 77.943 1.00 40.48 O ATOM 1113 OE2 GLU A 55 -18.907 16.136 76.045 1.00 51.21 O ATOM 1114 H GLU A 55 -22.717 16.255 79.924 1.00 0.00 H ATOM 1115 N LYS A 56 -19.928 15.438 82.605 1.00 30.49 N ATOM 1116 CA LYS A 56 -19.615 16.126 83.836 1.00 29.91 C ATOM 1117 C LYS A 56 -18.181 16.612 83.591 1.00 29.02 C ATOM 1118 O LYS A 56 -17.315 15.838 83.186 1.00 28.90 O ATOM 1119 CB LYS A 56 -19.663 15.187 85.043 1.00 29.94 C ATOM 1120 CG LYS A 56 -19.998 15.910 86.353 1.00 34.60 C ATOM 1121 CD LYS A 56 -19.540 15.155 87.609 1.00 37.64 C ATOM 1122 CE LYS A 56 -18.004 15.099 87.733 1.00 40.73 C ATOM 1123 NZ LYS A 56 -17.540 14.384 88.971 1.00 39.56 N ATOM 1124 H LYS A 56 -19.446 14.616 82.369 1.00 0.00 H ATOM 1125 HZ1 LYS A 56 -17.895 13.406 88.945 1.00 0.00 H ATOM 1126 HZ2 LYS A 56 -17.945 14.860 89.804 1.00 0.00 H ATOM 1127 HZ3 LYS A 56 -16.505 14.377 89.040 1.00 0.00 H ATOM 1128 N PRO A 57 -17.953 17.922 83.682 1.00 26.05 N ATOM 1129 CA PRO A 57 -16.630 18.510 83.478 1.00 26.59 C ATOM 1130 C PRO A 57 -15.596 17.989 84.476 1.00 28.86 C ATOM 1131 O PRO A 57 -15.941 17.574 85.584 1.00 30.77 O ATOM 1132 CB PRO A 57 -16.892 19.986 83.726 1.00 27.07 C ATOM 1133 CG PRO A 57 -18.280 20.158 83.255 1.00 23.58 C ATOM 1134 CD PRO A 57 -18.978 18.969 83.805 1.00 25.24 C ATOM 1135 N GLU A 58 -14.324 18.043 84.105 1.00 26.81 N ATOM 1136 CA GLU A 58 -13.303 17.591 85.018 1.00 26.57 C ATOM 1137 C GLU A 58 -13.190 18.663 86.084 1.00 26.48 C ATOM 1138 O GLU A 58 -13.686 19.765 85.891 1.00 27.20 O ATOM 1139 CB GLU A 58 -11.982 17.395 84.299 1.00 28.34 C ATOM 1140 CG GLU A 58 -10.888 17.006 85.248 1.00 29.73 C ATOM 1141 CD GLU A 58 -9.719 16.399 84.557 1.00 33.06 C ATOM 1142 OE1 GLU A 58 -9.105 17.079 83.709 1.00 37.44 O ATOM 1143 OE2 GLU A 58 -9.413 15.232 84.869 1.00 42.37 O ATOM 1144 H GLU A 58 -14.091 18.412 83.227 1.00 0.00 H ATOM 1145 N GLY A 59 -12.552 18.345 87.206 1.00 28.31 N ATOM 1146 CA GLY A 59 -12.421 19.303 88.297 1.00 28.38 C ATOM 1147 C GLY A 59 -11.359 20.381 88.165 1.00 29.13 C ATOM 1148 O GLY A 59 -10.830 20.636 87.076 1.00 35.36 O ATOM 1149 H GLY A 59 -12.093 17.492 87.283 1.00 0.00 H ATOM 1150 N ASP A 60 -11.035 20.996 89.299 1.00 28.06 N ATOM 1151 CA ASP A 60 -10.044 22.082 89.416 1.00 26.57 C ATOM 1152 C ASP A 60 -8.912 22.082 88.388 1.00 27.18 C ATOM 1153 O ASP A 60 -7.938 21.374 88.545 1.00 30.69 O ATOM 1154 CB ASP A 60 -9.456 22.053 90.828 1.00 26.23 C ATOM 1155 CG ASP A 60 -8.547 23.214 91.122 1.00 25.83 C ATOM 1156 OD1 ASP A 60 -8.203 23.961 90.202 1.00 30.60 O ATOM 1157 OD2 ASP A 60 -8.162 23.386 92.296 1.00 29.10 O ATOM 1158 H ASP A 60 -11.473 20.691 90.109 1.00 0.00 H ATOM 1159 N ILE A 61 -8.997 22.986 87.421 1.00 27.81 N ATOM 1160 CA ILE A 61 -8.007 23.120 86.372 1.00 24.70 C ATOM 1161 C ILE A 61 -6.590 23.271 86.902 1.00 27.77 C ATOM 1162 O ILE A 61 -5.647 22.842 86.265 1.00 31.55 O ATOM 1163 CB ILE A 61 -8.331 24.327 85.478 1.00 26.10 C ATOM 1164 CG1 ILE A 61 -7.527 24.277 84.182 1.00 23.82 C ATOM 1165 CG2 ILE A 61 -8.102 25.616 86.219 1.00 26.42 C ATOM 1166 CD1 ILE A 61 -8.095 23.279 83.187 1.00 16.86 C ATOM 1167 H ILE A 61 -9.810 23.541 87.386 1.00 0.00 H ATOM 1168 N THR A 62 -6.436 23.903 88.055 1.00 32.42 N ATOM 1169 CA THR A 62 -5.112 24.111 88.660 1.00 35.42 C ATOM 1170 C THR A 62 -4.259 22.831 88.803 1.00 36.68 C ATOM 1171 O THR A 62 -3.041 22.876 88.623 1.00 38.71 O ATOM 1172 CB THR A 62 -5.230 24.825 90.051 1.00 29.44 C ATOM 1173 OG1 THR A 62 -5.711 26.159 89.866 1.00 26.04 O ATOM 1174 CG2 THR A 62 -3.880 24.895 90.762 1.00 38.34 C ATOM 1175 H THR A 62 -7.223 24.266 88.479 1.00 0.00 H ATOM 1176 HG1 THR A 62 -6.632 26.225 89.597 1.00 0.00 H ATOM 1177 N GLN A 63 -4.896 21.706 89.123 1.00 37.60 N ATOM 1178 CA GLN A 63 -4.188 20.444 89.313 1.00 38.72 C ATOM 1179 C GLN A 63 -4.562 19.382 88.263 1.00 37.81 C ATOM 1180 O GLN A 63 -4.745 18.187 88.555 1.00 38.71 O ATOM 1181 CB GLN A 63 -4.358 19.929 90.759 1.00 45.48 C ATOM 1182 CG GLN A 63 -3.743 20.844 91.869 1.00 52.96 C ATOM 1183 CD GLN A 63 -2.199 20.978 91.839 1.00 59.23 C ATOM 1184 OE1 GLN A 63 -1.468 19.991 91.992 1.00 62.68 O ATOM 1185 NE2 GLN A 63 -1.709 22.211 91.693 1.00 58.88 N ATOM 1186 H GLN A 63 -5.875 21.690 89.172 1.00 0.00 H ATOM 1187 HE21 GLN A 63 -2.251 23.012 91.565 1.00 0.00 H ATOM 1188 HE22 GLN A 63 -0.736 22.245 91.756 1.00 0.00 H ATOM 1189 N VAL A 64 -4.638 19.841 87.020 1.00 37.00 N ATOM 1190 CA VAL A 64 -4.931 18.998 85.880 1.00 32.81 C ATOM 1191 C VAL A 64 -3.740 19.030 84.926 1.00 34.25 C ATOM 1192 O VAL A 64 -3.426 20.052 84.318 1.00 31.84 O ATOM 1193 CB VAL A 64 -6.196 19.454 85.127 1.00 30.96 C ATOM 1194 CG1 VAL A 64 -6.303 18.734 83.784 1.00 23.51 C ATOM 1195 CG2 VAL A 64 -7.430 19.158 85.959 1.00 28.28 C ATOM 1196 H VAL A 64 -4.452 20.789 86.838 1.00 0.00 H ATOM 1197 N ASN A 65 -3.066 17.895 84.830 1.00 35.83 N ATOM 1198 CA ASN A 65 -1.918 17.733 83.959 1.00 38.50 C ATOM 1199 C ASN A 65 -2.315 18.179 82.552 1.00 39.63 C ATOM 1200 O ASN A 65 -2.985 17.438 81.851 1.00 40.33 O ATOM 1201 CB ASN A 65 -1.528 16.254 83.953 1.00 41.75 C ATOM 1202 CG ASN A 65 -0.143 16.019 83.424 1.00 47.18 C ATOM 1203 OD1 ASN A 65 0.281 16.643 82.447 1.00 47.90 O ATOM 1204 ND2 ASN A 65 0.585 15.113 84.069 1.00 54.56 N ATOM 1205 H ASN A 65 -3.367 17.144 85.383 1.00 0.00 H ATOM 1206 HD21 ASN A 65 0.227 14.619 84.841 1.00 0.00 H ATOM 1207 HD22 ASN A 65 1.491 14.973 83.737 1.00 0.00 H ATOM 1208 N GLU A 66 -1.890 19.373 82.141 1.00 42.55 N ATOM 1209 CA GLU A 66 -2.222 19.929 80.822 1.00 41.32 C ATOM 1210 C GLU A 66 -2.076 18.986 79.622 1.00 44.98 C ATOM 1211 O GLU A 66 -2.867 19.049 78.677 1.00 46.56 O ATOM 1212 CB GLU A 66 -1.448 21.231 80.564 1.00 39.35 C ATOM 1213 CG GLU A 66 0.040 21.080 80.396 1.00 35.04 C ATOM 1214 CD GLU A 66 0.817 21.624 81.573 1.00 37.55 C ATOM 1215 OE1 GLU A 66 1.552 22.616 81.376 1.00 39.22 O ATOM 1216 OE2 GLU A 66 0.696 21.065 82.682 1.00 30.85 O ATOM 1217 H GLU A 66 -1.360 19.915 82.767 1.00 0.00 H ATOM 1218 N LYS A 67 -1.087 18.098 79.671 1.00 45.36 N ATOM 1219 CA LYS A 67 -0.844 17.137 78.600 1.00 43.18 C ATOM 1220 C LYS A 67 -2.039 16.195 78.416 1.00 39.00 C ATOM 1221 O LYS A 67 -2.169 15.526 77.396 1.00 39.12 O ATOM 1222 CB LYS A 67 0.400 16.325 78.932 1.00 49.50 C ATOM 1223 CG LYS A 67 1.620 17.155 79.303 1.00 54.20 C ATOM 1224 CD LYS A 67 2.746 16.242 79.729 1.00 61.66 C ATOM 1225 CE LYS A 67 3.880 17.004 80.382 1.00 67.82 C ATOM 1226 NZ LYS A 67 4.812 16.049 81.073 1.00 71.88 N ATOM 1227 H LYS A 67 -0.510 18.078 80.467 1.00 0.00 H ATOM 1228 HZ1 LYS A 67 5.184 15.371 80.374 1.00 0.00 H ATOM 1229 HZ2 LYS A 67 4.318 15.534 81.826 1.00 0.00 H ATOM 1230 HZ3 LYS A 67 5.603 16.595 81.473 1.00 0.00 H ATOM 1231 N THR A 68 -2.869 16.126 79.450 1.00 37.73 N ATOM 1232 CA THR A 68 -4.081 15.309 79.500 1.00 35.87 C ATOM 1233 C THR A 68 -5.192 15.914 78.652 1.00 33.66 C ATOM 1234 O THR A 68 -6.114 15.229 78.228 1.00 34.93 O ATOM 1235 CB THR A 68 -4.620 15.248 80.949 1.00 36.26 C ATOM 1236 OG1 THR A 68 -3.610 14.717 81.816 1.00 33.20 O ATOM 1237 CG2 THR A 68 -5.885 14.403 81.032 1.00 41.55 C ATOM 1238 H THR A 68 -2.656 16.650 80.237 1.00 0.00 H ATOM 1239 HG1 THR A 68 -2.865 15.316 81.732 1.00 0.00 H ATOM 1240 N ILE A 69 -5.125 17.214 78.448 1.00 30.04 N ATOM 1241 CA ILE A 69 -6.145 17.883 77.685 1.00 29.32 C ATOM 1242 C ILE A 69 -6.109 17.430 76.241 1.00 28.32 C ATOM 1243 O ILE A 69 -5.075 17.441 75.615 1.00 29.21 O ATOM 1244 CB ILE A 69 -5.997 19.388 77.833 1.00 26.69 C ATOM 1245 CG1 ILE A 69 -6.376 19.764 79.253 1.00 22.15 C ATOM 1246 CG2 ILE A 69 -6.888 20.112 76.883 1.00 28.12 C ATOM 1247 CD1 ILE A 69 -6.069 21.159 79.598 1.00 30.03 C ATOM 1248 H ILE A 69 -4.350 17.726 78.757 1.00 0.00 H ATOM 1249 N PRO A 70 -7.245 16.946 75.728 1.00 29.29 N ATOM 1250 CA PRO A 70 -7.396 16.464 74.359 1.00 27.68 C ATOM 1251 C PRO A 70 -7.018 17.499 73.334 1.00 27.65 C ATOM 1252 O PRO A 70 -7.214 18.688 73.553 1.00 31.29 O ATOM 1253 CB PRO A 70 -8.885 16.149 74.281 1.00 26.24 C ATOM 1254 CG PRO A 70 -9.181 15.664 75.651 1.00 27.15 C ATOM 1255 CD PRO A 70 -8.478 16.703 76.497 1.00 30.37 C ATOM 1256 N ASP A 71 -6.488 17.034 72.207 1.00 31.65 N ATOM 1257 CA ASP A 71 -6.084 17.903 71.102 1.00 33.25 C ATOM 1258 C ASP A 71 -7.316 18.756 70.754 1.00 31.17 C ATOM 1259 O ASP A 71 -8.431 18.248 70.708 1.00 30.09 O ATOM 1260 CB ASP A 71 -5.691 17.073 69.866 1.00 43.77 C ATOM 1261 CG ASP A 71 -4.794 15.858 70.192 1.00 52.13 C ATOM 1262 OD1 ASP A 71 -5.236 14.934 70.939 1.00 52.83 O ATOM 1263 OD2 ASP A 71 -3.664 15.809 69.639 1.00 53.14 O ATOM 1264 H ASP A 71 -6.408 16.068 72.150 1.00 0.00 H ATOM 1265 N HIS A 72 -7.109 20.037 70.481 1.00 28.77 N ATOM 1266 CA HIS A 72 -8.216 20.926 70.175 1.00 25.02 C ATOM 1267 C HIS A 72 -7.759 22.123 69.337 1.00 27.37 C ATOM 1268 O HIS A 72 -6.594 22.540 69.403 1.00 28.02 O ATOM 1269 CB HIS A 72 -8.875 21.388 71.482 1.00 17.85 C ATOM 1270 CG HIS A 72 -7.936 22.056 72.430 1.00 13.25 C ATOM 1271 ND1 HIS A 72 -7.885 23.429 72.590 1.00 19.64 N ATOM 1272 CD2 HIS A 72 -6.987 21.558 73.249 1.00 14.13 C ATOM 1273 CE1 HIS A 72 -6.947 23.739 73.455 1.00 9.65 C ATOM 1274 NE2 HIS A 72 -6.383 22.621 73.873 1.00 13.80 N ATOM 1275 H HIS A 72 -6.203 20.399 70.425 1.00 0.00 H ATOM 1276 HD1 HIS A 72 -8.447 24.087 72.117 1.00 0.00 H ATOM 1277 HE2 HIS A 72 -5.661 22.542 74.538 1.00 0.00 H ATOM 1278 N ASP A 73 -8.688 22.696 68.576 1.00 26.83 N ATOM 1279 CA ASP A 73 -8.369 23.823 67.709 1.00 24.38 C ATOM 1280 C ASP A 73 -8.652 25.189 68.302 1.00 21.26 C ATOM 1281 O ASP A 73 -7.996 26.174 67.959 1.00 20.59 O ATOM 1282 CB ASP A 73 -9.082 23.670 66.362 1.00 28.41 C ATOM 1283 CG ASP A 73 -8.635 22.428 65.598 1.00 29.42 C ATOM 1284 OD1 ASP A 73 -7.417 22.189 65.475 1.00 36.98 O ATOM 1285 OD2 ASP A 73 -9.503 21.676 65.133 1.00 30.08 O ATOM 1286 H ASP A 73 -9.608 22.355 68.579 1.00 0.00 H ATOM 1287 N ILE A 74 -9.658 25.262 69.159 1.00 22.72 N ATOM 1288 CA ILE A 74 -10.009 26.519 69.804 1.00 18.01 C ATOM 1289 C ILE A 74 -10.171 26.229 71.285 1.00 16.75 C ATOM 1290 O ILE A 74 -10.703 25.183 71.648 1.00 12.67 O ATOM 1291 CB ILE A 74 -11.323 27.073 69.250 1.00 14.69 C ATOM 1292 CG1 ILE A 74 -11.246 27.212 67.723 1.00 13.89 C ATOM 1293 CG2 ILE A 74 -11.583 28.439 69.848 1.00 18.23 C ATOM 1294 CD1 ILE A 74 -12.579 27.572 67.066 1.00 9.10 C ATOM 1295 H ILE A 74 -10.217 24.481 69.354 1.00 0.00 H ATOM 1296 N LEU A 75 -9.597 27.076 72.132 1.00 15.01 N ATOM 1297 CA LEU A 75 -9.715 26.900 73.567 1.00 16.71 C ATOM 1298 C LEU A 75 -10.624 28.036 73.986 1.00 20.12 C ATOM 1299 O LEU A 75 -10.434 29.171 73.559 1.00 23.56 O ATOM 1300 CB LEU A 75 -8.336 26.974 74.263 1.00 17.64 C ATOM 1301 CG LEU A 75 -8.145 26.960 75.793 1.00 15.88 C ATOM 1302 CD1 LEU A 75 -6.790 26.452 76.179 1.00 8.36 C ATOM 1303 CD2 LEU A 75 -8.300 28.348 76.342 1.00 12.21 C ATOM 1304 H LEU A 75 -9.099 27.852 71.781 1.00 0.00 H ATOM 1305 N CYS A 76 -11.685 27.704 74.711 1.00 19.76 N ATOM 1306 CA CYS A 76 -12.620 28.702 75.174 1.00 18.18 C ATOM 1307 C CYS A 76 -12.430 28.765 76.666 1.00 18.66 C ATOM 1308 O CYS A 76 -12.184 27.729 77.296 1.00 20.82 O ATOM 1309 CB CYS A 76 -14.046 28.269 74.857 1.00 16.38 C ATOM 1310 SG CYS A 76 -14.403 28.128 73.107 1.00 22.29 S ATOM 1311 H CYS A 76 -11.856 26.777 74.969 1.00 0.00 H ATOM 1312 N ALA A 77 -12.495 29.977 77.221 1.00 17.15 N ATOM 1313 CA ALA A 77 -12.349 30.188 78.651 1.00 13.73 C ATOM 1314 C ALA A 77 -12.951 31.481 79.109 1.00 14.87 C ATOM 1315 O ALA A 77 -12.503 32.539 78.708 1.00 19.46 O ATOM 1316 CB ALA A 77 -10.908 30.165 79.047 1.00 17.97 C ATOM 1317 H ALA A 77 -12.610 30.755 76.634 1.00 0.00 H ATOM 1318 N GLY A 78 -13.989 31.401 79.931 1.00 15.84 N ATOM 1319 CA GLY A 78 -14.588 32.596 80.488 1.00 12.79 C ATOM 1320 C GLY A 78 -14.051 32.534 81.893 1.00 12.50 C ATOM 1321 O GLY A 78 -14.715 31.993 82.751 1.00 12.72 O ATOM 1322 H GLY A 78 -14.388 30.540 80.225 1.00 0.00 H ATOM 1323 N PHE A 79 -12.830 33.024 82.120 1.00 12.64 N ATOM 1324 CA PHE A 79 -12.217 32.919 83.445 1.00 11.49 C ATOM 1325 C PHE A 79 -12.781 33.805 84.540 1.00 10.57 C ATOM 1326 O PHE A 79 -13.491 34.773 84.264 1.00 17.00 O ATOM 1327 CB PHE A 79 -10.673 32.964 83.376 1.00 9.25 C ATOM 1328 CG PHE A 79 -10.111 34.183 82.707 1.00 11.97 C ATOM 1329 CD1 PHE A 79 -9.474 35.156 83.446 1.00 6.81 C ATOM 1330 CD2 PHE A 79 -10.213 34.353 81.336 1.00 8.60 C ATOM 1331 CE1 PHE A 79 -8.955 36.267 82.829 1.00 6.97 C ATOM 1332 CE2 PHE A 79 -9.693 35.470 80.727 1.00 4.06 C ATOM 1333 CZ PHE A 79 -9.064 36.423 81.475 1.00 5.97 C ATOM 1334 H PHE A 79 -12.387 33.475 81.373 1.00 0.00 H ATOM 1335 N PRO A 80 -12.602 33.390 85.800 1.00 9.02 N ATOM 1336 CA PRO A 80 -13.094 34.142 86.951 1.00 11.87 C ATOM 1337 C PRO A 80 -12.832 35.613 86.791 1.00 15.86 C ATOM 1338 O PRO A 80 -11.913 36.015 86.087 1.00 17.97 O ATOM 1339 CB PRO A 80 -12.334 33.520 88.111 1.00 10.33 C ATOM 1340 CG PRO A 80 -12.407 32.065 87.728 1.00 10.46 C ATOM 1341 CD PRO A 80 -12.071 32.083 86.229 1.00 6.22 C ATOM 1342 N CYS A 81 -13.657 36.427 87.436 1.00 15.23 N ATOM 1343 CA CYS A 81 -13.521 37.863 87.290 1.00 21.28 C ATOM 1344 C CYS A 81 -13.638 38.607 88.582 1.00 19.53 C ATOM 1345 O CYS A 81 -13.409 39.810 88.625 1.00 22.98 O ATOM 1346 CB CYS A 81 -14.594 38.401 86.349 1.00 23.17 C ATOM 1347 SG CYS A 81 -16.241 38.163 86.990 1.00 32.39 S ATOM 1348 H CYS A 81 -14.330 36.024 88.032 1.00 0.00 H ATOM 1349 N GLN A 82 -13.997 37.910 89.646 1.00 19.08 N ATOM 1350 CA GLN A 82 -14.155 38.586 90.926 1.00 18.09 C ATOM 1351 C GLN A 82 -12.985 39.534 91.188 1.00 23.12 C ATOM 1352 O GLN A 82 -13.180 40.704 91.515 1.00 28.71 O ATOM 1353 CB GLN A 82 -14.267 37.581 92.065 1.00 14.61 C ATOM 1354 CG GLN A 82 -15.256 36.467 91.852 1.00 14.77 C ATOM 1355 CD GLN A 82 -14.591 35.204 91.379 1.00 14.39 C ATOM 1356 OE1 GLN A 82 -14.954 34.105 91.796 1.00 21.94 O ATOM 1357 NE2 GLN A 82 -13.596 35.346 90.521 1.00 15.61 N ATOM 1358 H GLN A 82 -14.260 36.981 89.513 1.00 0.00 H ATOM 1359 HE21 GLN A 82 -13.217 36.162 90.179 1.00 0.00 H ATOM 1360 HE22 GLN A 82 -13.274 34.458 90.272 1.00 0.00 H ATOM 1361 N ALA A 83 -11.785 39.063 90.870 1.00 23.12 N ATOM 1362 CA ALA A 83 -10.569 39.813 91.112 1.00 16.49 C ATOM 1363 C ALA A 83 -10.331 40.992 90.211 1.00 17.13 C ATOM 1364 O ALA A 83 -9.369 41.705 90.399 1.00 23.54 O ATOM 1365 CB ALA A 83 -9.395 38.877 91.050 1.00 21.56 C ATOM 1366 H ALA A 83 -11.666 38.213 90.416 1.00 0.00 H ATOM 1367 N PHE A 84 -11.192 41.220 89.234 1.00 19.39 N ATOM 1368 CA PHE A 84 -10.983 42.342 88.321 1.00 18.54 C ATOM 1369 C PHE A 84 -12.216 43.223 88.218 1.00 19.41 C ATOM 1370 O PHE A 84 -12.155 44.350 87.730 1.00 18.28 O ATOM 1371 CB PHE A 84 -10.599 41.815 86.936 1.00 15.97 C ATOM 1372 CG PHE A 84 -9.512 40.789 86.966 1.00 9.58 C ATOM 1373 CD1 PHE A 84 -9.815 39.445 86.942 1.00 13.83 C ATOM 1374 CD2 PHE A 84 -8.199 41.162 87.078 1.00 9.72 C ATOM 1375 CE1 PHE A 84 -8.823 38.492 87.040 1.00 8.04 C ATOM 1376 CE2 PHE A 84 -7.195 40.206 87.173 1.00 6.40 C ATOM 1377 CZ PHE A 84 -7.514 38.877 87.156 1.00 5.89 C ATOM 1378 H PHE A 84 -11.985 40.669 89.149 1.00 0.00 H ATOM 1379 N SER A 85 -13.318 42.737 88.769 1.00 22.87 N ATOM 1380 CA SER A 85 -14.578 43.456 88.710 1.00 27.09 C ATOM 1381 C SER A 85 -14.679 44.768 89.468 1.00 25.93 C ATOM 1382 O SER A 85 -14.281 44.875 90.627 1.00 27.29 O ATOM 1383 CB SER A 85 -15.730 42.555 89.141 1.00 21.15 C ATOM 1384 OG SER A 85 -16.936 43.286 89.112 1.00 27.47 O ATOM 1385 H SER A 85 -13.302 41.879 89.229 1.00 0.00 H ATOM 1386 HG SER A 85 -17.143 43.268 88.199 1.00 0.00 H ATOM 1387 N ILE A 86 -15.328 45.724 88.816 1.00 24.80 N ATOM 1388 CA ILE A 86 -15.579 47.039 89.366 1.00 24.34 C ATOM 1389 C ILE A 86 -16.392 46.831 90.653 1.00 25.57 C ATOM 1390 O ILE A 86 -16.381 47.658 91.554 1.00 29.44 O ATOM 1391 CB ILE A 86 -16.412 47.858 88.345 1.00 25.81 C ATOM 1392 CG1 ILE A 86 -16.657 49.294 88.808 1.00 29.68 C ATOM 1393 CG2 ILE A 86 -17.771 47.204 88.144 1.00 30.65 C ATOM 1394 CD1 ILE A 86 -17.618 50.075 87.888 1.00 25.44 C ATOM 1395 H ILE A 86 -15.627 45.527 87.902 1.00 0.00 H ATOM 1396 N SER A 87 -17.045 45.685 90.767 1.00 25.47 N ATOM 1397 CA SER A 87 -17.869 45.416 91.935 1.00 23.80 C ATOM 1398 C SER A 87 -17.178 44.733 93.123 1.00 23.42 C ATOM 1399 O SER A 87 -17.806 44.536 94.169 1.00 25.13 O ATOM 1400 CB SER A 87 -19.104 44.627 91.506 1.00 19.49 C ATOM 1401 OG SER A 87 -20.106 44.682 92.495 1.00 17.51 O ATOM 1402 H SER A 87 -17.006 44.984 90.094 1.00 0.00 H ATOM 1403 HG SER A 87 -20.142 45.598 92.802 1.00 0.00 H ATOM 1404 N GLY A 88 -15.886 44.429 93.000 1.00 19.84 N ATOM 1405 CA GLY A 88 -15.203 43.758 94.085 1.00 16.37 C ATOM 1406 C GLY A 88 -14.004 44.511 94.590 1.00 20.61 C ATOM 1407 O GLY A 88 -13.799 45.661 94.242 1.00 27.31 O ATOM 1408 H GLY A 88 -15.359 44.714 92.232 1.00 0.00 H ATOM 1409 N LYS A 89 -13.196 43.843 95.397 1.00 22.35 N ATOM 1410 CA LYS A 89 -11.997 44.422 95.977 1.00 26.28 C ATOM 1411 C LYS A 89 -10.952 44.844 94.966 1.00 32.49 C ATOM 1412 O LYS A 89 -10.336 45.892 95.136 1.00 44.03 O ATOM 1413 CB LYS A 89 -11.377 43.454 96.971 1.00 27.06 C ATOM 1414 CG LYS A 89 -12.271 43.191 98.185 1.00 32.16 C ATOM 1415 CD LYS A 89 -11.617 42.256 99.197 1.00 35.10 C ATOM 1416 CE LYS A 89 -12.470 42.136 100.449 1.00 37.47 C ATOM 1417 NZ LYS A 89 -11.679 41.627 101.606 1.00 50.21 N ATOM 1418 H LYS A 89 -13.465 42.926 95.593 1.00 0.00 H ATOM 1419 HZ1 LYS A 89 -10.902 42.291 101.776 1.00 0.00 H ATOM 1420 HZ2 LYS A 89 -11.293 40.684 101.397 1.00 0.00 H ATOM 1421 HZ3 LYS A 89 -12.293 41.572 102.439 1.00 0.00 H ATOM 1422 N GLN A 90 -10.699 43.993 93.974 1.00 33.23 N ATOM 1423 CA GLN A 90 -9.737 44.260 92.882 1.00 31.28 C ATOM 1424 C GLN A 90 -8.270 43.875 93.071 1.00 32.34 C ATOM 1425 O GLN A 90 -7.392 44.504 92.488 1.00 34.42 O ATOM 1426 CB GLN A 90 -9.797 45.720 92.405 1.00 26.82 C ATOM 1427 CG GLN A 90 -10.914 46.049 91.466 1.00 26.44 C ATOM 1428 CD GLN A 90 -10.872 47.482 91.016 1.00 25.24 C ATOM 1429 OE1 GLN A 90 -11.553 48.336 91.580 1.00 38.04 O ATOM 1430 NE2 GLN A 90 -10.089 47.762 89.985 1.00 24.48 N ATOM 1431 H GLN A 90 -11.198 43.142 93.975 1.00 0.00 H ATOM 1432 HE21 GLN A 90 -9.583 47.055 89.571 1.00 0.00 H ATOM 1433 HE22 GLN A 90 -10.078 48.693 89.707 1.00 0.00 H ATOM 1434 N LYS A 91 -7.996 42.798 93.791 1.00 32.17 N ATOM 1435 CA LYS A 91 -6.617 42.397 94.007 1.00 33.02 C ATOM 1436 C LYS A 91 -5.965 41.771 92.767 1.00 33.69 C ATOM 1437 O LYS A 91 -4.792 41.382 92.796 1.00 32.62 O ATOM 1438 CB LYS A 91 -6.544 41.465 95.211 1.00 39.28 C ATOM 1439 CG LYS A 91 -7.182 42.055 96.470 1.00 41.17 C ATOM 1440 CD LYS A 91 -7.109 41.090 97.652 1.00 50.57 C ATOM 1441 CE LYS A 91 -7.725 41.705 98.928 1.00 58.59 C ATOM 1442 NZ LYS A 91 -7.471 40.925 100.189 1.00 59.70 N ATOM 1443 H LYS A 91 -8.663 42.215 94.184 1.00 0.00 H ATOM 1444 HZ1 LYS A 91 -6.435 40.871 100.307 1.00 0.00 H ATOM 1445 HZ2 LYS A 91 -7.849 39.960 100.135 1.00 0.00 H ATOM 1446 HZ3 LYS A 91 -7.868 41.406 101.019 1.00 0.00 H ATOM 1447 N GLY A 92 -6.734 41.694 91.682 1.00 30.11 N ATOM 1448 CA GLY A 92 -6.239 41.153 90.433 1.00 26.20 C ATOM 1449 C GLY A 92 -5.507 39.838 90.573 1.00 26.28 C ATOM 1450 O GLY A 92 -6.017 38.919 91.218 1.00 20.13 O ATOM 1451 H GLY A 92 -7.677 41.944 91.726 1.00 0.00 H ATOM 1452 N PHE A 93 -4.293 39.775 90.012 1.00 25.82 N ATOM 1453 CA PHE A 93 -3.471 38.562 90.048 1.00 24.72 C ATOM 1454 C PHE A 93 -3.092 38.180 91.466 1.00 28.50 C ATOM 1455 O PHE A 93 -2.754 37.024 91.737 1.00 30.07 O ATOM 1456 CB PHE A 93 -2.205 38.720 89.202 1.00 23.08 C ATOM 1457 CG PHE A 93 -2.466 38.890 87.732 1.00 18.89 C ATOM 1458 CD1 PHE A 93 -1.759 39.831 87.001 1.00 17.37 C ATOM 1459 CD2 PHE A 93 -3.440 38.144 87.090 1.00 18.65 C ATOM 1460 CE1 PHE A 93 -2.015 40.035 85.659 1.00 16.20 C ATOM 1461 CE2 PHE A 93 -3.705 38.345 85.740 1.00 20.56 C ATOM 1462 CZ PHE A 93 -2.992 39.292 85.025 1.00 19.04 C ATOM 1463 H PHE A 93 -3.915 40.575 89.591 1.00 0.00 H ATOM 1464 N GLU A 94 -3.156 39.145 92.382 1.00 33.84 N ATOM 1465 CA GLU A 94 -2.836 38.864 93.772 1.00 35.90 C ATOM 1466 C GLU A 94 -3.977 38.080 94.437 1.00 39.27 C ATOM 1467 O GLU A 94 -3.877 37.712 95.605 1.00 40.62 O ATOM 1468 CB GLU A 94 -2.521 40.148 94.548 1.00 39.59 C ATOM 1469 CG GLU A 94 -1.031 40.454 94.704 1.00 44.44 C ATOM 1470 CD GLU A 94 -0.435 41.210 93.531 1.00 51.93 C ATOM 1471 OE1 GLU A 94 -1.177 41.633 92.617 1.00 54.26 O ATOM 1472 OE2 GLU A 94 0.798 41.404 93.534 1.00 59.54 O ATOM 1473 H GLU A 94 -3.451 40.043 92.149 1.00 0.00 H ATOM 1474 N ASP A 95 -5.057 37.813 93.698 1.00 38.34 N ATOM 1475 CA ASP A 95 -6.186 37.047 94.234 1.00 35.64 C ATOM 1476 C ASP A 95 -6.060 35.587 93.812 1.00 35.11 C ATOM 1477 O ASP A 95 -5.652 35.303 92.686 1.00 35.99 O ATOM 1478 CB ASP A 95 -7.506 37.597 93.699 1.00 36.81 C ATOM 1479 CG ASP A 95 -8.712 36.969 94.362 1.00 33.63 C ATOM 1480 OD1 ASP A 95 -8.980 35.780 94.138 1.00 33.63 O ATOM 1481 OD2 ASP A 95 -9.402 37.674 95.109 1.00 33.48 O ATOM 1482 H ASP A 95 -5.102 38.107 92.766 1.00 0.00 H ATOM 1483 N SER A 96 -6.468 34.665 94.687 1.00 32.87 N ATOM 1484 CA SER A 96 -6.404 33.234 94.378 1.00 30.36 C ATOM 1485 C SER A 96 -7.093 32.991 93.055 1.00 30.41 C ATOM 1486 O SER A 96 -6.519 32.413 92.112 1.00 31.45 O ATOM 1487 CB SER A 96 -7.098 32.421 95.461 1.00 31.44 C ATOM 1488 OG SER A 96 -8.105 33.182 96.111 1.00 37.24 O ATOM 1489 H SER A 96 -6.818 34.941 95.562 1.00 0.00 H ATOM 1490 HG SER A 96 -8.722 33.687 95.589 1.00 0.00 H ATOM 1491 N ARG A 97 -8.307 33.520 92.978 1.00 24.37 N ATOM 1492 CA ARG A 97 -9.115 33.388 91.791 1.00 20.06 C ATOM 1493 C ARG A 97 -8.694 34.343 90.715 1.00 20.92 C ATOM 1494 O ARG A 97 -9.406 34.507 89.729 1.00 24.27 O ATOM 1495 CB ARG A 97 -10.568 33.608 92.136 1.00 20.93 C ATOM 1496 CG ARG A 97 -10.956 32.879 93.371 1.00 13.93 C ATOM 1497 CD ARG A 97 -11.140 33.865 94.450 1.00 16.24 C ATOM 1498 NE ARG A 97 -12.526 34.273 94.555 1.00 16.67 N ATOM 1499 CZ ARG A 97 -12.937 35.501 94.843 1.00 20.45 C ATOM 1500 NH1 ARG A 97 -12.081 36.485 95.044 1.00 20.43 N ATOM 1501 NH2 ARG A 97 -14.227 35.732 94.983 1.00 30.76 N ATOM 1502 H ARG A 97 -8.678 33.941 93.768 1.00 0.00 H ATOM 1503 HE ARG A 97 -13.211 33.591 94.397 1.00 0.00 H ATOM 1504 HH11 ARG A 97 -11.097 36.310 94.982 1.00 0.00 H ATOM 1505 HH12 ARG A 97 -12.401 37.400 95.275 1.00 0.00 H ATOM 1506 HH21 ARG A 97 -14.875 34.981 94.862 1.00 0.00 H ATOM 1507 HH22 ARG A 97 -14.550 36.652 95.210 1.00 0.00 H ATOM 1508 N GLY A 98 -7.513 34.928 90.874 1.00 18.25 N ATOM 1509 CA GLY A 98 -7.019 35.865 89.884 1.00 17.67 C ATOM 1510 C GLY A 98 -5.884 35.295 89.055 1.00 17.02 C ATOM 1511 O GLY A 98 -5.457 35.887 88.071 1.00 20.02 O ATOM 1512 H GLY A 98 -6.929 34.701 91.606 1.00 0.00 H ATOM 1513 N THR A 99 -5.420 34.115 89.421 1.00 15.49 N ATOM 1514 CA THR A 99 -4.314 33.512 88.720 1.00 19.39 C ATOM 1515 C THR A 99 -4.712 32.584 87.572 1.00 24.85 C ATOM 1516 O THR A 99 -3.862 32.170 86.774 1.00 31.17 O ATOM 1517 CB THR A 99 -3.485 32.751 89.710 1.00 19.14 C ATOM 1518 OG1 THR A 99 -4.362 32.129 90.655 1.00 25.14 O ATOM 1519 CG2 THR A 99 -2.593 33.697 90.458 1.00 22.32 C ATOM 1520 H THR A 99 -5.814 33.623 90.168 1.00 0.00 H ATOM 1521 HG1 THR A 99 -4.702 32.730 91.329 1.00 0.00 H ATOM 1522 N LEU A 100 -6.012 32.325 87.427 1.00 26.11 N ATOM 1523 CA LEU A 100 -6.509 31.416 86.389 1.00 18.29 C ATOM 1524 C LEU A 100 -6.037 31.682 84.976 1.00 16.29 C ATOM 1525 O LEU A 100 -5.911 30.759 84.183 1.00 20.68 O ATOM 1526 CB LEU A 100 -8.031 31.320 86.421 1.00 12.24 C ATOM 1527 CG LEU A 100 -8.695 30.502 87.537 1.00 16.47 C ATOM 1528 CD1 LEU A 100 -8.051 29.138 87.636 1.00 9.69 C ATOM 1529 CD2 LEU A 100 -8.589 31.196 88.877 1.00 14.09 C ATOM 1530 H LEU A 100 -6.644 32.740 88.057 1.00 0.00 H ATOM 1531 N PHE A 101 -5.718 32.921 84.649 1.00 16.10 N ATOM 1532 CA PHE A 101 -5.277 33.176 83.298 1.00 17.87 C ATOM 1533 C PHE A 101 -3.993 32.422 83.000 1.00 20.06 C ATOM 1534 O PHE A 101 -3.805 31.887 81.912 1.00 23.34 O ATOM 1535 CB PHE A 101 -5.064 34.662 83.031 1.00 19.04 C ATOM 1536 CG PHE A 101 -4.519 34.916 81.679 1.00 20.50 C ATOM 1537 CD1 PHE A 101 -5.338 34.814 80.562 1.00 23.19 C ATOM 1538 CD2 PHE A 101 -3.175 35.137 81.501 1.00 18.54 C ATOM 1539 CE1 PHE A 101 -4.816 34.923 79.284 1.00 22.46 C ATOM 1540 CE2 PHE A 101 -2.649 35.245 80.234 1.00 25.29 C ATOM 1541 CZ PHE A 101 -3.474 35.137 79.124 1.00 21.00 C ATOM 1542 H PHE A 101 -5.727 33.620 85.327 1.00 0.00 H ATOM 1543 N PHE A 102 -3.129 32.327 83.994 1.00 21.37 N ATOM 1544 CA PHE A 102 -1.864 31.657 83.799 1.00 21.32 C ATOM 1545 C PHE A 102 -2.028 30.160 83.665 1.00 25.36 C ATOM 1546 O PHE A 102 -1.089 29.443 83.315 1.00 30.67 O ATOM 1547 CB PHE A 102 -0.867 32.095 84.876 1.00 18.73 C ATOM 1548 CG PHE A 102 -0.695 33.596 84.929 1.00 10.64 C ATOM 1549 CD1 PHE A 102 -1.239 34.329 85.956 1.00 12.41 C ATOM 1550 CD2 PHE A 102 -0.101 34.273 83.878 1.00 10.99 C ATOM 1551 CE1 PHE A 102 -1.202 35.708 85.926 1.00 12.72 C ATOM 1552 CE2 PHE A 102 -0.061 35.639 83.838 1.00 9.68 C ATOM 1553 CZ PHE A 102 -0.611 36.360 84.856 1.00 14.53 C ATOM 1554 H PHE A 102 -3.324 32.683 84.885 1.00 0.00 H ATOM 1555 N ASP A 103 -3.239 29.684 83.898 1.00 27.16 N ATOM 1556 CA ASP A 103 -3.508 28.272 83.726 1.00 28.81 C ATOM 1557 C ASP A 103 -3.887 28.128 82.263 1.00 30.96 C ATOM 1558 O ASP A 103 -3.517 27.148 81.599 1.00 32.43 O ATOM 1559 CB ASP A 103 -4.643 27.814 84.629 1.00 30.33 C ATOM 1560 CG ASP A 103 -4.203 27.637 86.049 1.00 31.51 C ATOM 1561 OD1 ASP A 103 -4.139 28.653 86.773 1.00 39.77 O ATOM 1562 OD2 ASP A 103 -3.904 26.490 86.439 1.00 34.14 O ATOM 1563 H ASP A 103 -3.949 30.261 84.218 1.00 0.00 H ATOM 1564 N ILE A 104 -4.598 29.135 81.755 1.00 30.46 N ATOM 1565 CA ILE A 104 -5.005 29.160 80.352 1.00 26.04 C ATOM 1566 C ILE A 104 -3.710 29.145 79.546 1.00 27.51 C ATOM 1567 O ILE A 104 -3.451 28.202 78.803 1.00 30.46 O ATOM 1568 CB ILE A 104 -5.822 30.424 80.049 1.00 20.21 C ATOM 1569 CG1 ILE A 104 -7.171 30.324 80.735 1.00 16.15 C ATOM 1570 CG2 ILE A 104 -5.980 30.641 78.560 1.00 20.20 C ATOM 1571 CD1 ILE A 104 -7.964 31.573 80.654 1.00 15.97 C ATOM 1572 H ILE A 104 -4.852 29.879 82.343 1.00 0.00 H ATOM 1573 N ALA A 105 -2.842 30.117 79.812 1.00 28.18 N ATOM 1574 CA ALA A 105 -1.559 30.233 79.110 1.00 26.61 C ATOM 1575 C ALA A 105 -0.784 28.929 79.086 1.00 25.89 C ATOM 1576 O ALA A 105 -0.316 28.506 78.024 1.00 29.07 O ATOM 1577 CB ALA A 105 -0.705 31.334 79.725 1.00 22.48 C ATOM 1578 H ALA A 105 -3.076 30.768 80.506 1.00 0.00 H ATOM 1579 N ARG A 106 -0.660 28.273 80.240 1.00 25.74 N ATOM 1580 CA ARG A 106 0.084 27.016 80.273 1.00 26.49 C ATOM 1581 C ARG A 106 -0.599 25.855 79.544 1.00 27.22 C ATOM 1582 O ARG A 106 0.074 24.923 79.113 1.00 29.80 O ATOM 1583 CB ARG A 106 0.549 26.622 81.681 1.00 20.61 C ATOM 1584 CG ARG A 106 -0.508 26.379 82.682 1.00 25.93 C ATOM 1585 CD ARG A 106 0.035 25.493 83.792 1.00 26.31 C ATOM 1586 NE ARG A 106 -0.579 24.177 83.711 1.00 28.86 N ATOM 1587 CZ ARG A 106 -1.698 23.834 84.345 1.00 31.43 C ATOM 1588 NH1 ARG A 106 -2.318 24.697 85.142 1.00 32.14 N ATOM 1589 NH2 ARG A 106 -2.280 22.672 84.071 1.00 28.12 N ATOM 1590 H ARG A 106 -1.056 28.625 81.066 1.00 0.00 H ATOM 1591 HE ARG A 106 -0.146 23.488 83.165 1.00 0.00 H ATOM 1592 HH11 ARG A 106 -1.962 25.621 85.280 1.00 0.00 H ATOM 1593 HH12 ARG A 106 -3.156 24.411 85.610 1.00 0.00 H ATOM 1594 HH21 ARG A 106 -1.876 22.062 83.392 1.00 0.00 H ATOM 1595 HH22 ARG A 106 -3.118 22.402 84.547 1.00 0.00 H ATOM 1596 N ILE A 107 -1.923 25.898 79.408 1.00 26.82 N ATOM 1597 CA ILE A 107 -2.604 24.859 78.659 1.00 18.57 C ATOM 1598 C ILE A 107 -2.343 25.211 77.208 1.00 22.90 C ATOM 1599 O ILE A 107 -2.133 24.329 76.385 1.00 25.71 O ATOM 1600 CB ILE A 107 -4.103 24.849 78.914 1.00 15.85 C ATOM 1601 CG1 ILE A 107 -4.376 24.311 80.316 1.00 9.54 C ATOM 1602 CG2 ILE A 107 -4.803 24.003 77.862 1.00 12.35 C ATOM 1603 CD1 ILE A 107 -5.810 24.279 80.702 1.00 10.22 C ATOM 1604 H ILE A 107 -2.447 26.622 79.817 1.00 0.00 H ATOM 1605 N VAL A 108 -2.286 26.512 76.912 1.00 24.85 N ATOM 1606 CA VAL A 108 -2.045 26.985 75.553 1.00 24.08 C ATOM 1607 C VAL A 108 -0.635 26.631 75.147 1.00 26.87 C ATOM 1608 O VAL A 108 -0.395 26.203 74.028 1.00 29.04 O ATOM 1609 CB VAL A 108 -2.268 28.499 75.410 1.00 19.59 C ATOM 1610 CG1 VAL A 108 -1.843 28.955 74.053 1.00 21.23 C ATOM 1611 CG2 VAL A 108 -3.730 28.834 75.597 1.00 19.02 C ATOM 1612 H VAL A 108 -2.399 27.174 77.615 1.00 0.00 H ATOM 1613 N ARG A 109 0.289 26.755 76.081 1.00 30.05 N ATOM 1614 CA ARG A 109 1.680 26.429 75.815 1.00 33.92 C ATOM 1615 C ARG A 109 1.817 24.987 75.320 1.00 31.25 C ATOM 1616 O ARG A 109 2.393 24.742 74.266 1.00 32.28 O ATOM 1617 CB ARG A 109 2.489 26.613 77.099 1.00 43.41 C ATOM 1618 CG ARG A 109 3.989 26.380 76.981 1.00 51.16 C ATOM 1619 CD ARG A 109 4.685 26.687 78.304 1.00 58.44 C ATOM 1620 NE ARG A 109 4.536 28.091 78.699 1.00 69.06 N ATOM 1621 CZ ARG A 109 3.953 28.504 79.824 1.00 73.17 C ATOM 1622 NH1 ARG A 109 3.453 27.619 80.682 1.00 74.89 N ATOM 1623 NH2 ARG A 109 3.885 29.806 80.101 1.00 73.30 N ATOM 1624 H ARG A 109 0.014 27.051 76.965 1.00 0.00 H ATOM 1625 HE ARG A 109 4.887 28.777 78.093 1.00 0.00 H ATOM 1626 HH11 ARG A 109 3.497 26.640 80.490 1.00 0.00 H ATOM 1627 HH12 ARG A 109 3.009 27.938 81.519 1.00 0.00 H ATOM 1628 HH21 ARG A 109 4.283 30.474 79.475 1.00 0.00 H ATOM 1629 HH22 ARG A 109 3.451 30.109 80.950 1.00 0.00 H ATOM 1630 N GLU A 110 1.247 24.046 76.065 1.00 32.54 N ATOM 1631 CA GLU A 110 1.327 22.614 75.739 1.00 33.56 C ATOM 1632 C GLU A 110 0.522 22.153 74.532 1.00 34.81 C ATOM 1633 O GLU A 110 1.032 21.414 73.693 1.00 37.23 O ATOM 1634 CB GLU A 110 0.924 21.776 76.949 1.00 33.01 C ATOM 1635 CG GLU A 110 0.945 20.272 76.722 1.00 35.89 C ATOM 1636 CD GLU A 110 2.341 19.704 76.597 1.00 37.70 C ATOM 1637 OE1 GLU A 110 3.277 20.283 77.194 1.00 39.56 O ATOM 1638 OE2 GLU A 110 2.497 18.663 75.918 1.00 37.14 O ATOM 1639 H GLU A 110 0.764 24.328 76.876 1.00 0.00 H ATOM 1640 N LYS A 111 -0.748 22.542 74.479 1.00 33.49 N ATOM 1641 CA LYS A 111 -1.629 22.165 73.384 1.00 30.53 C ATOM 1642 C LYS A 111 -1.651 23.094 72.165 1.00 29.87 C ATOM 1643 O LYS A 111 -2.227 22.725 71.156 1.00 31.35 O ATOM 1644 CB LYS A 111 -3.064 22.014 73.906 1.00 35.07 C ATOM 1645 CG LYS A 111 -3.325 20.723 74.649 1.00 40.76 C ATOM 1646 CD LYS A 111 -3.301 19.538 73.694 1.00 44.97 C ATOM 1647 CE LYS A 111 -2.844 18.280 74.413 1.00 50.04 C ATOM 1648 NZ LYS A 111 -2.644 17.095 73.530 1.00 57.13 N ATOM 1649 H LYS A 111 -1.081 23.123 75.199 1.00 0.00 H ATOM 1650 HZ1 LYS A 111 -1.854 17.345 72.894 1.00 0.00 H ATOM 1651 HZ2 LYS A 111 -3.473 16.849 72.955 1.00 0.00 H ATOM 1652 HZ3 LYS A 111 -2.356 16.273 74.095 1.00 0.00 H ATOM 1653 N LYS A 112 -1.063 24.285 72.260 1.00 30.04 N ATOM 1654 CA LYS A 112 -1.076 25.272 71.174 1.00 32.15 C ATOM 1655 C LYS A 112 -2.208 25.157 70.150 1.00 31.88 C ATOM 1656 O LYS A 112 -1.986 24.705 69.028 1.00 35.50 O ATOM 1657 CB LYS A 112 0.273 25.337 70.466 1.00 38.02 C ATOM 1658 CG LYS A 112 1.269 26.166 71.215 1.00 46.71 C ATOM 1659 CD LYS A 112 2.510 26.425 70.403 1.00 55.38 C ATOM 1660 CE LYS A 112 3.545 27.111 71.278 1.00 59.11 C ATOM 1661 NZ LYS A 112 4.796 27.411 70.539 1.00 66.84 N ATOM 1662 H LYS A 112 -0.581 24.542 73.068 1.00 0.00 H ATOM 1663 HZ1 LYS A 112 4.584 28.141 69.829 1.00 0.00 H ATOM 1664 HZ2 LYS A 112 5.189 26.559 70.095 1.00 0.00 H ATOM 1665 HZ3 LYS A 112 5.471 27.782 71.244 1.00 0.00 H ATOM 1666 N PRO A 113 -3.449 25.542 70.530 1.00 30.43 N ATOM 1667 CA PRO A 113 -4.585 25.460 69.604 1.00 27.07 C ATOM 1668 C PRO A 113 -4.554 26.586 68.587 1.00 24.87 C ATOM 1669 O PRO A 113 -3.863 27.577 68.794 1.00 24.96 O ATOM 1670 CB PRO A 113 -5.778 25.600 70.534 1.00 23.92 C ATOM 1671 CG PRO A 113 -5.281 26.539 71.548 1.00 24.54 C ATOM 1672 CD PRO A 113 -3.908 26.000 71.854 1.00 25.65 C ATOM 1673 N LYS A 114 -5.326 26.455 67.513 1.00 22.28 N ATOM 1674 CA LYS A 114 -5.357 27.490 66.488 1.00 20.85 C ATOM 1675 C LYS A 114 -5.817 28.826 67.022 1.00 19.37 C ATOM 1676 O LYS A 114 -5.229 29.855 66.704 1.00 23.54 O ATOM 1677 CB LYS A 114 -6.284 27.108 65.350 1.00 22.09 C ATOM 1678 CG LYS A 114 -5.788 26.017 64.437 1.00 22.46 C ATOM 1679 CD LYS A 114 -6.860 25.742 63.410 1.00 24.14 C ATOM 1680 CE LYS A 114 -6.379 24.920 62.260 1.00 26.24 C ATOM 1681 NZ LYS A 114 -7.457 24.986 61.219 1.00 39.23 N ATOM 1682 H LYS A 114 -5.895 25.660 67.418 1.00 0.00 H ATOM 1683 HZ1 LYS A 114 -7.643 25.956 60.902 1.00 0.00 H ATOM 1684 HZ2 LYS A 114 -8.315 24.590 61.664 1.00 0.00 H ATOM 1685 HZ3 LYS A 114 -7.196 24.389 60.407 1.00 0.00 H ATOM 1686 N VAL A 115 -6.887 28.808 67.811 1.00 20.28 N ATOM 1687 CA VAL A 115 -7.462 30.031 68.368 1.00 19.92 C ATOM 1688 C VAL A 115 -7.641 29.971 69.890 1.00 23.91 C ATOM 1689 O VAL A 115 -7.818 28.887 70.474 1.00 26.52 O ATOM 1690 CB VAL A 115 -8.872 30.296 67.781 1.00 13.53 C ATOM 1691 CG1 VAL A 115 -9.410 31.578 68.307 1.00 19.59 C ATOM 1692 CG2 VAL A 115 -8.844 30.338 66.285 1.00 13.39 C ATOM 1693 H VAL A 115 -7.295 27.953 68.050 1.00 0.00 H ATOM 1694 N VAL A 116 -7.605 31.139 70.527 1.00 22.17 N ATOM 1695 CA VAL A 116 -7.840 31.243 71.963 1.00 23.19 C ATOM 1696 C VAL A 116 -8.971 32.285 72.094 1.00 25.16 C ATOM 1697 O VAL A 116 -8.847 33.434 71.653 1.00 24.22 O ATOM 1698 CB VAL A 116 -6.582 31.680 72.746 1.00 23.44 C ATOM 1699 CG1 VAL A 116 -6.895 31.777 74.221 1.00 23.41 C ATOM 1700 CG2 VAL A 116 -5.482 30.677 72.571 1.00 22.96 C ATOM 1701 H VAL A 116 -7.443 31.956 70.022 1.00 0.00 H ATOM 1702 N PHE A 117 -10.090 31.850 72.657 1.00 23.83 N ATOM 1703 CA PHE A 117 -11.271 32.687 72.801 1.00 22.26 C ATOM 1704 C PHE A 117 -11.484 32.918 74.286 1.00 21.39 C ATOM 1705 O PHE A 117 -11.882 31.999 74.982 1.00 26.15 O ATOM 1706 CB PHE A 117 -12.457 31.911 72.195 1.00 20.90 C ATOM 1707 CG PHE A 117 -13.724 32.727 72.007 1.00 16.84 C ATOM 1708 CD1 PHE A 117 -13.778 34.072 72.362 1.00 11.35 C ATOM 1709 CD2 PHE A 117 -14.863 32.133 71.468 1.00 12.64 C ATOM 1710 CE1 PHE A 117 -14.932 34.803 72.189 1.00 7.03 C ATOM 1711 CE2 PHE A 117 -16.014 32.850 71.291 1.00 11.16 C ATOM 1712 CZ PHE A 117 -16.054 34.194 71.655 1.00 13.16 C ATOM 1713 H PHE A 117 -10.135 30.944 73.028 1.00 0.00 H ATOM 1714 N MET A 118 -11.229 34.122 74.781 1.00 18.20 N ATOM 1715 CA MET A 118 -11.405 34.382 76.205 1.00 16.90 C ATOM 1716 C MET A 118 -12.434 35.479 76.514 1.00 16.97 C ATOM 1717 O MET A 118 -12.728 36.328 75.671 1.00 18.67 O ATOM 1718 CB MET A 118 -10.052 34.715 76.866 1.00 14.16 C ATOM 1719 CG MET A 118 -9.071 33.557 76.996 1.00 8.76 C ATOM 1720 SD MET A 118 -7.476 34.080 77.616 1.00 15.68 S ATOM 1721 CE MET A 118 -6.870 35.119 76.314 1.00 2.00 C ATOM 1722 H MET A 118 -10.880 34.826 74.186 1.00 0.00 H ATOM 1723 N GLU A 119 -12.907 35.512 77.757 1.00 14.39 N ATOM 1724 CA GLU A 119 -13.908 36.493 78.167 1.00 10.76 C ATOM 1725 C GLU A 119 -13.719 36.933 79.611 1.00 6.79 C ATOM 1726 O GLU A 119 -13.304 36.156 80.429 1.00 8.85 O ATOM 1727 CB GLU A 119 -15.295 35.865 78.006 1.00 13.87 C ATOM 1728 CG GLU A 119 -16.492 36.742 78.355 1.00 17.05 C ATOM 1729 CD GLU A 119 -17.046 36.501 79.749 1.00 22.23 C ATOM 1730 OE1 GLU A 119 -16.768 35.441 80.352 1.00 26.39 O ATOM 1731 OE2 GLU A 119 -17.776 37.385 80.250 1.00 25.07 O ATOM 1732 H GLU A 119 -12.591 34.866 78.404 1.00 0.00 H ATOM 1733 N ASN A 120 -13.948 38.208 79.897 1.00 8.15 N ATOM 1734 CA ASN A 120 -13.892 38.721 81.255 1.00 11.72 C ATOM 1735 C ASN A 120 -14.711 40.034 81.321 1.00 15.91 C ATOM 1736 O ASN A 120 -15.304 40.444 80.323 1.00 21.51 O ATOM 1737 CB ASN A 120 -12.449 38.844 81.795 1.00 9.70 C ATOM 1738 CG ASN A 120 -12.371 38.610 83.312 1.00 8.14 C ATOM 1739 OD1 ASN A 120 -12.858 39.407 84.093 1.00 10.48 O ATOM 1740 ND2 ASN A 120 -11.820 37.482 83.716 1.00 10.24 N ATOM 1741 H ASN A 120 -14.163 38.847 79.174 1.00 0.00 H ATOM 1742 HD21 ASN A 120 -11.728 37.286 84.670 1.00 0.00 H ATOM 1743 HD22 ASN A 120 -11.525 36.840 83.035 1.00 0.00 H ATOM 1744 N VAL A 121 -14.832 40.643 82.500 1.00 15.62 N ATOM 1745 CA VAL A 121 -15.614 41.864 82.640 1.00 6.56 C ATOM 1746 C VAL A 121 -14.897 43.070 82.037 1.00 12.87 C ATOM 1747 O VAL A 121 -13.675 43.042 81.865 1.00 17.06 O ATOM 1748 CB VAL A 121 -15.982 42.086 84.114 1.00 7.21 C ATOM 1749 CG1 VAL A 121 -16.759 40.873 84.630 1.00 6.12 C ATOM 1750 CG2 VAL A 121 -14.737 42.250 84.951 1.00 6.92 C ATOM 1751 H VAL A 121 -14.365 40.272 83.275 1.00 0.00 H ATOM 1752 N LYS A 122 -15.642 44.121 81.691 1.00 11.34 N ATOM 1753 CA LYS A 122 -15.052 45.325 81.086 1.00 14.46 C ATOM 1754 C LYS A 122 -13.901 45.945 81.866 1.00 19.63 C ATOM 1755 O LYS A 122 -13.025 46.583 81.287 1.00 23.11 O ATOM 1756 CB LYS A 122 -16.140 46.372 80.877 1.00 14.37 C ATOM 1757 CG LYS A 122 -15.723 47.816 80.558 1.00 18.29 C ATOM 1758 CD LYS A 122 -16.973 48.707 80.686 1.00 23.12 C ATOM 1759 CE LYS A 122 -16.756 50.180 80.383 1.00 24.06 C ATOM 1760 NZ LYS A 122 -17.883 50.970 81.016 1.00 28.73 N ATOM 1761 H LYS A 122 -16.614 44.074 81.800 1.00 0.00 H ATOM 1762 HZ1 LYS A 122 -17.854 50.761 82.024 1.00 0.00 H ATOM 1763 HZ2 LYS A 122 -18.814 50.703 80.637 1.00 0.00 H ATOM 1764 HZ3 LYS A 122 -17.717 51.981 80.850 1.00 0.00 H ATOM 1765 N ASN A 123 -13.914 45.800 83.182 1.00 20.48 N ATOM 1766 CA ASN A 123 -12.859 46.381 83.970 1.00 19.50 C ATOM 1767 C ASN A 123 -11.581 45.585 83.933 1.00 23.13 C ATOM 1768 O ASN A 123 -10.607 45.960 84.565 1.00 28.72 O ATOM 1769 CB ASN A 123 -13.288 46.579 85.406 1.00 18.94 C ATOM 1770 CG ASN A 123 -12.461 47.628 86.097 1.00 22.69 C ATOM 1771 OD1 ASN A 123 -12.480 48.806 85.711 1.00 23.05 O ATOM 1772 ND2 ASN A 123 -11.690 47.213 87.078 1.00 16.63 N ATOM 1773 H ASN A 123 -14.645 45.314 83.608 1.00 0.00 H ATOM 1774 HD21 ASN A 123 -11.158 47.876 87.546 1.00 0.00 H ATOM 1775 HD22 ASN A 123 -11.700 46.253 87.278 1.00 0.00 H ATOM 1776 N PHE A 124 -11.579 44.446 83.256 1.00 26.34 N ATOM 1777 CA PHE A 124 -10.348 43.659 83.173 1.00 24.97 C ATOM 1778 C PHE A 124 -9.429 44.460 82.262 1.00 25.55 C ATOM 1779 O PHE A 124 -8.219 44.400 82.385 1.00 28.79 O ATOM 1780 CB PHE A 124 -10.626 42.275 82.574 1.00 19.37 C ATOM 1781 CG PHE A 124 -9.421 41.374 82.507 1.00 11.32 C ATOM 1782 CD1 PHE A 124 -9.152 40.475 83.527 1.00 10.56 C ATOM 1783 CD2 PHE A 124 -8.602 41.365 81.384 1.00 10.95 C ATOM 1784 CE1 PHE A 124 -8.091 39.566 83.437 1.00 6.06 C ATOM 1785 CE2 PHE A 124 -7.538 40.457 81.291 1.00 10.94 C ATOM 1786 CZ PHE A 124 -7.290 39.552 82.331 1.00 3.98 C ATOM 1787 H PHE A 124 -12.395 44.087 82.836 1.00 0.00 H ATOM 1788 N ALA A 125 -10.023 45.260 81.389 1.00 23.54 N ATOM 1789 CA ALA A 125 -9.270 46.076 80.459 1.00 26.23 C ATOM 1790 C ALA A 125 -8.549 47.258 81.117 1.00 31.22 C ATOM 1791 O ALA A 125 -7.540 47.716 80.591 1.00 36.39 O ATOM 1792 CB ALA A 125 -10.178 46.574 79.354 1.00 23.95 C ATOM 1793 H ALA A 125 -11.000 45.309 81.342 1.00 0.00 H ATOM 1794 N SER A 126 -9.042 47.746 82.254 1.00 31.15 N ATOM 1795 CA SER A 126 -8.404 48.875 82.941 1.00 27.48 C ATOM 1796 C SER A 126 -7.786 48.497 84.282 1.00 26.84 C ATOM 1797 O SER A 126 -7.066 49.288 84.876 1.00 28.81 O ATOM 1798 CB SER A 126 -9.423 49.986 83.186 1.00 27.83 C ATOM 1799 OG SER A 126 -10.318 50.081 82.097 1.00 38.65 O ATOM 1800 H SER A 126 -9.884 47.416 82.619 1.00 0.00 H ATOM 1801 HG SER A 126 -10.987 50.764 82.218 1.00 0.00 H ATOM 1802 N HIS A 127 -8.066 47.297 84.767 1.00 23.75 N ATOM 1803 CA HIS A 127 -7.545 46.878 86.049 1.00 23.71 C ATOM 1804 C HIS A 127 -6.067 47.175 86.178 1.00 29.05 C ATOM 1805 O HIS A 127 -5.355 47.106 85.190 1.00 35.12 O ATOM 1806 CB HIS A 127 -7.809 45.413 86.281 1.00 16.41 C ATOM 1807 CG HIS A 127 -7.189 44.910 87.534 1.00 15.40 C ATOM 1808 ND1 HIS A 127 -7.722 45.169 88.777 1.00 11.64 N ATOM 1809 CD2 HIS A 127 -6.045 44.223 87.747 1.00 16.89 C ATOM 1810 CE1 HIS A 127 -6.927 44.667 89.702 1.00 17.77 C ATOM 1811 NE2 HIS A 127 -5.903 44.087 89.103 1.00 21.90 N ATOM 1812 H HIS A 127 -8.634 46.683 84.249 1.00 0.00 H ATOM 1813 HD1 HIS A 127 -8.617 45.521 88.973 1.00 0.00 H ATOM 1814 HE2 HIS A 127 -5.153 43.629 89.560 1.00 0.00 H ATOM 1815 N ASP A 128 -5.627 47.500 87.398 1.00 33.45 N ATOM 1816 CA ASP A 128 -4.240 47.879 87.729 1.00 35.45 C ATOM 1817 C ASP A 128 -3.554 48.709 86.648 1.00 37.43 C ATOM 1818 O ASP A 128 -2.472 48.355 86.199 1.00 39.38 O ATOM 1819 CB ASP A 128 -3.379 46.660 88.074 1.00 37.13 C ATOM 1820 CG ASP A 128 -2.118 47.026 88.856 1.00 41.10 C ATOM 1821 OD1 ASP A 128 -2.070 48.127 89.451 1.00 43.00 O ATOM 1822 OD2 ASP A 128 -1.179 46.198 88.902 1.00 40.09 O ATOM 1823 H ASP A 128 -6.276 47.441 88.113 1.00 0.00 H ATOM 1824 N ASN A 129 -4.236 49.760 86.188 1.00 38.00 N ATOM 1825 CA ASN A 129 -3.733 50.678 85.163 1.00 38.34 C ATOM 1826 C ASN A 129 -3.544 50.152 83.761 1.00 40.35 C ATOM 1827 O ASN A 129 -3.038 50.866 82.891 1.00 45.69 O ATOM 1828 CB ASN A 129 -2.429 51.316 85.601 1.00 41.28 C ATOM 1829 CG ASN A 129 -2.644 52.451 86.547 1.00 45.43 C ATOM 1830 OD1 ASN A 129 -3.327 53.427 86.222 1.00 47.86 O ATOM 1831 ND2 ASN A 129 -2.067 52.343 87.736 1.00 47.58 N ATOM 1832 H ASN A 129 -5.137 49.968 86.513 1.00 0.00 H ATOM 1833 HD21 ASN A 129 -1.520 51.550 87.894 1.00 0.00 H ATOM 1834 HD22 ASN A 129 -2.213 53.067 88.380 1.00 0.00 H ATOM 1835 N GLY A 130 -3.978 48.931 83.513 1.00 38.77 N ATOM 1836 CA GLY A 130 -3.790 48.365 82.199 1.00 35.54 C ATOM 1837 C GLY A 130 -2.756 47.272 82.303 1.00 33.90 C ATOM 1838 O GLY A 130 -2.443 46.618 81.317 1.00 36.86 O ATOM 1839 H GLY A 130 -4.435 48.425 84.210 1.00 0.00 H ATOM 1840 N ASN A 131 -2.258 47.040 83.511 1.00 35.96 N ATOM 1841 CA ASN A 131 -1.265 46.002 83.740 1.00 38.56 C ATOM 1842 C ASN A 131 -1.796 44.593 83.463 1.00 37.62 C ATOM 1843 O ASN A 131 -1.127 43.818 82.786 1.00 38.88 O ATOM 1844 CB ASN A 131 -0.700 46.073 85.174 1.00 47.20 C ATOM 1845 CG ASN A 131 0.514 47.013 85.303 1.00 54.21 C ATOM 1846 OD1 ASN A 131 0.362 48.235 85.391 1.00 52.22 O ATOM 1847 ND2 ASN A 131 1.720 46.433 85.342 1.00 55.20 N ATOM 1848 H ASN A 131 -2.530 47.595 84.278 1.00 0.00 H ATOM 1849 HD21 ASN A 131 1.797 45.463 85.287 1.00 0.00 H ATOM 1850 HD22 ASN A 131 2.486 47.041 85.415 1.00 0.00 H ATOM 1851 N THR A 132 -2.994 44.266 83.954 1.00 32.81 N ATOM 1852 CA THR A 132 -3.554 42.930 83.763 1.00 31.07 C ATOM 1853 C THR A 132 -3.715 42.573 82.305 1.00 28.80 C ATOM 1854 O THR A 132 -3.295 41.512 81.872 1.00 31.35 O ATOM 1855 CB THR A 132 -4.920 42.777 84.443 1.00 31.07 C ATOM 1856 OG1 THR A 132 -5.426 44.066 84.787 1.00 37.35 O ATOM 1857 CG2 THR A 132 -4.812 41.958 85.677 1.00 31.82 C ATOM 1858 H THR A 132 -3.568 44.906 84.413 1.00 0.00 H ATOM 1859 HG1 THR A 132 -5.814 44.435 83.962 1.00 0.00 H ATOM 1860 N LEU A 133 -4.303 43.471 81.536 1.00 26.90 N ATOM 1861 CA LEU A 133 -4.511 43.200 80.129 1.00 29.22 C ATOM 1862 C LEU A 133 -3.199 43.125 79.388 1.00 31.69 C ATOM 1863 O LEU A 133 -3.043 42.326 78.471 1.00 34.16 O ATOM 1864 CB LEU A 133 -5.393 44.262 79.498 1.00 26.34 C ATOM 1865 CG LEU A 133 -5.868 43.942 78.081 1.00 23.52 C ATOM 1866 CD1 LEU A 133 -6.873 42.789 78.105 1.00 20.05 C ATOM 1867 CD2 LEU A 133 -6.484 45.187 77.475 1.00 20.51 C ATOM 1868 H LEU A 133 -4.580 44.317 81.943 1.00 0.00 H ATOM 1869 N GLU A 134 -2.254 43.971 79.774 1.00 33.70 N ATOM 1870 CA GLU A 134 -0.937 43.985 79.141 1.00 30.92 C ATOM 1871 C GLU A 134 -0.226 42.678 79.438 1.00 26.30 C ATOM 1872 O GLU A 134 0.376 42.089 78.558 1.00 26.31 O ATOM 1873 CB GLU A 134 -0.121 45.150 79.673 1.00 35.15 C ATOM 1874 CG GLU A 134 1.254 45.299 79.086 1.00 47.59 C ATOM 1875 CD GLU A 134 2.136 46.223 79.917 1.00 55.64 C ATOM 1876 OE1 GLU A 134 2.443 45.876 81.087 1.00 56.27 O ATOM 1877 OE2 GLU A 134 2.524 47.295 79.395 1.00 62.66 O ATOM 1878 H GLU A 134 -2.431 44.615 80.492 1.00 0.00 H ATOM 1879 N VAL A 135 -0.296 42.211 80.676 1.00 23.21 N ATOM 1880 CA VAL A 135 0.359 40.966 81.002 1.00 25.25 C ATOM 1881 C VAL A 135 -0.271 39.887 80.170 1.00 25.84 C ATOM 1882 O VAL A 135 0.422 39.036 79.644 1.00 31.92 O ATOM 1883 CB VAL A 135 0.221 40.590 82.476 1.00 31.36 C ATOM 1884 CG1 VAL A 135 0.638 39.127 82.683 1.00 30.81 C ATOM 1885 CG2 VAL A 135 1.087 41.514 83.340 1.00 32.50 C ATOM 1886 H VAL A 135 -0.807 42.701 81.346 1.00 0.00 H ATOM 1887 N VAL A 136 -1.592 39.925 80.051 1.00 26.84 N ATOM 1888 CA VAL A 136 -2.309 38.942 79.254 1.00 20.90 C ATOM 1889 C VAL A 136 -1.867 39.065 77.802 1.00 22.03 C ATOM 1890 O VAL A 136 -1.471 38.077 77.186 1.00 27.48 O ATOM 1891 CB VAL A 136 -3.829 39.135 79.356 1.00 14.37 C ATOM 1892 CG1 VAL A 136 -4.523 38.377 78.266 1.00 20.17 C ATOM 1893 CG2 VAL A 136 -4.323 38.639 80.687 1.00 16.62 C ATOM 1894 H VAL A 136 -2.105 40.616 80.529 1.00 0.00 H ATOM 1895 N LYS A 137 -1.859 40.289 77.286 1.00 23.46 N ATOM 1896 CA LYS A 137 -1.474 40.544 75.906 1.00 22.56 C ATOM 1897 C LYS A 137 -0.092 40.017 75.624 1.00 24.64 C ATOM 1898 O LYS A 137 0.110 39.267 74.677 1.00 30.21 O ATOM 1899 CB LYS A 137 -1.529 42.023 75.579 1.00 21.01 C ATOM 1900 CG LYS A 137 -0.915 42.307 74.245 1.00 25.61 C ATOM 1901 CD LYS A 137 -1.175 43.715 73.796 1.00 34.60 C ATOM 1902 CE LYS A 137 -0.650 43.903 72.378 1.00 39.50 C ATOM 1903 NZ LYS A 137 -0.953 45.280 71.891 1.00 48.16 N ATOM 1904 H LYS A 137 -2.085 41.023 77.863 1.00 0.00 H ATOM 1905 HZ1 LYS A 137 -0.468 45.956 72.522 1.00 0.00 H ATOM 1906 HZ2 LYS A 137 -1.978 45.455 71.907 1.00 0.00 H ATOM 1907 HZ3 LYS A 137 -0.582 45.382 70.924 1.00 0.00 H ATOM 1908 N ASN A 138 0.845 40.355 76.493 1.00 26.56 N ATOM 1909 CA ASN A 138 2.225 39.912 76.350 1.00 31.22 C ATOM 1910 C ASN A 138 2.381 38.386 76.449 1.00 32.84 C ATOM 1911 O ASN A 138 3.116 37.772 75.673 1.00 33.77 O ATOM 1912 CB ASN A 138 3.119 40.590 77.395 1.00 30.65 C ATOM 1913 CG ASN A 138 3.141 42.103 77.261 1.00 31.99 C ATOM 1914 OD1 ASN A 138 2.817 42.669 76.199 1.00 29.98 O ATOM 1915 ND2 ASN A 138 3.534 42.774 78.345 1.00 29.51 N ATOM 1916 H ASN A 138 0.598 40.944 77.222 1.00 0.00 H ATOM 1917 HD21 ASN A 138 3.785 42.297 79.158 1.00 0.00 H ATOM 1918 HD22 ASN A 138 3.535 43.744 78.243 1.00 0.00 H ATOM 1919 N THR A 139 1.691 37.769 77.397 1.00 31.54 N ATOM 1920 CA THR A 139 1.789 36.332 77.564 1.00 26.80 C ATOM 1921 C THR A 139 1.341 35.608 76.298 1.00 27.21 C ATOM 1922 O THR A 139 2.021 34.706 75.821 1.00 24.46 O ATOM 1923 CB THR A 139 0.976 35.891 78.773 1.00 24.68 C ATOM 1924 OG1 THR A 139 1.449 36.593 79.929 1.00 26.72 O ATOM 1925 CG2 THR A 139 1.140 34.412 79.015 1.00 31.01 C ATOM 1926 H THR A 139 1.084 38.276 77.976 1.00 0.00 H ATOM 1927 HG1 THR A 139 1.223 37.515 79.903 1.00 0.00 H ATOM 1928 N MET A 140 0.254 36.082 75.700 1.00 29.91 N ATOM 1929 CA MET A 140 -0.285 35.471 74.493 1.00 31.55 C ATOM 1930 C MET A 140 0.643 35.691 73.315 1.00 33.20 C ATOM 1931 O MET A 140 0.942 34.760 72.564 1.00 32.17 O ATOM 1932 CB MET A 140 -1.669 36.049 74.199 1.00 29.10 C ATOM 1933 CG MET A 140 -2.664 35.030 73.722 1.00 27.61 C ATOM 1934 SD MET A 140 -2.863 33.711 74.885 1.00 25.35 S ATOM 1935 CE MET A 140 -2.732 34.577 76.315 1.00 17.42 C ATOM 1936 H MET A 140 -0.195 36.880 76.067 1.00 0.00 H ATOM 1937 N ASN A 141 1.075 36.938 73.150 1.00 35.48 N ATOM 1938 CA ASN A 141 1.987 37.303 72.071 1.00 37.89 C ATOM 1939 C ASN A 141 3.246 36.470 72.241 1.00 43.31 C ATOM 1940 O ASN A 141 3.748 35.872 71.295 1.00 45.52 O ATOM 1941 CB ASN A 141 2.345 38.798 72.127 1.00 36.87 C ATOM 1942 CG ASN A 141 1.161 39.711 71.800 1.00 37.19 C ATOM 1943 OD1 ASN A 141 0.034 39.252 71.636 1.00 43.89 O ATOM 1944 ND2 ASN A 141 1.420 41.004 71.694 1.00 31.63 N ATOM 1945 H ASN A 141 0.715 37.636 73.733 1.00 0.00 H ATOM 1946 HD21 ASN A 141 2.335 41.307 71.835 1.00 0.00 H ATOM 1947 HD22 ASN A 141 0.654 41.572 71.482 1.00 0.00 H ATOM 1948 N GLU A 142 3.708 36.379 73.478 1.00 48.97 N ATOM 1949 CA GLU A 142 4.902 35.613 73.819 1.00 54.23 C ATOM 1950 C GLU A 142 4.739 34.134 73.452 1.00 53.36 C ATOM 1951 O GLU A 142 5.734 33.424 73.344 1.00 56.59 O ATOM 1952 CB GLU A 142 5.206 35.762 75.323 1.00 61.52 C ATOM 1953 CG GLU A 142 6.437 35.007 75.833 1.00 70.67 C ATOM 1954 CD GLU A 142 6.296 34.521 77.285 1.00 77.99 C ATOM 1955 OE1 GLU A 142 5.185 34.621 77.863 1.00 79.63 O ATOM 1956 OE2 GLU A 142 7.300 34.014 77.843 1.00 81.93 O ATOM 1957 H GLU A 142 3.199 36.818 74.172 1.00 0.00 H ATOM 1958 N LEU A 143 3.495 33.674 73.282 1.00 53.29 N ATOM 1959 CA LEU A 143 3.196 32.275 72.912 1.00 50.65 C ATOM 1960 C LEU A 143 3.003 32.068 71.401 1.00 47.75 C ATOM 1961 O LEU A 143 2.596 30.979 70.964 1.00 44.34 O ATOM 1962 CB LEU A 143 1.938 31.777 73.636 1.00 51.29 C ATOM 1963 CG LEU A 143 2.056 31.283 75.073 1.00 51.69 C ATOM 1964 CD1 LEU A 143 0.685 30.955 75.618 1.00 50.71 C ATOM 1965 CD2 LEU A 143 2.949 30.057 75.125 1.00 54.40 C ATOM 1966 H LEU A 143 2.739 34.279 73.417 1.00 0.00 H ATOM 1967 N ASP A 144 3.276 33.122 70.627 1.00 44.76 N ATOM 1968 CA ASP A 144 3.150 33.136 69.165 1.00 42.88 C ATOM 1969 C ASP A 144 1.691 33.244 68.716 1.00 37.71 C ATOM 1970 O ASP A 144 1.280 32.636 67.718 1.00 35.29 O ATOM 1971 CB ASP A 144 3.824 31.907 68.536 1.00 50.28 C ATOM 1972 CG ASP A 144 4.223 32.135 67.080 1.00 58.13 C ATOM 1973 OD1 ASP A 144 4.889 33.166 66.809 1.00 61.64 O ATOM 1974 OD2 ASP A 144 3.878 31.283 66.217 1.00 60.39 O ATOM 1975 H ASP A 144 3.595 33.933 71.070 1.00 0.00 H ATOM 1976 N TYR A 145 0.941 34.089 69.415 1.00 30.61 N ATOM 1977 CA TYR A 145 -0.462 34.297 69.129 1.00 25.17 C ATOM 1978 C TYR A 145 -0.734 35.767 68.909 1.00 23.74 C ATOM 1979 O TYR A 145 -0.021 36.603 69.444 1.00 25.90 O ATOM 1980 CB TYR A 145 -1.297 33.824 70.322 1.00 23.33 C ATOM 1981 CG TYR A 145 -1.503 32.332 70.389 1.00 15.70 C ATOM 1982 CD1 TYR A 145 -0.571 31.511 70.994 1.00 15.11 C ATOM 1983 CD2 TYR A 145 -2.622 31.743 69.818 1.00 12.34 C ATOM 1984 CE1 TYR A 145 -0.746 30.146 71.028 1.00 15.75 C ATOM 1985 CE2 TYR A 145 -2.803 30.380 69.841 1.00 10.83 C ATOM 1986 CZ TYR A 145 -1.864 29.583 70.447 1.00 17.35 C ATOM 1987 OH TYR A 145 -2.037 28.216 70.481 1.00 22.41 O ATOM 1988 H TYR A 145 1.317 34.622 70.152 1.00 0.00 H ATOM 1989 HH TYR A 145 -2.833 28.052 70.024 1.00 0.00 H ATOM 1990 N SER A 146 -1.695 36.089 68.050 1.00 24.22 N ATOM 1991 CA SER A 146 -2.065 37.491 67.869 1.00 25.78 C ATOM 1992 C SER A 146 -2.906 37.778 69.091 1.00 23.68 C ATOM 1993 O SER A 146 -3.104 36.905 69.932 1.00 27.17 O ATOM 1994 CB SER A 146 -2.882 37.750 66.585 1.00 27.00 C ATOM 1995 OG SER A 146 -4.004 36.891 66.421 1.00 31.89 O ATOM 1996 H SER A 146 -2.128 35.367 67.564 1.00 0.00 H ATOM 1997 HG SER A 146 -3.605 36.021 66.236 1.00 0.00 H ATOM 1998 N PHE A 147 -3.390 38.994 69.226 1.00 23.88 N ATOM 1999 CA PHE A 147 -4.209 39.279 70.370 1.00 21.50 C ATOM 2000 C PHE A 147 -5.121 40.425 70.049 1.00 25.74 C ATOM 2001 O PHE A 147 -4.713 41.591 70.137 1.00 28.06 O ATOM 2002 CB PHE A 147 -3.348 39.609 71.577 1.00 20.20 C ATOM 2003 CG PHE A 147 -4.135 39.878 72.814 1.00 22.04 C ATOM 2004 CD1 PHE A 147 -4.797 38.848 73.466 1.00 23.14 C ATOM 2005 CD2 PHE A 147 -4.183 41.148 73.357 1.00 19.22 C ATOM 2006 CE1 PHE A 147 -5.486 39.083 74.649 1.00 20.71 C ATOM 2007 CE2 PHE A 147 -4.868 41.385 74.532 1.00 17.80 C ATOM 2008 CZ PHE A 147 -5.519 40.352 75.182 1.00 18.50 C ATOM 2009 H PHE A 147 -3.150 39.729 68.628 1.00 0.00 H ATOM 2010 N HIS A 148 -6.355 40.076 69.670 1.00 24.89 N ATOM 2011 CA HIS A 148 -7.387 41.039 69.325 1.00 20.08 C ATOM 2012 C HIS A 148 -8.316 41.123 70.510 1.00 16.82 C ATOM 2013 O HIS A 148 -8.934 40.138 70.852 1.00 25.97 O ATOM 2014 CB HIS A 148 -8.188 40.538 68.134 1.00 21.21 C ATOM 2015 CG HIS A 148 -7.353 40.155 66.957 1.00 27.10 C ATOM 2016 ND1 HIS A 148 -7.294 40.913 65.805 1.00 28.26 N ATOM 2017 CD2 HIS A 148 -6.569 39.073 66.732 1.00 27.27 C ATOM 2018 CE1 HIS A 148 -6.517 40.316 64.925 1.00 26.88 C ATOM 2019 NE2 HIS A 148 -6.062 39.195 65.462 1.00 31.70 N ATOM 2020 H HIS A 148 -6.591 39.120 69.679 1.00 0.00 H ATOM 2021 HD1 HIS A 148 -7.785 41.752 65.618 1.00 0.00 H ATOM 2022 HE2 HIS A 148 -5.455 38.551 65.024 1.00 0.00 H ATOM 2023 N ALA A 149 -8.460 42.287 71.122 1.00 15.80 N ATOM 2024 CA ALA A 149 -9.345 42.395 72.270 1.00 11.74 C ATOM 2025 C ALA A 149 -10.263 43.606 72.129 1.00 15.92 C ATOM 2026 O ALA A 149 -9.805 44.672 71.753 1.00 19.10 O ATOM 2027 CB ALA A 149 -8.532 42.507 73.518 1.00 13.24 C ATOM 2028 H ALA A 149 -7.987 43.092 70.841 1.00 0.00 H ATOM 2029 N LYS A 150 -11.560 43.443 72.378 1.00 16.58 N ATOM 2030 CA LYS A 150 -12.486 44.566 72.277 1.00 18.45 C ATOM 2031 C LYS A 150 -13.670 44.421 73.227 1.00 20.93 C ATOM 2032 O LYS A 150 -14.058 43.308 73.565 1.00 29.72 O ATOM 2033 CB LYS A 150 -13.003 44.682 70.852 1.00 19.90 C ATOM 2034 CG LYS A 150 -13.830 45.919 70.599 1.00 20.96 C ATOM 2035 CD LYS A 150 -14.006 46.180 69.140 1.00 21.39 C ATOM 2036 CE LYS A 150 -14.344 47.614 68.898 1.00 23.56 C ATOM 2037 NZ LYS A 150 -14.613 47.825 67.471 1.00 31.74 N ATOM 2038 H LYS A 150 -11.898 42.565 72.663 1.00 0.00 H ATOM 2039 HZ1 LYS A 150 -15.428 47.246 67.188 1.00 0.00 H ATOM 2040 HZ2 LYS A 150 -13.775 47.546 66.927 1.00 0.00 H ATOM 2041 HZ3 LYS A 150 -14.828 48.828 67.314 1.00 0.00 H ATOM 2042 N VAL A 151 -14.243 45.535 73.667 1.00 21.94 N ATOM 2043 CA VAL A 151 -15.391 45.493 74.569 1.00 20.18 C ATOM 2044 C VAL A 151 -16.694 45.511 73.783 1.00 24.91 C ATOM 2045 O VAL A 151 -16.916 46.454 73.007 1.00 31.05 O ATOM 2046 CB VAL A 151 -15.418 46.720 75.495 1.00 20.03 C ATOM 2047 CG1 VAL A 151 -16.740 46.785 76.225 1.00 17.53 C ATOM 2048 CG2 VAL A 151 -14.292 46.659 76.504 1.00 15.22 C ATOM 2049 H VAL A 151 -13.904 46.412 73.391 1.00 0.00 H ATOM 2050 N LEU A 152 -17.551 44.500 73.987 1.00 21.89 N ATOM 2051 CA LEU A 152 -18.852 44.428 73.322 1.00 19.01 C ATOM 2052 C LEU A 152 -19.960 44.446 74.369 1.00 16.35 C ATOM 2053 O LEU A 152 -19.836 43.814 75.404 1.00 21.42 O ATOM 2054 CB LEU A 152 -18.977 43.159 72.469 1.00 19.69 C ATOM 2055 CG LEU A 152 -17.911 42.886 71.397 1.00 21.59 C ATOM 2056 CD1 LEU A 152 -18.464 41.923 70.403 1.00 21.42 C ATOM 2057 CD2 LEU A 152 -17.497 44.137 70.668 1.00 22.31 C ATOM 2058 H LEU A 152 -17.316 43.793 74.627 1.00 0.00 H ATOM 2059 N ASN A 153 -21.046 45.157 74.087 1.00 16.74 N ATOM 2060 CA ASN A 153 -22.178 45.245 75.000 1.00 16.79 C ATOM 2061 C ASN A 153 -23.293 44.377 74.475 1.00 20.80 C ATOM 2062 O ASN A 153 -23.648 44.482 73.309 1.00 25.59 O ATOM 2063 CB ASN A 153 -22.690 46.677 75.062 1.00 17.54 C ATOM 2064 CG ASN A 153 -23.507 46.945 76.284 1.00 16.53 C ATOM 2065 OD1 ASN A 153 -24.068 46.038 76.883 1.00 23.67 O ATOM 2066 ND2 ASN A 153 -23.551 48.195 76.693 1.00 16.88 N ATOM 2067 H ASN A 153 -21.084 45.615 73.219 1.00 0.00 H ATOM 2068 HD21 ASN A 153 -23.062 48.888 76.210 1.00 0.00 H ATOM 2069 HD22 ASN A 153 -24.091 48.388 77.484 1.00 0.00 H ATOM 2070 N ALA A 154 -23.862 43.534 75.334 1.00 24.61 N ATOM 2071 CA ALA A 154 -24.949 42.647 74.944 1.00 18.08 C ATOM 2072 C ALA A 154 -26.018 43.367 74.140 1.00 16.68 C ATOM 2073 O ALA A 154 -26.418 42.895 73.095 1.00 23.50 O ATOM 2074 CB ALA A 154 -25.570 41.991 76.174 1.00 14.59 C ATOM 2075 H ALA A 154 -23.504 43.499 76.245 1.00 0.00 H ATOM 2076 N LEU A 155 -26.441 44.532 74.606 1.00 17.77 N ATOM 2077 CA LEU A 155 -27.506 45.327 73.964 1.00 17.93 C ATOM 2078 C LEU A 155 -27.304 45.691 72.508 1.00 16.05 C ATOM 2079 O LEU A 155 -28.238 46.106 71.827 1.00 14.13 O ATOM 2080 CB LEU A 155 -27.769 46.616 74.763 1.00 15.89 C ATOM 2081 CG LEU A 155 -26.712 47.719 74.710 1.00 17.72 C ATOM 2082 CD1 LEU A 155 -27.042 48.672 73.595 1.00 24.50 C ATOM 2083 CD2 LEU A 155 -26.680 48.474 76.009 1.00 14.41 C ATOM 2084 H LEU A 155 -26.036 44.859 75.440 1.00 0.00 H ATOM 2085 N ASP A 156 -26.060 45.625 72.064 1.00 17.47 N ATOM 2086 CA ASP A 156 -25.716 45.951 70.694 1.00 13.59 C ATOM 2087 C ASP A 156 -25.844 44.719 69.807 1.00 15.84 C ATOM 2088 O ASP A 156 -25.682 44.810 68.591 1.00 14.76 O ATOM 2089 CB ASP A 156 -24.277 46.481 70.621 1.00 18.74 C ATOM 2090 CG ASP A 156 -24.174 47.961 70.920 1.00 22.74 C ATOM 2091 OD1 ASP A 156 -25.052 48.712 70.449 1.00 27.39 O ATOM 2092 OD2 ASP A 156 -23.212 48.383 71.613 1.00 21.41 O ATOM 2093 H ASP A 156 -25.365 45.314 72.671 1.00 0.00 H ATOM 2094 N TYR A 157 -26.087 43.565 70.420 1.00 14.50 N ATOM 2095 CA TYR A 157 -26.200 42.349 69.666 1.00 11.83 C ATOM 2096 C TYR A 157 -27.555 41.650 69.690 1.00 16.65 C ATOM 2097 O TYR A 157 -27.664 40.480 69.345 1.00 19.21 O ATOM 2098 CB TYR A 157 -25.025 41.432 70.002 1.00 13.96 C ATOM 2099 CG TYR A 157 -23.724 42.114 69.644 1.00 12.31 C ATOM 2100 CD1 TYR A 157 -23.092 42.965 70.554 1.00 16.54 C ATOM 2101 CD2 TYR A 157 -23.229 42.060 68.346 1.00 8.53 C ATOM 2102 CE1 TYR A 157 -22.021 43.752 70.174 1.00 13.58 C ATOM 2103 CE2 TYR A 157 -22.167 42.840 67.951 1.00 10.92 C ATOM 2104 CZ TYR A 157 -21.559 43.695 68.867 1.00 16.97 C ATOM 2105 OH TYR A 157 -20.496 44.502 68.471 1.00 13.72 O ATOM 2106 H TYR A 157 -26.191 43.555 71.389 1.00 0.00 H ATOM 2107 HH TYR A 157 -20.228 44.314 67.565 1.00 0.00 H ATOM 2108 N GLY A 158 -28.607 42.396 70.006 1.00 16.90 N ATOM 2109 CA GLY A 158 -29.930 41.800 70.005 1.00 16.74 C ATOM 2110 C GLY A 158 -30.476 41.232 71.303 1.00 17.80 C ATOM 2111 O GLY A 158 -31.556 40.623 71.294 1.00 18.83 O ATOM 2112 H GLY A 158 -28.460 43.341 70.255 1.00 0.00 H ATOM 2113 N ILE A 159 -29.759 41.426 72.409 1.00 16.46 N ATOM 2114 CA ILE A 159 -30.198 40.918 73.706 1.00 18.82 C ATOM 2115 C ILE A 159 -30.466 42.093 74.645 1.00 19.47 C ATOM 2116 O ILE A 159 -29.596 42.914 74.902 1.00 21.34 O ATOM 2117 CB ILE A 159 -29.143 39.984 74.301 1.00 18.53 C ATOM 2118 CG1 ILE A 159 -29.153 38.643 73.544 1.00 16.58 C ATOM 2119 CG2 ILE A 159 -29.350 39.816 75.822 1.00 22.16 C ATOM 2120 CD1 ILE A 159 -30.437 37.835 73.655 1.00 6.24 C ATOM 2121 H ILE A 159 -28.906 41.906 72.378 1.00 0.00 H ATOM 2122 N PRO A 160 -31.695 42.204 75.145 1.00 17.60 N ATOM 2123 CA PRO A 160 -32.001 43.312 76.036 1.00 13.37 C ATOM 2124 C PRO A 160 -31.294 43.184 77.369 1.00 17.06 C ATOM 2125 O PRO A 160 -31.908 42.825 78.363 1.00 16.58 O ATOM 2126 CB PRO A 160 -33.500 43.193 76.195 1.00 11.46 C ATOM 2127 CG PRO A 160 -33.706 41.720 76.155 1.00 16.62 C ATOM 2128 CD PRO A 160 -32.860 41.324 74.983 1.00 14.86 C ATOM 2129 N GLN A 161 -29.998 43.459 77.394 1.00 16.52 N ATOM 2130 CA GLN A 161 -29.255 43.409 78.643 1.00 17.29 C ATOM 2131 C GLN A 161 -28.013 44.222 78.515 1.00 15.96 C ATOM 2132 O GLN A 161 -27.352 44.192 77.472 1.00 17.92 O ATOM 2133 CB GLN A 161 -28.813 41.995 78.999 1.00 20.81 C ATOM 2134 CG GLN A 161 -28.061 41.934 80.336 1.00 8.86 C ATOM 2135 CD GLN A 161 -27.468 40.575 80.645 1.00 9.68 C ATOM 2136 OE1 GLN A 161 -26.971 40.363 81.725 1.00 7.86 O ATOM 2137 NE2 GLN A 161 -27.491 39.666 79.691 1.00 13.62 N ATOM 2138 H GLN A 161 -29.489 43.704 76.584 1.00 0.00 H ATOM 2139 HE21 GLN A 161 -27.881 39.818 78.809 1.00 0.00 H ATOM 2140 HE22 GLN A 161 -27.092 38.809 79.960 1.00 0.00 H ATOM 2141 N LYS A 162 -27.690 44.950 79.571 1.00 11.73 N ATOM 2142 CA LYS A 162 -26.481 45.732 79.560 1.00 14.05 C ATOM 2143 C LYS A 162 -25.407 44.811 80.081 1.00 13.69 C ATOM 2144 O LYS A 162 -25.425 44.418 81.241 1.00 17.57 O ATOM 2145 CB LYS A 162 -26.597 46.968 80.457 1.00 17.51 C ATOM 2146 CG LYS A 162 -25.262 47.738 80.628 1.00 25.68 C ATOM 2147 CD LYS A 162 -25.434 49.145 81.192 1.00 29.15 C ATOM 2148 CE LYS A 162 -24.100 49.823 81.460 1.00 24.97 C ATOM 2149 NZ LYS A 162 -23.438 49.254 82.651 1.00 30.82 N ATOM 2150 H LYS A 162 -28.254 44.938 80.370 1.00 0.00 H ATOM 2151 HZ1 LYS A 162 -23.297 48.234 82.515 1.00 0.00 H ATOM 2152 HZ2 LYS A 162 -24.078 49.403 83.458 1.00 0.00 H ATOM 2153 HZ3 LYS A 162 -22.523 49.719 82.822 1.00 0.00 H ATOM 2154 N ARG A 163 -24.515 44.380 79.211 1.00 15.15 N ATOM 2155 CA ARG A 163 -23.455 43.514 79.676 1.00 14.41 C ATOM 2156 C ARG A 163 -22.261 43.765 78.817 1.00 13.40 C ATOM 2157 O ARG A 163 -22.211 43.362 77.672 1.00 20.70 O ATOM 2158 CB ARG A 163 -23.884 42.058 79.666 1.00 14.45 C ATOM 2159 CG ARG A 163 -22.784 41.141 80.026 1.00 14.20 C ATOM 2160 CD ARG A 163 -23.275 39.747 80.349 1.00 13.17 C ATOM 2161 NE ARG A 163 -23.756 39.653 81.723 1.00 19.54 N ATOM 2162 CZ ARG A 163 -23.279 38.808 82.623 1.00 12.83 C ATOM 2163 NH1 ARG A 163 -22.304 37.983 82.308 1.00 24.66 N ATOM 2164 NH2 ARG A 163 -23.808 38.755 83.817 1.00 9.18 N ATOM 2165 H ARG A 163 -24.549 44.647 78.274 1.00 0.00 H ATOM 2166 HE ARG A 163 -24.486 40.254 81.989 1.00 0.00 H ATOM 2167 HH11 ARG A 163 -21.911 37.995 81.390 1.00 0.00 H ATOM 2168 HH12 ARG A 163 -21.940 37.359 82.994 1.00 0.00 H ATOM 2169 HH21 ARG A 163 -24.583 39.347 84.046 1.00 0.00 H ATOM 2170 HH22 ARG A 163 -23.446 38.118 84.498 1.00 0.00 H ATOM 2171 N GLU A 164 -21.318 44.496 79.381 1.00 13.71 N ATOM 2172 CA GLU A 164 -20.122 44.882 78.682 1.00 13.95 C ATOM 2173 C GLU A 164 -19.006 43.974 79.095 1.00 16.39 C ATOM 2174 O GLU A 164 -18.530 44.049 80.220 1.00 17.23 O ATOM 2175 CB GLU A 164 -19.803 46.319 79.039 1.00 15.50 C ATOM 2176 CG GLU A 164 -21.011 47.253 78.949 1.00 17.26 C ATOM 2177 CD GLU A 164 -20.621 48.691 79.143 1.00 20.12 C ATOM 2178 OE1 GLU A 164 -20.978 49.290 80.183 1.00 28.16 O ATOM 2179 OE2 GLU A 164 -19.928 49.218 78.259 1.00 24.98 O ATOM 2180 H GLU A 164 -21.444 44.743 80.319 1.00 0.00 H ATOM 2181 N ARG A 165 -18.552 43.146 78.168 1.00 15.95 N ATOM 2182 CA ARG A 165 -17.503 42.187 78.451 1.00 14.90 C ATOM 2183 C ARG A 165 -16.360 42.340 77.468 1.00 18.22 C ATOM 2184 O ARG A 165 -16.580 42.799 76.352 1.00 22.49 O ATOM 2185 CB ARG A 165 -18.078 40.766 78.358 1.00 8.43 C ATOM 2186 CG ARG A 165 -19.118 40.483 79.400 1.00 8.40 C ATOM 2187 CD ARG A 165 -18.509 40.771 80.772 1.00 17.52 C ATOM 2188 NE ARG A 165 -19.359 40.390 81.894 1.00 7.62 N ATOM 2189 CZ ARG A 165 -20.092 41.227 82.602 1.00 6.04 C ATOM 2190 NH1 ARG A 165 -20.098 42.515 82.316 1.00 8.66 N ATOM 2191 NH2 ARG A 165 -20.833 40.772 83.601 1.00 14.26 N ATOM 2192 H ARG A 165 -18.918 43.202 77.255 1.00 0.00 H ATOM 2193 HE ARG A 165 -19.399 39.440 82.099 1.00 0.00 H ATOM 2194 HH11 ARG A 165 -19.554 42.873 81.558 1.00 0.00 H ATOM 2195 HH12 ARG A 165 -20.665 43.126 82.862 1.00 0.00 H ATOM 2196 HH21 ARG A 165 -20.827 39.785 83.798 1.00 0.00 H ATOM 2197 HH22 ARG A 165 -21.403 41.379 84.162 1.00 0.00 H ATOM 2198 N ILE A 166 -15.144 41.975 77.879 1.00 18.17 N ATOM 2199 CA ILE A 166 -14.001 42.050 76.977 1.00 18.70 C ATOM 2200 C ILE A 166 -13.777 40.698 76.335 1.00 14.33 C ATOM 2201 O ILE A 166 -13.676 39.687 77.028 1.00 13.24 O ATOM 2202 CB ILE A 166 -12.664 42.511 77.664 1.00 21.91 C ATOM 2203 CG1 ILE A 166 -11.586 42.690 76.585 1.00 23.18 C ATOM 2204 CG2 ILE A 166 -12.173 41.495 78.708 1.00 20.85 C ATOM 2205 CD1 ILE A 166 -10.303 43.411 77.030 1.00 27.33 C ATOM 2206 H ILE A 166 -15.019 41.615 78.783 1.00 0.00 H ATOM 2207 N TYR A 167 -13.781 40.667 75.013 1.00 12.82 N ATOM 2208 CA TYR A 167 -13.532 39.432 74.298 1.00 14.65 C ATOM 2209 C TYR A 167 -12.109 39.518 73.734 1.00 18.32 C ATOM 2210 O TYR A 167 -11.734 40.531 73.149 1.00 23.46 O ATOM 2211 CB TYR A 167 -14.580 39.250 73.216 1.00 6.60 C ATOM 2212 CG TYR A 167 -15.943 39.294 73.814 1.00 6.04 C ATOM 2213 CD1 TYR A 167 -16.639 40.499 73.942 1.00 5.81 C ATOM 2214 CD2 TYR A 167 -16.520 38.144 74.335 1.00 6.70 C ATOM 2215 CE1 TYR A 167 -17.893 40.552 74.579 1.00 5.16 C ATOM 2216 CE2 TYR A 167 -17.747 38.188 74.974 1.00 10.08 C ATOM 2217 CZ TYR A 167 -18.431 39.387 75.093 1.00 7.83 C ATOM 2218 OH TYR A 167 -19.646 39.374 75.735 1.00 13.05 O ATOM 2219 H TYR A 167 -13.911 41.519 74.524 1.00 0.00 H ATOM 2220 HH TYR A 167 -19.829 40.189 76.159 1.00 0.00 H ATOM 2221 N MET A 168 -11.311 38.489 74.009 1.00 16.61 N ATOM 2222 CA MET A 168 -9.930 38.408 73.588 1.00 13.39 C ATOM 2223 C MET A 168 -9.790 37.205 72.672 1.00 18.51 C ATOM 2224 O MET A 168 -9.879 36.070 73.126 1.00 22.62 O ATOM 2225 CB MET A 168 -9.033 38.230 74.825 1.00 11.82 C ATOM 2226 CG MET A 168 -9.217 39.330 75.861 1.00 12.85 C ATOM 2227 SD MET A 168 -8.344 39.129 77.387 1.00 17.22 S ATOM 2228 CE MET A 168 -9.520 38.362 78.305 1.00 6.72 C ATOM 2229 H MET A 168 -11.723 37.741 74.500 1.00 0.00 H ATOM 2230 N ILE A 169 -9.610 37.465 71.380 1.00 20.22 N ATOM 2231 CA ILE A 169 -9.450 36.427 70.367 1.00 20.36 C ATOM 2232 C ILE A 169 -7.992 36.385 69.855 1.00 21.64 C ATOM 2233 O ILE A 169 -7.494 37.372 69.297 1.00 18.38 O ATOM 2234 CB ILE A 169 -10.395 36.696 69.158 1.00 20.18 C ATOM 2235 CG1 ILE A 169 -11.793 37.092 69.641 1.00 20.48 C ATOM 2236 CG2 ILE A 169 -10.470 35.485 68.237 1.00 24.18 C ATOM 2237 CD1 ILE A 169 -12.315 36.281 70.758 1.00 18.36 C ATOM 2238 H ILE A 169 -9.587 38.399 71.092 1.00 0.00 H ATOM 2239 N CYS A 170 -7.343 35.231 70.004 1.00 22.26 N ATOM 2240 CA CYS A 170 -5.958 35.047 69.581 1.00 23.58 C ATOM 2241 C CYS A 170 -5.835 33.901 68.595 1.00 20.51 C ATOM 2242 O CYS A 170 -6.382 32.837 68.823 1.00 27.23 O ATOM 2243 CB CYS A 170 -5.080 34.726 70.798 1.00 24.09 C ATOM 2244 SG CYS A 170 -5.639 35.489 72.325 1.00 28.77 S ATOM 2245 H CYS A 170 -7.818 34.487 70.424 1.00 0.00 H ATOM 2246 N PHE A 171 -5.159 34.139 67.481 1.00 20.98 N ATOM 2247 CA PHE A 171 -4.943 33.112 66.468 1.00 20.60 C ATOM 2248 C PHE A 171 -3.465 32.836 66.512 1.00 22.72 C ATOM 2249 O PHE A 171 -2.683 33.727 66.867 1.00 25.11 O ATOM 2250 CB PHE A 171 -5.254 33.635 65.071 1.00 17.31 C ATOM 2251 CG PHE A 171 -6.678 33.963 64.851 1.00 12.74 C ATOM 2252 CD1 PHE A 171 -7.145 35.236 65.106 1.00 11.18 C ATOM 2253 CD2 PHE A 171 -7.556 32.998 64.392 1.00 11.61 C ATOM 2254 CE1 PHE A 171 -8.484 35.553 64.912 1.00 17.45 C ATOM 2255 CE2 PHE A 171 -8.884 33.297 64.195 1.00 12.67 C ATOM 2256 CZ PHE A 171 -9.360 34.577 64.457 1.00 15.06 C ATOM 2257 H PHE A 171 -4.770 35.027 67.339 1.00 0.00 H ATOM 2258 N ARG A 172 -3.064 31.612 66.197 1.00 23.83 N ATOM 2259 CA ARG A 172 -1.637 31.294 66.177 1.00 23.21 C ATOM 2260 C ARG A 172 -1.083 32.098 65.020 1.00 27.84 C ATOM 2261 O ARG A 172 -1.753 32.260 63.994 1.00 27.62 O ATOM 2262 CB ARG A 172 -1.411 29.812 65.905 1.00 20.08 C ATOM 2263 CG ARG A 172 -0.718 29.082 67.018 1.00 20.03 C ATOM 2264 CD ARG A 172 -0.225 27.726 66.582 1.00 22.77 C ATOM 2265 NE ARG A 172 -1.271 26.720 66.393 1.00 27.45 N ATOM 2266 CZ ARG A 172 -1.558 26.149 65.222 1.00 29.44 C ATOM 2267 NH1 ARG A 172 -0.896 26.503 64.137 1.00 32.14 N ATOM 2268 NH2 ARG A 172 -2.434 25.155 65.143 1.00 33.68 N ATOM 2269 H ARG A 172 -3.740 30.931 65.990 1.00 0.00 H ATOM 2270 HE ARG A 172 -1.803 26.462 67.173 1.00 0.00 H ATOM 2271 HH11 ARG A 172 -0.175 27.190 64.180 1.00 0.00 H ATOM 2272 HH12 ARG A 172 -1.113 26.064 63.265 1.00 0.00 H ATOM 2273 HH21 ARG A 172 -2.897 24.831 65.970 1.00 0.00 H ATOM 2274 HH22 ARG A 172 -2.648 24.736 64.261 1.00 0.00 H ATOM 2275 N ASN A 173 0.134 32.605 65.164 1.00 34.34 N ATOM 2276 CA ASN A 173 0.730 33.400 64.088 1.00 38.79 C ATOM 2277 C ASN A 173 0.900 32.603 62.798 1.00 38.98 C ATOM 2278 O ASN A 173 0.790 33.155 61.701 1.00 40.73 O ATOM 2279 CB ASN A 173 2.062 34.020 64.528 1.00 43.09 C ATOM 2280 CG ASN A 173 1.880 35.239 65.432 1.00 43.86 C ATOM 2281 OD1 ASN A 173 1.051 36.118 65.161 1.00 46.31 O ATOM 2282 ND2 ASN A 173 2.677 35.311 66.493 1.00 43.12 N ATOM 2283 H ASN A 173 0.598 32.461 66.014 1.00 0.00 H ATOM 2284 HD21 ASN A 173 3.341 34.617 66.638 1.00 0.00 H ATOM 2285 HD22 ASN A 173 2.555 36.074 67.089 1.00 0.00 H ATOM 2286 N ASP A 174 1.078 31.293 62.943 1.00 39.85 N ATOM 2287 CA ASP A 174 1.252 30.370 61.816 1.00 39.98 C ATOM 2288 C ASP A 174 0.168 30.640 60.794 1.00 39.85 C ATOM 2289 O ASP A 174 0.433 30.833 59.617 1.00 42.08 O ATOM 2290 CB ASP A 174 1.045 28.907 62.246 1.00 44.24 C ATOM 2291 CG ASP A 174 1.782 28.525 63.525 1.00 53.03 C ATOM 2292 OD1 ASP A 174 2.198 29.402 64.323 1.00 58.17 O ATOM 2293 OD2 ASP A 174 1.926 27.301 63.744 1.00 56.92 O ATOM 2294 H ASP A 174 1.057 30.976 63.866 1.00 0.00 H ATOM 2295 N LEU A 175 -1.059 30.696 61.295 1.00 38.65 N ATOM 2296 CA LEU A 175 -2.249 30.881 60.490 1.00 34.85 C ATOM 2297 C LEU A 175 -2.283 32.138 59.667 1.00 34.89 C ATOM 2298 O LEU A 175 -3.044 32.220 58.708 1.00 36.30 O ATOM 2299 CB LEU A 175 -3.491 30.789 61.376 1.00 35.49 C ATOM 2300 CG LEU A 175 -3.552 29.510 62.212 1.00 27.14 C ATOM 2301 CD1 LEU A 175 -4.742 29.517 63.144 1.00 23.19 C ATOM 2302 CD2 LEU A 175 -3.596 28.337 61.278 1.00 26.45 C ATOM 2303 H LEU A 175 -1.160 30.663 62.265 1.00 0.00 H ATOM 2304 N ASN A 176 -1.494 33.129 60.052 1.00 36.28 N ATOM 2305 CA ASN A 176 -1.452 34.368 59.289 1.00 40.27 C ATOM 2306 C ASN A 176 -2.864 34.935 59.126 1.00 35.75 C ATOM 2307 O ASN A 176 -3.340 35.201 58.020 1.00 36.64 O ATOM 2308 CB ASN A 176 -0.784 34.093 57.931 1.00 47.75 C ATOM 2309 CG ASN A 176 -0.846 35.276 56.983 1.00 55.92 C ATOM 2310 OD1 ASN A 176 -0.920 35.095 55.759 1.00 63.63 O ATOM 2311 ND2 ASN A 176 -0.794 36.491 57.531 1.00 56.90 N ATOM 2312 H ASN A 176 -0.900 33.015 60.820 1.00 0.00 H ATOM 2313 HD21 ASN A 176 -0.690 36.637 58.485 1.00 0.00 H ATOM 2314 HD22 ASN A 176 -0.882 37.207 56.869 1.00 0.00 H ATOM 2315 N ILE A 177 -3.533 35.106 60.254 1.00 31.37 N ATOM 2316 CA ILE A 177 -4.885 35.624 60.248 1.00 30.17 C ATOM 2317 C ILE A 177 -4.842 37.129 60.303 1.00 29.96 C ATOM 2318 O ILE A 177 -4.476 37.715 61.318 1.00 32.62 O ATOM 2319 CB ILE A 177 -5.682 35.059 61.417 1.00 29.23 C ATOM 2320 CG1 ILE A 177 -5.821 33.541 61.258 1.00 25.38 C ATOM 2321 CG2 ILE A 177 -7.013 35.756 61.538 1.00 29.23 C ATOM 2322 CD1 ILE A 177 -6.384 33.099 59.919 1.00 21.70 C ATOM 2323 H ILE A 177 -3.137 34.866 61.108 1.00 0.00 H ATOM 2324 N GLN A 178 -5.215 37.745 59.193 1.00 29.45 N ATOM 2325 CA GLN A 178 -5.206 39.197 59.057 1.00 31.84 C ATOM 2326 C GLN A 178 -6.589 39.820 58.776 1.00 30.54 C ATOM 2327 O GLN A 178 -6.694 41.038 58.605 1.00 28.64 O ATOM 2328 CB GLN A 178 -4.263 39.584 57.908 1.00 38.59 C ATOM 2329 CG GLN A 178 -2.806 39.141 58.057 1.00 47.62 C ATOM 2330 CD GLN A 178 -1.912 40.218 58.664 1.00 52.81 C ATOM 2331 OE1 GLN A 178 -1.682 41.278 58.057 1.00 55.74 O ATOM 2332 NE2 GLN A 178 -1.377 39.940 59.852 1.00 57.00 N ATOM 2333 H GLN A 178 -5.498 37.193 58.430 1.00 0.00 H ATOM 2334 HE21 GLN A 178 -1.599 39.097 60.287 1.00 0.00 H ATOM 2335 HE22 GLN A 178 -0.769 40.605 60.227 1.00 0.00 H ATOM 2336 N ASN A 179 -7.640 38.997 58.734 1.00 30.77 N ATOM 2337 CA ASN A 179 -8.997 39.476 58.431 1.00 27.75 C ATOM 2338 C ASN A 179 -10.020 39.391 59.569 1.00 26.41 C ATOM 2339 O ASN A 179 -11.213 39.622 59.346 1.00 28.70 O ATOM 2340 CB ASN A 179 -9.537 38.715 57.216 1.00 27.79 C ATOM 2341 CG ASN A 179 -9.654 37.230 57.470 1.00 27.17 C ATOM 2342 OD1 ASN A 179 -9.391 36.765 58.575 1.00 33.43 O ATOM 2343 ND2 ASN A 179 -10.074 36.482 56.466 1.00 27.10 N ATOM 2344 H ASN A 179 -7.534 38.040 58.925 1.00 0.00 H ATOM 2345 HD21 ASN A 179 -10.310 36.893 55.611 1.00 0.00 H ATOM 2346 HD22 ASN A 179 -10.117 35.518 56.619 1.00 0.00 H ATOM 2347 N PHE A 180 -9.571 39.032 60.769 1.00 24.35 N ATOM 2348 CA PHE A 180 -10.478 38.928 61.894 1.00 24.20 C ATOM 2349 C PHE A 180 -11.093 40.262 62.248 1.00 27.25 C ATOM 2350 O PHE A 180 -10.445 41.299 62.189 1.00 29.78 O ATOM 2351 CB PHE A 180 -9.820 38.366 63.143 1.00 20.67 C ATOM 2352 CG PHE A 180 -10.782 38.226 64.265 1.00 19.69 C ATOM 2353 CD1 PHE A 180 -11.824 37.323 64.173 1.00 20.53 C ATOM 2354 CD2 PHE A 180 -10.738 39.080 65.347 1.00 23.40 C ATOM 2355 CE1 PHE A 180 -12.805 37.287 65.128 1.00 21.83 C ATOM 2356 CE2 PHE A 180 -11.725 39.047 66.315 1.00 18.65 C ATOM 2357 CZ PHE A 180 -12.757 38.156 66.202 1.00 19.52 C ATOM 2358 H PHE A 180 -8.623 38.889 60.885 1.00 0.00 H ATOM 2359 N GLN A 181 -12.346 40.227 62.658 1.00 30.89 N ATOM 2360 CA GLN A 181 -13.038 41.445 63.015 1.00 30.00 C ATOM 2361 C GLN A 181 -14.154 41.087 63.967 1.00 29.47 C ATOM 2362 O GLN A 181 -14.652 39.958 63.934 1.00 32.01 O ATOM 2363 CB GLN A 181 -13.606 42.110 61.761 1.00 35.93 C ATOM 2364 CG GLN A 181 -14.600 41.273 60.959 1.00 36.40 C ATOM 2365 CD GLN A 181 -15.014 41.977 59.679 1.00 39.40 C ATOM 2366 OE1 GLN A 181 -15.980 42.738 59.655 1.00 42.03 O ATOM 2367 NE2 GLN A 181 -14.253 41.763 58.617 1.00 43.46 N ATOM 2368 H GLN A 181 -12.850 39.388 62.719 1.00 0.00 H ATOM 2369 HE21 GLN A 181 -13.482 41.170 58.728 1.00 0.00 H ATOM 2370 HE22 GLN A 181 -14.498 42.211 57.785 1.00 0.00 H ATOM 2371 N PHE A 182 -14.489 42.027 64.848 1.00 24.63 N ATOM 2372 CA PHE A 182 -15.553 41.842 65.814 1.00 19.06 C ATOM 2373 C PHE A 182 -16.862 42.184 65.155 1.00 23.52 C ATOM 2374 O PHE A 182 -16.912 43.060 64.298 1.00 27.33 O ATOM 2375 CB PHE A 182 -15.317 42.707 67.018 1.00 13.92 C ATOM 2376 CG PHE A 182 -14.364 42.112 67.969 1.00 9.11 C ATOM 2377 CD1 PHE A 182 -13.016 42.399 67.881 1.00 8.45 C ATOM 2378 CD2 PHE A 182 -14.810 41.222 68.938 1.00 11.08 C ATOM 2379 CE1 PHE A 182 -12.109 41.802 68.747 1.00 13.32 C ATOM 2380 CE2 PHE A 182 -13.928 40.618 69.814 1.00 11.08 C ATOM 2381 CZ PHE A 182 -12.567 40.904 69.722 1.00 15.24 C ATOM 2382 H PHE A 182 -14.050 42.910 64.823 1.00 0.00 H ATOM 2383 N PRO A 183 -17.946 41.505 65.550 1.00 24.19 N ATOM 2384 CA PRO A 183 -19.241 41.778 64.939 1.00 24.41 C ATOM 2385 C PRO A 183 -19.640 43.233 64.979 1.00 25.93 C ATOM 2386 O PRO A 183 -19.428 43.940 65.963 1.00 33.59 O ATOM 2387 CB PRO A 183 -20.192 40.884 65.738 1.00 26.73 C ATOM 2388 CG PRO A 183 -19.545 40.796 67.075 1.00 23.42 C ATOM 2389 CD PRO A 183 -18.089 40.621 66.721 1.00 23.98 C ATOM 2390 N LYS A 184 -20.176 43.691 63.871 1.00 27.45 N ATOM 2391 CA LYS A 184 -20.615 45.052 63.763 1.00 27.78 C ATOM 2392 C LYS A 184 -21.937 45.095 64.503 1.00 26.38 C ATOM 2393 O LYS A 184 -22.717 44.157 64.455 1.00 27.17 O ATOM 2394 CB LYS A 184 -20.805 45.420 62.285 1.00 36.36 C ATOM 2395 CG LYS A 184 -21.277 46.843 62.059 1.00 48.17 C ATOM 2396 CD LYS A 184 -21.497 47.214 60.600 1.00 50.03 C ATOM 2397 CE LYS A 184 -21.993 48.662 60.553 1.00 56.62 C ATOM 2398 NZ LYS A 184 -22.080 49.265 59.195 1.00 63.03 N ATOM 2399 H LYS A 184 -20.303 43.087 63.101 1.00 0.00 H ATOM 2400 HZ1 LYS A 184 -22.744 48.704 58.622 1.00 0.00 H ATOM 2401 HZ2 LYS A 184 -21.147 49.290 58.743 1.00 0.00 H ATOM 2402 HZ3 LYS A 184 -22.454 50.230 59.324 1.00 0.00 H ATOM 2403 N PRO A 185 -22.172 46.163 65.259 1.00 26.49 N ATOM 2404 CA PRO A 185 -23.416 46.296 66.004 1.00 23.18 C ATOM 2405 C PRO A 185 -24.618 46.422 65.091 1.00 25.19 C ATOM 2406 O PRO A 185 -24.500 46.619 63.872 1.00 23.08 O ATOM 2407 CB PRO A 185 -23.204 47.596 66.772 1.00 25.54 C ATOM 2408 CG PRO A 185 -21.720 47.653 66.961 1.00 24.30 C ATOM 2409 CD PRO A 185 -21.232 47.241 65.610 1.00 24.34 C ATOM 2410 N PHE A 186 -25.790 46.327 65.699 1.00 24.08 N ATOM 2411 CA PHE A 186 -27.028 46.457 64.970 1.00 24.51 C ATOM 2412 C PHE A 186 -28.142 46.874 65.919 1.00 26.31 C ATOM 2413 O PHE A 186 -28.019 46.746 67.136 1.00 29.54 O ATOM 2414 CB PHE A 186 -27.363 45.185 64.171 1.00 22.49 C ATOM 2415 CG PHE A 186 -27.441 43.910 64.989 1.00 22.56 C ATOM 2416 CD1 PHE A 186 -28.648 43.484 65.519 1.00 15.88 C ATOM 2417 CD2 PHE A 186 -26.324 43.087 65.138 1.00 20.83 C ATOM 2418 CE1 PHE A 186 -28.746 42.266 66.176 1.00 14.64 C ATOM 2419 CE2 PHE A 186 -26.418 41.868 65.797 1.00 20.13 C ATOM 2420 CZ PHE A 186 -27.630 41.457 66.316 1.00 15.62 C ATOM 2421 H PHE A 186 -25.856 46.132 66.668 1.00 0.00 H ATOM 2422 N GLU A 187 -29.177 47.472 65.347 1.00 27.80 N ATOM 2423 CA GLU A 187 -30.332 47.971 66.084 1.00 27.90 C ATOM 2424 C GLU A 187 -31.005 46.907 66.973 1.00 27.34 C ATOM 2425 O GLU A 187 -31.276 45.798 66.515 1.00 32.92 O ATOM 2426 CB GLU A 187 -31.328 48.552 65.070 1.00 28.78 C ATOM 2427 CG GLU A 187 -32.347 49.502 65.700 1.00 41.12 C ATOM 2428 CD GLU A 187 -33.320 50.177 64.731 1.00 41.48 C ATOM 2429 OE1 GLU A 187 -33.263 49.956 63.479 1.00 45.52 O ATOM 2430 OE2 GLU A 187 -34.153 50.952 65.243 1.00 45.23 O ATOM 2431 H GLU A 187 -29.153 47.570 64.368 1.00 0.00 H ATOM 2432 N LEU A 188 -31.245 47.238 68.239 1.00 25.40 N ATOM 2433 CA LEU A 188 -31.885 46.324 69.189 1.00 21.43 C ATOM 2434 C LEU A 188 -33.389 46.344 68.956 1.00 25.03 C ATOM 2435 O LEU A 188 -33.991 47.410 68.906 1.00 25.23 O ATOM 2436 CB LEU A 188 -31.574 46.757 70.633 1.00 13.77 C ATOM 2437 CG LEU A 188 -32.196 45.979 71.800 1.00 11.34 C ATOM 2438 CD1 LEU A 188 -31.831 44.511 71.715 1.00 10.66 C ATOM 2439 CD2 LEU A 188 -31.756 46.551 73.117 1.00 8.91 C ATOM 2440 H LEU A 188 -31.016 48.132 68.562 1.00 0.00 H ATOM 2441 N ASN A 189 -33.995 45.169 68.813 1.00 31.46 N ATOM 2442 CA ASN A 189 -35.441 45.069 68.574 1.00 35.32 C ATOM 2443 C ASN A 189 -36.246 44.334 69.656 1.00 33.91 C ATOM 2444 O ASN A 189 -37.463 44.222 69.556 1.00 32.43 O ATOM 2445 CB ASN A 189 -35.718 44.457 67.189 1.00 38.89 C ATOM 2446 CG ASN A 189 -35.681 45.495 66.069 0.50 44.57 C ATOM 2447 OD1 ASN A 189 -36.583 46.325 65.949 0.50 48.64 O ATOM 2448 ND2 ASN A 189 -34.645 45.443 65.239 0.50 46.03 N ATOM 2449 H ASN A 189 -33.426 44.377 68.849 1.00 0.00 H ATOM 2450 HD21 ASN A 189 -33.944 44.776 65.370 1.00 0.00 H ATOM 2451 HD22 ASN A 189 -34.654 46.107 64.522 1.00 0.00 H ATOM 2452 N THR A 190 -35.570 43.894 70.715 1.00 33.68 N ATOM 2453 CA THR A 190 -36.199 43.166 71.818 1.00 29.09 C ATOM 2454 C THR A 190 -35.796 43.845 73.135 1.00 29.37 C ATOM 2455 O THR A 190 -34.659 44.321 73.250 1.00 30.04 O ATOM 2456 CB THR A 190 -35.717 41.693 71.806 1.00 31.95 C ATOM 2457 OG1 THR A 190 -36.011 41.111 70.530 1.00 35.71 O ATOM 2458 CG2 THR A 190 -36.382 40.870 72.901 1.00 32.58 C ATOM 2459 H THR A 190 -34.614 44.079 70.812 1.00 0.00 H ATOM 2460 HG1 THR A 190 -36.972 41.076 70.421 1.00 0.00 H ATOM 2461 N PHE A 191 -36.727 43.901 74.101 1.00 24.36 N ATOM 2462 CA PHE A 191 -36.515 44.525 75.423 1.00 21.73 C ATOM 2463 C PHE A 191 -36.966 43.601 76.536 1.00 16.95 C ATOM 2464 O PHE A 191 -37.539 42.553 76.271 1.00 20.42 O ATOM 2465 CB PHE A 191 -37.226 45.879 75.511 1.00 19.67 C ATOM 2466 CG PHE A 191 -36.851 46.816 74.388 1.00 24.50 C ATOM 2467 CD1 PHE A 191 -37.442 46.688 73.127 1.00 27.30 C ATOM 2468 CD2 PHE A 191 -35.867 47.786 74.560 1.00 22.77 C ATOM 2469 CE1 PHE A 191 -37.047 47.510 72.049 1.00 24.02 C ATOM 2470 CE2 PHE A 191 -35.467 48.612 73.490 1.00 20.15 C ATOM 2471 CZ PHE A 191 -36.060 48.471 72.233 1.00 18.66 C ATOM 2472 H PHE A 191 -37.587 43.468 73.946 1.00 0.00 H ATOM 2473 N VAL A 192 -36.752 43.984 77.782 1.00 15.55 N ATOM 2474 CA VAL A 192 -37.114 43.081 78.866 1.00 18.73 C ATOM 2475 C VAL A 192 -38.549 42.575 78.767 1.00 22.37 C ATOM 2476 O VAL A 192 -38.771 41.380 78.626 1.00 23.39 O ATOM 2477 CB VAL A 192 -36.813 43.690 80.258 1.00 17.16 C ATOM 2478 CG1 VAL A 192 -36.959 42.635 81.375 1.00 11.81 C ATOM 2479 CG2 VAL A 192 -35.411 44.226 80.276 1.00 13.50 C ATOM 2480 H VAL A 192 -36.374 44.876 77.965 1.00 0.00 H ATOM 2481 N LYS A 193 -39.505 43.489 78.685 1.00 27.44 N ATOM 2482 CA LYS A 193 -40.934 43.137 78.620 1.00 32.58 C ATOM 2483 C LYS A 193 -41.286 42.005 77.647 1.00 32.48 C ATOM 2484 O LYS A 193 -42.324 41.366 77.775 1.00 32.65 O ATOM 2485 CB LYS A 193 -41.741 44.363 78.218 1.00 36.59 C ATOM 2486 CG LYS A 193 -41.714 44.551 76.725 1.00 41.23 C ATOM 2487 CD LYS A 193 -42.565 45.682 76.245 1.00 44.40 C ATOM 2488 CE LYS A 193 -42.913 45.457 74.788 1.00 47.73 C ATOM 2489 NZ LYS A 193 -41.728 44.957 74.046 1.00 47.56 N ATOM 2490 H LYS A 193 -39.246 44.436 78.647 1.00 0.00 H ATOM 2491 HZ1 LYS A 193 -41.470 44.053 74.481 1.00 0.00 H ATOM 2492 HZ2 LYS A 193 -40.900 45.585 74.135 1.00 0.00 H ATOM 2493 HZ3 LYS A 193 -41.944 44.786 73.045 1.00 0.00 H ATOM 2494 N ASP A 194 -40.437 41.811 76.648 1.00 33.51 N ATOM 2495 CA ASP A 194 -40.626 40.784 75.636 1.00 34.01 C ATOM 2496 C ASP A 194 -40.271 39.377 76.084 1.00 35.04 C ATOM 2497 O ASP A 194 -40.804 38.398 75.565 1.00 39.11 O ATOM 2498 CB ASP A 194 -39.772 41.115 74.421 1.00 34.72 C ATOM 2499 CG ASP A 194 -40.318 42.265 73.645 1.00 37.33 C ATOM 2500 OD1 ASP A 194 -41.549 42.410 73.610 1.00 44.30 O ATOM 2501 OD2 ASP A 194 -39.531 43.017 73.051 1.00 44.19 O ATOM 2502 H ASP A 194 -39.628 42.364 76.602 1.00 0.00 H ATOM 2503 N LEU A 195 -39.298 39.281 76.976 1.00 32.27 N ATOM 2504 CA LEU A 195 -38.847 37.999 77.470 1.00 28.02 C ATOM 2505 C LEU A 195 -39.576 37.596 78.757 1.00 29.00 C ATOM 2506 O LEU A 195 -39.432 36.461 79.221 1.00 29.89 O ATOM 2507 CB LEU A 195 -37.326 38.051 77.707 1.00 24.46 C ATOM 2508 CG LEU A 195 -36.456 38.571 76.554 1.00 25.72 C ATOM 2509 CD1 LEU A 195 -35.022 38.649 77.022 1.00 27.93 C ATOM 2510 CD2 LEU A 195 -36.561 37.707 75.289 1.00 21.64 C ATOM 2511 H LEU A 195 -38.876 40.099 77.295 1.00 0.00 H ATOM 2512 N LEU A 196 -40.349 38.518 79.334 1.00 25.56 N ATOM 2513 CA LEU A 196 -41.062 38.259 80.584 1.00 23.30 C ATOM 2514 C LEU A 196 -42.091 37.136 80.483 1.00 26.53 C ATOM 2515 O LEU A 196 -42.820 37.070 79.500 1.00 32.41 O ATOM 2516 CB LEU A 196 -41.745 39.541 81.053 1.00 19.34 C ATOM 2517 CG LEU A 196 -40.848 40.725 81.423 1.00 19.95 C ATOM 2518 CD1 LEU A 196 -41.674 41.933 81.743 1.00 14.12 C ATOM 2519 CD2 LEU A 196 -39.989 40.366 82.619 1.00 23.29 C ATOM 2520 H LEU A 196 -40.473 39.384 78.886 1.00 0.00 H ATOM 2521 N LEU A 197 -42.145 36.260 81.496 1.00 24.94 N ATOM 2522 CA LEU A 197 -43.110 35.138 81.557 1.00 18.59 C ATOM 2523 C LEU A 197 -44.493 35.701 81.904 1.00 20.94 C ATOM 2524 O LEU A 197 -44.620 36.888 82.223 1.00 15.04 O ATOM 2525 CB LEU A 197 -42.704 34.157 82.668 1.00 15.03 C ATOM 2526 CG LEU A 197 -41.413 33.365 82.493 1.00 16.71 C ATOM 2527 CD1 LEU A 197 -41.015 32.678 83.764 1.00 13.74 C ATOM 2528 CD2 LEU A 197 -41.596 32.352 81.410 1.00 16.23 C ATOM 2529 H LEU A 197 -41.537 36.317 82.232 1.00 0.00 H ATOM 2530 N PRO A 198 -45.555 34.870 81.832 1.00 25.68 N ATOM 2531 CA PRO A 198 -46.882 35.391 82.169 1.00 26.04 C ATOM 2532 C PRO A 198 -46.949 35.541 83.687 1.00 29.27 C ATOM 2533 O PRO A 198 -46.408 34.698 84.416 1.00 29.09 O ATOM 2534 CB PRO A 198 -47.823 34.292 81.670 1.00 22.02 C ATOM 2535 CG PRO A 198 -47.062 33.667 80.556 1.00 26.48 C ATOM 2536 CD PRO A 198 -45.686 33.561 81.174 1.00 26.46 C ATOM 2537 N ASP A 199 -47.635 36.591 84.148 1.00 30.90 N ATOM 2538 CA ASP A 199 -47.770 36.897 85.563 1.00 29.15 C ATOM 2539 C ASP A 199 -48.084 35.670 86.389 1.00 31.67 C ATOM 2540 O ASP A 199 -47.632 35.558 87.524 1.00 31.12 O ATOM 2541 CB ASP A 199 -48.852 37.957 85.793 1.00 26.83 C ATOM 2542 CG ASP A 199 -48.439 39.345 85.329 1.00 31.32 C ATOM 2543 OD1 ASP A 199 -47.322 39.515 84.806 1.00 31.68 O ATOM 2544 OD2 ASP A 199 -49.237 40.291 85.507 1.00 34.00 O ATOM 2545 H ASP A 199 -48.082 37.161 83.464 1.00 0.00 H ATOM 2546 N SER A 200 -48.826 34.734 85.810 1.00 34.83 N ATOM 2547 CA SER A 200 -49.215 33.519 86.529 1.00 36.56 C ATOM 2548 C SER A 200 -48.067 32.719 87.092 1.00 35.86 C ATOM 2549 O SER A 200 -48.140 32.241 88.220 1.00 37.96 O ATOM 2550 CB SER A 200 -50.083 32.604 85.649 1.00 37.45 C ATOM 2551 OG SER A 200 -49.477 32.347 84.395 1.00 39.78 O ATOM 2552 H SER A 200 -49.138 34.871 84.887 1.00 0.00 H ATOM 2553 HG SER A 200 -48.672 31.830 84.492 1.00 0.00 H ATOM 2554 N GLU A 201 -46.999 32.598 86.317 1.00 35.00 N ATOM 2555 CA GLU A 201 -45.851 31.813 86.740 1.00 34.13 C ATOM 2556 C GLU A 201 -44.819 32.580 87.574 1.00 31.98 C ATOM 2557 O GLU A 201 -43.835 31.991 88.016 1.00 32.68 O ATOM 2558 CB GLU A 201 -45.158 31.218 85.515 1.00 35.31 C ATOM 2559 CG GLU A 201 -46.088 30.905 84.348 1.00 42.54 C ATOM 2560 CD GLU A 201 -45.373 30.265 83.155 1.00 47.41 C ATOM 2561 OE1 GLU A 201 -44.393 29.516 83.364 1.00 55.67 O ATOM 2562 OE2 GLU A 201 -45.801 30.492 82.000 1.00 46.98 O ATOM 2563 H GLU A 201 -46.960 33.083 85.464 1.00 0.00 H ATOM 2564 N VAL A 202 -45.058 33.861 87.844 1.00 30.83 N ATOM 2565 CA VAL A 202 -44.089 34.680 88.579 1.00 29.47 C ATOM 2566 C VAL A 202 -44.636 35.384 89.830 1.00 32.36 C ATOM 2567 O VAL A 202 -43.937 36.181 90.449 1.00 32.76 O ATOM 2568 CB VAL A 202 -43.508 35.782 87.646 1.00 28.92 C ATOM 2569 CG1 VAL A 202 -42.337 36.422 88.286 1.00 37.45 C ATOM 2570 CG2 VAL A 202 -43.073 35.215 86.310 1.00 27.86 C ATOM 2571 H VAL A 202 -45.887 34.277 87.517 1.00 0.00 H ATOM 2572 N GLU A 203 -45.877 35.099 90.211 1.00 37.57 N ATOM 2573 CA GLU A 203 -46.495 35.733 91.379 1.00 39.74 C ATOM 2574 C GLU A 203 -45.526 35.805 92.555 1.00 37.98 C ATOM 2575 O GLU A 203 -45.317 36.859 93.147 1.00 37.63 O ATOM 2576 CB GLU A 203 -47.734 34.942 91.838 1.00 48.75 C ATOM 2577 CG GLU A 203 -49.016 35.093 91.003 1.00 58.38 C ATOM 2578 CD GLU A 203 -50.247 34.453 91.669 1.00 64.08 C ATOM 2579 OE1 GLU A 203 -50.100 33.843 92.757 1.00 66.12 O ATOM 2580 OE2 GLU A 203 -51.365 34.571 91.105 1.00 66.23 O ATOM 2581 H GLU A 203 -46.409 34.476 89.675 1.00 0.00 H ATOM 2582 N HIS A 204 -44.941 34.652 92.858 1.00 36.28 N ATOM 2583 CA HIS A 204 -44.003 34.443 93.959 1.00 36.65 C ATOM 2584 C HIS A 204 -42.689 35.240 94.026 1.00 36.01 C ATOM 2585 O HIS A 204 -41.939 35.107 95.001 1.00 35.53 O ATOM 2586 CB HIS A 204 -43.675 32.961 94.021 1.00 38.31 C ATOM 2587 CG HIS A 204 -43.246 32.397 92.706 1.00 45.93 C ATOM 2588 ND1 HIS A 204 -41.920 32.314 92.321 1.00 48.28 N ATOM 2589 CD2 HIS A 204 -43.967 31.908 91.668 1.00 47.93 C ATOM 2590 CE1 HIS A 204 -41.847 31.802 91.108 1.00 48.29 C ATOM 2591 NE2 HIS A 204 -43.077 31.548 90.685 1.00 49.79 N ATOM 2592 H HIS A 204 -45.239 33.913 92.293 1.00 0.00 H ATOM 2593 HD1 HIS A 204 -41.134 32.599 92.858 1.00 0.00 H ATOM 2594 HE2 HIS A 204 -43.360 31.235 89.783 1.00 0.00 H ATOM 2595 N LEU A 205 -42.345 35.971 92.968 1.00 33.67 N ATOM 2596 CA LEU A 205 -41.108 36.747 92.984 1.00 28.90 C ATOM 2597 C LEU A 205 -41.429 38.183 93.309 1.00 28.96 C ATOM 2598 O LEU A 205 -40.528 38.990 93.544 1.00 30.69 O ATOM 2599 CB LEU A 205 -40.393 36.685 91.644 1.00 20.52 C ATOM 2600 CG LEU A 205 -39.987 35.283 91.231 1.00 19.44 C ATOM 2601 CD1 LEU A 205 -39.555 35.333 89.794 1.00 20.23 C ATOM 2602 CD2 LEU A 205 -38.889 34.748 92.120 1.00 10.95 C ATOM 2603 H LEU A 205 -42.921 36.050 92.183 1.00 0.00 H ATOM 2604 N VAL A 206 -42.719 38.495 93.314 1.00 25.31 N ATOM 2605 CA VAL A 206 -43.171 39.839 93.597 1.00 26.60 C ATOM 2606 C VAL A 206 -42.851 40.159 95.038 1.00 32.41 C ATOM 2607 O VAL A 206 -43.146 39.380 95.944 1.00 38.87 O ATOM 2608 CB VAL A 206 -44.687 40.010 93.305 1.00 25.91 C ATOM 2609 CG1 VAL A 206 -45.145 41.393 93.703 1.00 23.74 C ATOM 2610 CG2 VAL A 206 -44.974 39.790 91.809 1.00 21.81 C ATOM 2611 H VAL A 206 -43.410 37.816 93.195 1.00 0.00 H ATOM 2612 N ILE A 207 -42.232 41.308 95.238 1.00 33.63 N ATOM 2613 CA ILE A 207 -41.833 41.758 96.554 1.00 34.61 C ATOM 2614 C ILE A 207 -42.497 43.131 96.782 1.00 36.58 C ATOM 2615 O ILE A 207 -42.377 44.021 95.952 1.00 41.56 O ATOM 2616 CB ILE A 207 -40.247 41.788 96.622 1.00 32.94 C ATOM 2617 CG1 ILE A 207 -39.721 40.550 97.380 1.00 32.42 C ATOM 2618 CG2 ILE A 207 -39.724 43.089 97.208 1.00 30.79 C ATOM 2619 CD1 ILE A 207 -38.454 39.901 96.780 1.00 33.03 C ATOM 2620 H ILE A 207 -42.066 41.931 94.493 1.00 0.00 H ATOM 2621 N ASP A 208 -43.273 43.263 97.855 1.00 38.78 N ATOM 2622 CA ASP A 208 -43.958 44.527 98.197 1.00 40.71 C ATOM 2623 C ASP A 208 -43.300 45.166 99.429 1.00 39.71 C ATOM 2624 O ASP A 208 -43.629 44.821 100.558 1.00 44.32 O ATOM 2625 CB ASP A 208 -45.453 44.249 98.482 1.00 43.66 C ATOM 2626 CG ASP A 208 -46.212 45.473 99.001 1.00 46.29 C ATOM 2627 OD1 ASP A 208 -45.988 46.590 98.487 1.00 49.94 O ATOM 2628 OD2 ASP A 208 -47.054 45.312 99.915 1.00 49.37 O ATOM 2629 H ASP A 208 -43.414 42.490 98.441 1.00 0.00 H ATOM 2630 N ARG A 209 -42.365 46.084 99.236 1.00 38.98 N ATOM 2631 CA ARG A 209 -41.710 46.694 100.385 1.00 39.32 C ATOM 2632 C ARG A 209 -42.203 48.088 100.687 1.00 41.45 C ATOM 2633 O ARG A 209 -42.230 48.938 99.802 1.00 40.40 O ATOM 2634 CB ARG A 209 -40.199 46.704 100.209 1.00 36.41 C ATOM 2635 CG ARG A 209 -39.575 45.382 100.525 1.00 33.40 C ATOM 2636 CD ARG A 209 -38.081 45.419 100.391 1.00 34.10 C ATOM 2637 NE ARG A 209 -37.419 46.245 101.399 1.00 32.98 N ATOM 2638 CZ ARG A 209 -36.233 45.962 101.933 1.00 32.24 C ATOM 2639 NH1 ARG A 209 -35.582 44.869 101.566 1.00 34.34 N ATOM 2640 NH2 ARG A 209 -35.669 46.798 102.791 1.00 32.43 N ATOM 2641 H ARG A 209 -42.152 46.371 98.324 1.00 0.00 H ATOM 2642 HE ARG A 209 -37.889 47.045 101.716 1.00 0.00 H ATOM 2643 HH11 ARG A 209 -35.990 44.251 100.896 1.00 0.00 H ATOM 2644 HH12 ARG A 209 -34.699 44.648 101.971 1.00 0.00 H ATOM 2645 HH21 ARG A 209 -36.109 47.660 103.039 1.00 0.00 H ATOM 2646 HH22 ARG A 209 -34.784 46.557 103.173 1.00 0.00 H ATOM 2647 N LYS A 210 -42.562 48.321 101.951 1.00 45.45 N ATOM 2648 CA LYS A 210 -43.055 49.624 102.402 1.00 47.06 C ATOM 2649 C LYS A 210 -42.068 50.729 102.063 1.00 44.77 C ATOM 2650 O LYS A 210 -42.480 51.867 101.813 1.00 46.34 O ATOM 2651 CB LYS A 210 -43.339 49.624 103.916 1.00 53.93 C ATOM 2652 CG LYS A 210 -44.597 48.841 104.364 1.00 61.29 C ATOM 2653 CD LYS A 210 -44.877 49.017 105.875 1.00 63.07 C ATOM 2654 CE LYS A 210 -46.156 48.292 106.333 1.00 66.71 C ATOM 2655 NZ LYS A 210 -46.556 48.602 107.755 1.00 65.75 N ATOM 2656 H LYS A 210 -42.531 47.594 102.600 1.00 0.00 H ATOM 2657 HZ1 LYS A 210 -46.728 49.623 107.863 1.00 0.00 H ATOM 2658 HZ2 LYS A 210 -45.801 48.307 108.406 1.00 0.00 H ATOM 2659 HZ3 LYS A 210 -47.430 48.083 107.977 1.00 0.00 H ATOM 2660 N ASP A 211 -40.774 50.388 102.031 1.00 42.09 N ATOM 2661 CA ASP A 211 -39.735 51.363 101.707 1.00 39.76 C ATOM 2662 C ASP A 211 -39.390 51.484 100.206 1.00 39.78 C ATOM 2663 O ASP A 211 -38.326 51.973 99.840 1.00 43.19 O ATOM 2664 CB ASP A 211 -38.479 51.159 102.577 1.00 36.58 C ATOM 2665 CG ASP A 211 -37.851 49.797 102.404 1.00 37.35 C ATOM 2666 OD1 ASP A 211 -38.263 49.087 101.478 1.00 39.08 O ATOM 2667 OD2 ASP A 211 -36.941 49.434 103.188 1.00 35.82 O ATOM 2668 H ASP A 211 -40.507 49.470 102.219 1.00 0.00 H ATOM 2669 N LEU A 212 -40.317 51.071 99.351 1.00 38.75 N ATOM 2670 CA LEU A 212 -40.161 51.144 97.901 1.00 38.35 C ATOM 2671 C LEU A 212 -40.350 52.603 97.508 1.00 39.60 C ATOM 2672 O LEU A 212 -41.451 53.129 97.557 1.00 42.62 O ATOM 2673 CB LEU A 212 -41.254 50.304 97.239 1.00 41.04 C ATOM 2674 CG LEU A 212 -41.282 49.921 95.762 1.00 41.80 C ATOM 2675 CD1 LEU A 212 -42.641 49.275 95.531 1.00 47.09 C ATOM 2676 CD2 LEU A 212 -41.097 51.097 94.830 1.00 37.64 C ATOM 2677 H LEU A 212 -41.178 50.736 99.680 1.00 0.00 H ATOM 2678 N VAL A 213 -39.294 53.246 97.057 1.00 39.98 N ATOM 2679 CA VAL A 213 -39.394 54.644 96.692 1.00 40.28 C ATOM 2680 C VAL A 213 -39.329 54.821 95.182 1.00 39.95 C ATOM 2681 O VAL A 213 -38.265 54.647 94.584 1.00 43.52 O ATOM 2682 CB VAL A 213 -38.240 55.437 97.345 1.00 43.93 C ATOM 2683 CG1 VAL A 213 -38.521 56.910 97.316 1.00 45.85 C ATOM 2684 CG2 VAL A 213 -37.996 54.958 98.776 1.00 48.71 C ATOM 2685 H VAL A 213 -38.433 52.779 96.989 1.00 0.00 H ATOM 2686 N MET A 214 -40.457 55.142 94.554 1.00 36.28 N ATOM 2687 CA MET A 214 -40.465 55.357 93.115 1.00 34.43 C ATOM 2688 C MET A 214 -39.938 56.746 92.800 1.00 34.45 C ATOM 2689 O MET A 214 -40.477 57.755 93.244 1.00 36.97 O ATOM 2690 CB MET A 214 -41.846 55.116 92.537 1.00 37.23 C ATOM 2691 CG MET A 214 -42.188 53.631 92.418 1.00 37.90 C ATOM 2692 SD MET A 214 -41.239 52.760 91.142 1.00 41.46 S ATOM 2693 CE MET A 214 -42.380 51.487 90.665 1.00 40.20 C ATOM 2694 H MET A 214 -41.277 55.261 95.074 1.00 0.00 H ATOM 2695 N THR A 215 -38.841 56.782 92.058 1.00 35.43 N ATOM 2696 CA THR A 215 -38.179 58.029 91.730 1.00 35.76 C ATOM 2697 C THR A 215 -38.386 58.540 90.305 1.00 37.00 C ATOM 2698 O THR A 215 -38.091 59.702 90.013 1.00 33.62 O ATOM 2699 CB THR A 215 -36.675 57.898 92.026 1.00 34.33 C ATOM 2700 OG1 THR A 215 -36.096 56.885 91.187 1.00 38.37 O ATOM 2701 CG2 THR A 215 -36.480 57.480 93.472 1.00 29.46 C ATOM 2702 H THR A 215 -38.457 55.955 91.699 1.00 0.00 H ATOM 2703 HG1 THR A 215 -35.138 56.925 91.282 1.00 0.00 H ATOM 2704 N ASN A 216 -38.846 57.656 89.420 1.00 38.22 N ATOM 2705 CA ASN A 216 -39.098 57.980 88.014 1.00 38.18 C ATOM 2706 C ASN A 216 -40.401 57.305 87.554 1.00 39.38 C ATOM 2707 O ASN A 216 -40.810 56.257 88.084 1.00 40.17 O ATOM 2708 CB ASN A 216 -37.936 57.505 87.128 1.00 41.56 C ATOM 2709 CG ASN A 216 -36.646 58.276 87.365 1.00 42.33 C ATOM 2710 OD1 ASN A 216 -36.169 58.977 86.477 1.00 49.31 O ATOM 2711 ND2 ASN A 216 -36.063 58.130 88.549 1.00 41.60 N ATOM 2712 H ASN A 216 -39.039 56.732 89.694 1.00 0.00 H ATOM 2713 HD21 ASN A 216 -36.453 57.519 89.203 1.00 0.00 H ATOM 2714 HD22 ASN A 216 -35.259 58.663 88.698 1.00 0.00 H ATOM 2715 N GLN A 217 -41.052 57.908 86.562 1.00 39.86 N ATOM 2716 CA GLN A 217 -42.318 57.396 86.042 1.00 35.37 C ATOM 2717 C GLN A 217 -42.035 56.345 84.983 1.00 31.24 C ATOM 2718 O GLN A 217 -41.063 56.461 84.255 1.00 26.80 O ATOM 2719 CB GLN A 217 -43.162 58.556 85.456 1.00 36.28 C ATOM 2720 H GLN A 217 -40.635 58.685 86.132 1.00 0.00 H ATOM 2721 N GLU A 218 -42.861 55.304 84.940 1.00 30.50 N ATOM 2722 CA GLU A 218 -42.713 54.227 83.963 1.00 31.16 C ATOM 2723 C GLU A 218 -42.655 54.827 82.574 1.00 34.07 C ATOM 2724 O GLU A 218 -43.010 55.990 82.386 1.00 36.64 O ATOM 2725 CB GLU A 218 -43.876 53.236 84.093 1.00 28.09 C ATOM 2726 CG GLU A 218 -43.966 52.131 83.038 1.00 29.85 C ATOM 2727 CD GLU A 218 -42.821 51.143 83.048 1.00 28.32 C ATOM 2728 OE1 GLU A 218 -43.089 49.928 82.938 1.00 25.94 O ATOM 2729 OE2 GLU A 218 -41.657 51.574 83.119 1.00 35.06 O ATOM 2730 H GLU A 218 -43.573 55.271 85.600 1.00 0.00 H ATOM 2731 N ILE A 219 -42.152 54.060 81.615 1.00 38.35 N ATOM 2732 CA ILE A 219 -42.052 54.548 80.242 1.00 39.77 C ATOM 2733 C ILE A 219 -42.898 53.702 79.302 1.00 41.38 C ATOM 2734 O ILE A 219 -43.151 52.520 79.576 1.00 45.07 O ATOM 2735 CB ILE A 219 -40.572 54.581 79.730 1.00 39.56 C ATOM 2736 CG1 ILE A 219 -39.922 53.198 79.788 1.00 37.94 C ATOM 2737 CG2 ILE A 219 -39.740 55.576 80.539 1.00 39.34 C ATOM 2738 CD1 ILE A 219 -38.497 53.200 79.273 1.00 33.20 C ATOM 2739 H ILE A 219 -41.857 53.148 81.771 1.00 0.00 H ATOM 2740 N GLU A 220 -43.375 54.321 78.228 1.00 40.53 N ATOM 2741 CA GLU A 220 -44.175 53.629 77.229 1.00 42.60 C ATOM 2742 C GLU A 220 -43.353 53.389 75.951 1.00 44.52 C ATOM 2743 O GLU A 220 -43.609 52.433 75.206 1.00 43.16 O ATOM 2744 CB GLU A 220 -45.443 54.429 76.915 1.00 45.45 C ATOM 2745 CG GLU A 220 -46.394 54.581 78.094 1.00 46.01 C ATOM 2746 CD GLU A 220 -46.856 53.244 78.642 1.00 46.40 C ATOM 2747 OE1 GLU A 220 -47.500 52.476 77.892 1.00 45.47 O ATOM 2748 OE2 GLU A 220 -46.566 52.957 79.823 1.00 48.24 O ATOM 2749 H GLU A 220 -43.173 55.290 78.086 1.00 0.00 H ATOM 2750 N GLN A 221 -42.380 54.263 75.693 1.00 44.56 N ATOM 2751 CA GLN A 221 -41.513 54.136 74.530 1.00 45.97 C ATOM 2752 C GLN A 221 -40.186 53.433 74.880 1.00 43.89 C ATOM 2753 O GLN A 221 -39.398 53.917 75.710 1.00 38.95 O ATOM 2754 CB GLN A 221 -41.242 55.501 73.895 1.00 52.94 C ATOM 2755 CG GLN A 221 -41.660 55.609 72.417 1.00 62.73 C ATOM 2756 CD GLN A 221 -41.242 54.402 71.560 1.00 68.72 C ATOM 2757 OE1 GLN A 221 -40.177 54.397 70.931 1.00 67.60 O ATOM 2758 NE2 GLN A 221 -42.103 53.382 71.522 1.00 72.95 N ATOM 2759 H GLN A 221 -42.231 55.007 76.311 1.00 0.00 H ATOM 2760 HE21 GLN A 221 -42.915 53.473 72.064 1.00 0.00 H ATOM 2761 HE22 GLN A 221 -41.910 52.611 70.947 1.00 0.00 H ATOM 2762 N THR A 222 -39.993 52.267 74.256 1.00 41.42 N ATOM 2763 CA THR A 222 -38.825 51.396 74.415 1.00 36.02 C ATOM 2764 C THR A 222 -37.503 52.103 74.159 1.00 35.14 C ATOM 2765 O THR A 222 -37.410 52.952 73.269 1.00 37.39 O ATOM 2766 CB THR A 222 -38.926 50.192 73.472 1.00 35.98 C ATOM 2767 OG1 THR A 222 -39.309 50.633 72.159 1.00 41.23 O ATOM 2768 CG2 THR A 222 -39.949 49.199 73.986 1.00 31.77 C ATOM 2769 H THR A 222 -40.689 51.977 73.639 1.00 0.00 H ATOM 2770 HG1 THR A 222 -40.130 51.119 72.135 1.00 0.00 H ATOM 2771 N THR A 223 -36.471 51.705 74.898 1.00 31.43 N ATOM 2772 CA THR A 223 -35.156 52.327 74.793 1.00 29.92 C ATOM 2773 C THR A 223 -34.104 51.254 75.041 1.00 29.39 C ATOM 2774 O THR A 223 -34.305 50.385 75.884 1.00 31.39 O ATOM 2775 CB THR A 223 -34.980 53.397 75.911 1.00 30.15 C ATOM 2776 OG1 THR A 223 -36.243 54.006 76.196 1.00 40.98 O ATOM 2777 CG2 THR A 223 -34.009 54.482 75.502 1.00 29.03 C ATOM 2778 H THR A 223 -36.573 50.976 75.540 1.00 0.00 H ATOM 2779 HG1 THR A 223 -36.881 53.383 76.556 1.00 0.00 H ATOM 2780 N PRO A 224 -32.983 51.275 74.291 1.00 26.53 N ATOM 2781 CA PRO A 224 -31.910 50.294 74.463 1.00 28.03 C ATOM 2782 C PRO A 224 -30.968 50.748 75.596 1.00 28.27 C ATOM 2783 O PRO A 224 -29.768 50.966 75.372 1.00 28.48 O ATOM 2784 CB PRO A 224 -31.204 50.341 73.115 1.00 26.36 C ATOM 2785 CG PRO A 224 -31.222 51.792 72.827 1.00 27.91 C ATOM 2786 CD PRO A 224 -32.669 52.165 73.160 1.00 28.43 C ATOM 2787 N LYS A 225 -31.531 50.913 76.793 1.00 27.99 N ATOM 2788 CA LYS A 225 -30.782 51.339 77.965 1.00 25.51 C ATOM 2789 C LYS A 225 -31.556 51.020 79.225 1.00 22.02 C ATOM 2790 O LYS A 225 -32.756 50.795 79.172 1.00 20.52 O ATOM 2791 CB LYS A 225 -30.440 52.836 77.902 1.00 30.53 C ATOM 2792 CG LYS A 225 -31.611 53.779 77.897 1.00 35.72 C ATOM 2793 CD LYS A 225 -31.143 55.224 77.994 1.00 43.86 C ATOM 2794 CE LYS A 225 -32.331 56.184 78.097 1.00 50.38 C ATOM 2795 NZ LYS A 225 -31.873 57.579 78.355 1.00 56.62 N ATOM 2796 H LYS A 225 -32.484 50.716 76.937 1.00 0.00 H ATOM 2797 HZ1 LYS A 225 -31.285 57.920 77.568 1.00 0.00 H ATOM 2798 HZ2 LYS A 225 -31.298 57.570 79.226 1.00 0.00 H ATOM 2799 HZ3 LYS A 225 -32.685 58.212 78.498 1.00 0.00 H ATOM 2800 N THR A 226 -30.846 50.942 80.345 1.00 24.50 N ATOM 2801 CA THR A 226 -31.444 50.641 81.638 1.00 24.24 C ATOM 2802 C THR A 226 -32.077 51.903 82.216 1.00 25.28 C ATOM 2803 O THR A 226 -31.384 52.881 82.469 1.00 27.01 O ATOM 2804 CB THR A 226 -30.372 50.097 82.639 1.00 23.40 C ATOM 2805 OG1 THR A 226 -29.394 51.107 82.927 1.00 21.72 O ATOM 2806 CG2 THR A 226 -29.650 48.925 82.044 1.00 18.99 C ATOM 2807 H THR A 226 -29.880 51.098 80.350 1.00 0.00 H ATOM 2808 HG1 THR A 226 -29.785 51.806 83.460 1.00 0.00 H ATOM 2809 N VAL A 227 -33.389 51.902 82.402 1.00 26.36 N ATOM 2810 CA VAL A 227 -34.053 53.067 82.967 1.00 24.20 C ATOM 2811 C VAL A 227 -34.448 52.745 84.403 1.00 23.87 C ATOM 2812 O VAL A 227 -35.277 51.874 84.654 1.00 23.08 O ATOM 2813 CB VAL A 227 -35.274 53.513 82.111 1.00 23.64 C ATOM 2814 CG1 VAL A 227 -34.811 54.270 80.872 1.00 27.14 C ATOM 2815 CG2 VAL A 227 -36.031 52.340 81.645 1.00 26.19 C ATOM 2816 H VAL A 227 -33.902 51.098 82.194 1.00 0.00 H ATOM 2817 N ARG A 228 -33.784 53.386 85.353 1.00 24.49 N ATOM 2818 CA ARG A 228 -34.082 53.138 86.747 1.00 25.16 C ATOM 2819 C ARG A 228 -35.418 53.790 87.070 1.00 26.57 C ATOM 2820 O ARG A 228 -35.620 54.947 86.727 1.00 30.39 O ATOM 2821 CB ARG A 228 -32.994 53.710 87.660 1.00 21.56 C ATOM 2822 CG ARG A 228 -33.139 53.218 89.093 1.00 22.15 C ATOM 2823 CD ARG A 228 -32.166 53.854 90.064 1.00 25.49 C ATOM 2824 NE ARG A 228 -30.837 53.261 89.981 1.00 30.18 N ATOM 2825 CZ ARG A 228 -29.949 53.257 90.971 1.00 31.24 C ATOM 2826 NH1 ARG A 228 -30.247 53.801 92.138 1.00 33.21 N ATOM 2827 NH2 ARG A 228 -28.728 52.773 90.771 1.00 35.70 N ATOM 2828 H ARG A 228 -33.146 54.078 85.089 1.00 0.00 H ATOM 2829 HE ARG A 228 -30.577 52.837 89.136 1.00 0.00 H ATOM 2830 HH11 ARG A 228 -31.142 54.212 92.293 1.00 0.00 H ATOM 2831 HH12 ARG A 228 -29.571 53.779 92.875 1.00 0.00 H ATOM 2832 HH21 ARG A 228 -28.474 52.406 89.878 1.00 0.00 H ATOM 2833 HH22 ARG A 228 -28.069 52.764 91.523 1.00 0.00 H ATOM 2834 N LEU A 229 -36.339 53.039 87.681 1.00 25.30 N ATOM 2835 CA LEU A 229 -37.649 53.570 88.049 1.00 21.92 C ATOM 2836 C LEU A 229 -37.702 53.870 89.532 1.00 23.59 C ATOM 2837 O LEU A 229 -38.387 54.800 89.953 1.00 26.07 O ATOM 2838 CB LEU A 229 -38.777 52.602 87.690 1.00 19.42 C ATOM 2839 CG LEU A 229 -39.139 52.394 86.226 1.00 16.30 C ATOM 2840 CD1 LEU A 229 -40.371 51.541 86.134 1.00 19.15 C ATOM 2841 CD2 LEU A 229 -39.394 53.710 85.566 1.00 13.03 C ATOM 2842 H LEU A 229 -36.141 52.102 87.861 1.00 0.00 H ATOM 2843 N GLY A 230 -36.980 53.098 90.332 1.00 24.75 N ATOM 2844 CA GLY A 230 -36.996 53.345 91.761 1.00 25.79 C ATOM 2845 C GLY A 230 -36.038 52.489 92.547 1.00 25.35 C ATOM 2846 O GLY A 230 -35.358 51.654 91.983 1.00 28.99 O ATOM 2847 H GLY A 230 -36.403 52.390 89.983 1.00 0.00 H ATOM 2848 N ILE A 231 -35.972 52.699 93.850 1.00 26.79 N ATOM 2849 CA ILE A 231 -35.084 51.921 94.697 1.00 28.53 C ATOM 2850 C ILE A 231 -35.890 51.413 95.863 1.00 30.27 C ATOM 2851 O ILE A 231 -37.055 51.780 96.029 1.00 30.70 O ATOM 2852 CB ILE A 231 -33.972 52.776 95.311 1.00 29.03 C ATOM 2853 CG1 ILE A 231 -34.578 53.837 96.236 1.00 31.29 C ATOM 2854 CG2 ILE A 231 -33.152 53.408 94.232 1.00 31.91 C ATOM 2855 CD1 ILE A 231 -33.579 54.561 97.117 1.00 31.50 C ATOM 2856 H ILE A 231 -36.572 53.368 94.271 1.00 0.00 H ATOM 2857 N VAL A 232 -35.253 50.587 96.680 1.00 29.20 N ATOM 2858 CA VAL A 232 -35.872 50.057 97.881 1.00 28.05 C ATOM 2859 C VAL A 232 -34.809 50.288 98.943 1.00 27.26 C ATOM 2860 O VAL A 232 -33.652 50.524 98.607 1.00 27.79 O ATOM 2861 CB VAL A 232 -36.250 48.556 97.731 1.00 30.77 C ATOM 2862 CG1 VAL A 232 -35.040 47.635 97.876 1.00 29.29 C ATOM 2863 CG2 VAL A 232 -37.321 48.196 98.715 1.00 31.87 C ATOM 2864 H VAL A 232 -34.320 50.333 96.503 1.00 0.00 H ATOM 2865 N GLY A 233 -35.192 50.291 100.212 1.00 26.65 N ATOM 2866 CA GLY A 233 -34.211 50.528 101.252 1.00 24.68 C ATOM 2867 C GLY A 233 -33.334 51.707 100.894 1.00 25.10 C ATOM 2868 O GLY A 233 -33.843 52.759 100.498 1.00 25.51 O ATOM 2869 H GLY A 233 -36.134 50.180 100.421 1.00 0.00 H ATOM 2870 N LYS A 234 -32.018 51.491 100.964 1.00 28.54 N ATOM 2871 CA LYS A 234 -31.007 52.510 100.661 1.00 25.41 C ATOM 2872 C LYS A 234 -30.673 52.621 99.173 1.00 27.06 C ATOM 2873 O LYS A 234 -30.105 53.616 98.739 1.00 31.17 O ATOM 2874 CB LYS A 234 -29.723 52.227 101.426 1.00 20.59 C ATOM 2875 CG LYS A 234 -29.870 52.360 102.927 1.00 28.63 C ATOM 2876 CD LYS A 234 -28.501 52.434 103.631 1.00 32.31 C ATOM 2877 CE LYS A 234 -28.633 52.770 105.130 1.00 33.76 C ATOM 2878 NZ LYS A 234 -27.354 52.553 105.885 1.00 33.19 N ATOM 2879 H LYS A 234 -31.719 50.583 101.167 1.00 0.00 H ATOM 2880 HZ1 LYS A 234 -26.595 53.100 105.438 1.00 0.00 H ATOM 2881 HZ2 LYS A 234 -27.132 51.539 105.823 1.00 0.00 H ATOM 2882 HZ3 LYS A 234 -27.449 52.824 106.882 1.00 0.00 H ATOM 2883 N GLY A 235 -30.972 51.587 98.399 1.00 23.89 N ATOM 2884 CA GLY A 235 -30.697 51.660 96.980 1.00 22.02 C ATOM 2885 C GLY A 235 -29.378 51.077 96.533 1.00 20.45 C ATOM 2886 O GLY A 235 -28.884 51.467 95.482 1.00 22.08 O ATOM 2887 H GLY A 235 -31.448 50.813 98.752 1.00 0.00 H ATOM 2888 N GLY A 236 -28.832 50.134 97.303 1.00 18.89 N ATOM 2889 CA GLY A 236 -27.567 49.507 96.954 1.00 17.53 C ATOM 2890 C GLY A 236 -27.758 48.422 95.917 1.00 18.43 C ATOM 2891 O GLY A 236 -28.854 48.258 95.400 1.00 24.35 O ATOM 2892 H GLY A 236 -29.298 49.882 98.113 1.00 0.00 H ATOM 2893 N GLN A 237 -26.709 47.671 95.605 1.00 18.31 N ATOM 2894 CA GLN A 237 -26.815 46.605 94.628 1.00 14.96 C ATOM 2895 C GLN A 237 -28.007 45.706 94.965 1.00 18.66 C ATOM 2896 O GLN A 237 -28.226 45.384 96.125 1.00 23.06 O ATOM 2897 CB GLN A 237 -25.506 45.824 94.594 1.00 14.61 C ATOM 2898 CG GLN A 237 -24.567 46.334 93.519 1.00 12.20 C ATOM 2899 CD GLN A 237 -23.170 45.742 93.600 1.00 10.13 C ATOM 2900 OE1 GLN A 237 -22.453 45.963 94.555 1.00 9.79 O ATOM 2901 NE2 GLN A 237 -22.768 45.042 92.576 1.00 12.26 N ATOM 2902 H GLN A 237 -25.851 47.807 96.019 1.00 0.00 H ATOM 2903 HE21 GLN A 237 -21.915 44.596 92.719 1.00 0.00 H ATOM 2904 HE22 GLN A 237 -23.262 44.998 91.731 1.00 0.00 H ATOM 2905 N GLY A 238 -28.822 45.379 93.967 1.00 19.91 N ATOM 2906 CA GLY A 238 -29.972 44.528 94.210 1.00 20.25 C ATOM 2907 C GLY A 238 -31.134 45.232 94.908 1.00 23.93 C ATOM 2908 O GLY A 238 -32.121 44.599 95.295 1.00 23.98 O ATOM 2909 H GLY A 238 -28.655 45.711 93.056 1.00 0.00 H ATOM 2910 N GLU A 239 -31.042 46.544 95.072 1.00 21.33 N ATOM 2911 CA GLU A 239 -32.100 47.286 95.723 1.00 16.51 C ATOM 2912 C GLU A 239 -32.641 48.372 94.834 1.00 15.97 C ATOM 2913 O GLU A 239 -33.230 49.333 95.301 1.00 17.64 O ATOM 2914 CB GLU A 239 -31.586 47.877 97.015 1.00 16.66 C ATOM 2915 CG GLU A 239 -31.087 46.815 97.984 1.00 21.72 C ATOM 2916 CD GLU A 239 -30.503 47.388 99.274 1.00 23.19 C ATOM 2917 OE1 GLU A 239 -30.333 46.609 100.222 1.00 22.67 O ATOM 2918 OE2 GLU A 239 -30.191 48.597 99.343 1.00 26.39 O ATOM 2919 H GLU A 239 -30.230 47.026 94.805 1.00 0.00 H ATOM 2920 N ARG A 240 -32.447 48.216 93.537 1.00 16.43 N ATOM 2921 CA ARG A 240 -32.935 49.186 92.598 1.00 13.04 C ATOM 2922 C ARG A 240 -33.793 48.517 91.542 1.00 18.62 C ATOM 2923 O ARG A 240 -33.628 47.333 91.210 1.00 21.71 O ATOM 2924 CB ARG A 240 -31.800 50.025 92.035 1.00 14.76 C ATOM 2925 CG ARG A 240 -30.468 49.343 91.984 1.00 13.46 C ATOM 2926 CD ARG A 240 -29.359 50.229 92.518 1.00 7.59 C ATOM 2927 NE ARG A 240 -28.066 49.678 92.142 1.00 13.08 N ATOM 2928 CZ ARG A 240 -26.897 50.174 92.504 1.00 12.28 C ATOM 2929 NH1 ARG A 240 -26.823 51.242 93.258 1.00 23.86 N ATOM 2930 NH2 ARG A 240 -25.793 49.603 92.094 1.00 17.24 N ATOM 2931 H ARG A 240 -31.959 47.441 93.196 1.00 0.00 H ATOM 2932 HE ARG A 240 -28.063 48.890 91.562 1.00 0.00 H ATOM 2933 HH11 ARG A 240 -27.651 51.720 93.555 1.00 0.00 H ATOM 2934 HH12 ARG A 240 -25.922 51.588 93.523 1.00 0.00 H ATOM 2935 HH21 ARG A 240 -25.854 48.800 91.505 1.00 0.00 H ATOM 2936 HH22 ARG A 240 -24.902 49.974 92.349 1.00 0.00 H ATOM 2937 N ILE A 241 -34.788 49.271 91.105 1.00 21.33 N ATOM 2938 CA ILE A 241 -35.792 48.808 90.163 1.00 22.52 C ATOM 2939 C ILE A 241 -35.688 49.506 88.832 1.00 23.17 C ATOM 2940 O ILE A 241 -35.458 50.715 88.776 1.00 22.17 O ATOM 2941 CB ILE A 241 -37.199 49.037 90.746 1.00 25.63 C ATOM 2942 CG1 ILE A 241 -37.260 48.463 92.168 1.00 23.92 C ATOM 2943 CG2 ILE A 241 -38.254 48.386 89.856 1.00 28.82 C ATOM 2944 CD1 ILE A 241 -38.461 48.903 92.961 1.00 30.44 C ATOM 2945 H ILE A 241 -34.773 50.191 91.382 1.00 0.00 H ATOM 2946 N TYR A 242 -35.992 48.752 87.781 1.00 23.24 N ATOM 2947 CA TYR A 242 -35.901 49.227 86.414 1.00 20.72 C ATOM 2948 C TYR A 242 -37.177 48.977 85.603 1.00 22.41 C ATOM 2949 O TYR A 242 -38.034 48.148 85.978 1.00 23.91 O ATOM 2950 CB TYR A 242 -34.687 48.541 85.756 1.00 18.05 C ATOM 2951 CG TYR A 242 -33.406 48.735 86.560 1.00 14.90 C ATOM 2952 CD1 TYR A 242 -33.037 47.837 87.573 1.00 9.46 C ATOM 2953 CD2 TYR A 242 -32.603 49.859 86.360 1.00 11.04 C ATOM 2954 CE1 TYR A 242 -31.893 48.076 88.369 1.00 9.07 C ATOM 2955 CE2 TYR A 242 -31.482 50.091 87.138 1.00 11.93 C ATOM 2956 CZ TYR A 242 -31.131 49.207 88.137 1.00 8.75 C ATOM 2957 OH TYR A 242 -30.018 49.482 88.900 1.00 13.48 O ATOM 2958 H TYR A 242 -36.286 47.822 87.904 1.00 0.00 H ATOM 2959 HH TYR A 242 -29.681 50.345 88.646 1.00 0.00 H ATOM 2960 N SER A 243 -37.313 49.722 84.514 1.00 21.05 N ATOM 2961 CA SER A 243 -38.451 49.588 83.635 1.00 23.55 C ATOM 2962 C SER A 243 -38.181 48.442 82.726 1.00 26.22 C ATOM 2963 O SER A 243 -37.103 48.358 82.145 1.00 30.12 O ATOM 2964 CB SER A 243 -38.622 50.840 82.779 1.00 21.50 C ATOM 2965 OG SER A 243 -39.340 50.563 81.589 1.00 23.77 O ATOM 2966 H SER A 243 -36.607 50.391 84.317 1.00 0.00 H ATOM 2967 HG SER A 243 -40.165 50.122 81.761 1.00 0.00 H ATOM 2968 N THR A 244 -39.204 47.631 82.496 1.00 28.32 N ATOM 2969 CA THR A 244 -39.098 46.483 81.621 1.00 26.94 C ATOM 2970 C THR A 244 -39.182 46.943 80.179 1.00 30.00 C ATOM 2971 O THR A 244 -39.170 46.112 79.270 1.00 31.99 O ATOM 2972 CB THR A 244 -40.215 45.420 81.896 1.00 25.51 C ATOM 2973 OG1 THR A 244 -41.494 45.946 81.532 1.00 29.24 O ATOM 2974 CG2 THR A 244 -40.234 45.022 83.363 1.00 22.37 C ATOM 2975 H THR A 244 -40.087 47.707 82.730 1.00 0.00 H ATOM 2976 HG1 THR A 244 -41.863 46.567 82.184 1.00 0.00 H ATOM 2977 N ARG A 245 -39.340 48.250 79.968 1.00 29.05 N ATOM 2978 CA ARG A 245 -39.404 48.767 78.602 1.00 31.40 C ATOM 2979 C ARG A 245 -37.994 49.208 78.199 1.00 33.56 C ATOM 2980 O ARG A 245 -37.770 49.780 77.122 1.00 33.41 O ATOM 2981 CB ARG A 245 -40.408 49.909 78.463 1.00 32.53 C ATOM 2982 CG ARG A 245 -41.762 49.472 77.939 1.00 32.51 C ATOM 2983 CD ARG A 245 -42.490 48.534 78.910 1.00 36.87 C ATOM 2984 NE ARG A 245 -43.667 49.176 79.489 1.00 38.17 N ATOM 2985 CZ ARG A 245 -44.901 49.074 79.008 1.00 37.81 C ATOM 2986 NH1 ARG A 245 -45.163 48.346 77.933 1.00 46.20 N ATOM 2987 NH2 ARG A 245 -45.878 49.755 79.574 1.00 45.39 N ATOM 2988 H ARG A 245 -39.372 48.950 80.659 1.00 0.00 H ATOM 2989 HE ARG A 245 -43.533 49.720 80.289 1.00 0.00 H ATOM 2990 HH11 ARG A 245 -44.440 47.861 77.446 1.00 0.00 H ATOM 2991 HH12 ARG A 245 -46.111 48.307 77.587 1.00 0.00 H ATOM 2992 HH21 ARG A 245 -45.654 50.344 80.346 1.00 0.00 H ATOM 2993 HH22 ARG A 245 -46.819 49.719 79.228 1.00 0.00 H ATOM 2994 N GLY A 246 -37.033 48.898 79.065 1.00 32.83 N ATOM 2995 CA GLY A 246 -35.644 49.217 78.800 1.00 26.84 C ATOM 2996 C GLY A 246 -34.932 47.891 78.769 1.00 23.11 C ATOM 2997 O GLY A 246 -35.563 46.843 78.612 1.00 21.23 O ATOM 2998 H GLY A 246 -37.194 48.418 79.891 1.00 0.00 H ATOM 2999 N ILE A 247 -33.627 47.911 78.956 1.00 22.92 N ATOM 3000 CA ILE A 247 -32.893 46.668 78.944 1.00 19.68 C ATOM 3001 C ILE A 247 -32.571 46.283 80.376 1.00 20.21 C ATOM 3002 O ILE A 247 -32.583 47.139 81.260 1.00 22.01 O ATOM 3003 CB ILE A 247 -31.614 46.793 78.123 1.00 15.22 C ATOM 3004 CG1 ILE A 247 -30.639 47.735 78.814 1.00 10.10 C ATOM 3005 CG2 ILE A 247 -31.950 47.307 76.744 1.00 13.20 C ATOM 3006 CD1 ILE A 247 -29.415 47.953 78.009 1.00 10.40 C ATOM 3007 H ILE A 247 -33.202 48.773 79.163 1.00 0.00 H ATOM 3008 N ALA A 248 -32.315 44.994 80.590 1.00 16.63 N ATOM 3009 CA ALA A 248 -31.986 44.453 81.893 1.00 15.55 C ATOM 3010 C ALA A 248 -30.602 44.900 82.336 1.00 15.42 C ATOM 3011 O ALA A 248 -29.700 45.006 81.521 1.00 19.74 O ATOM 3012 CB ALA A 248 -32.032 42.930 81.827 1.00 14.73 C ATOM 3013 H ALA A 248 -32.330 44.349 79.836 1.00 0.00 H ATOM 3014 N ILE A 249 -30.440 45.202 83.617 1.00 19.94 N ATOM 3015 CA ILE A 249 -29.122 45.573 84.135 1.00 20.89 C ATOM 3016 C ILE A 249 -28.414 44.220 84.167 1.00 21.37 C ATOM 3017 O ILE A 249 -29.080 43.193 84.114 1.00 25.68 O ATOM 3018 CB ILE A 249 -29.164 46.153 85.602 1.00 20.24 C ATOM 3019 CG1 ILE A 249 -29.877 45.177 86.559 1.00 17.63 C ATOM 3020 CG2 ILE A 249 -29.784 47.529 85.598 1.00 15.63 C ATOM 3021 CD1 ILE A 249 -29.507 45.314 88.028 1.00 15.21 C ATOM 3022 H ILE A 249 -31.228 45.074 84.197 1.00 0.00 H ATOM 3023 N GLY A 250 -27.095 44.189 84.285 1.00 17.92 N ATOM 3024 CA GLY A 250 -26.441 42.895 84.285 1.00 17.05 C ATOM 3025 C GLY A 250 -26.775 42.009 85.471 1.00 15.89 C ATOM 3026 O GLY A 250 -26.982 42.489 86.580 1.00 21.54 O ATOM 3027 H GLY A 250 -26.584 45.007 84.407 1.00 0.00 H ATOM 3028 N LEU A 251 -26.835 40.707 85.243 1.00 16.27 N ATOM 3029 CA LEU A 251 -27.092 39.729 86.308 1.00 15.26 C ATOM 3030 C LEU A 251 -25.730 39.449 86.949 1.00 18.42 C ATOM 3031 O LEU A 251 -24.717 39.483 86.247 1.00 16.67 O ATOM 3032 CB LEU A 251 -27.600 38.411 85.712 1.00 16.39 C ATOM 3033 CG LEU A 251 -29.036 38.078 85.298 1.00 10.73 C ATOM 3034 CD1 LEU A 251 -30.009 39.251 85.293 1.00 5.42 C ATOM 3035 CD2 LEU A 251 -28.968 37.409 83.962 1.00 5.74 C ATOM 3036 H LEU A 251 -26.658 40.398 84.327 1.00 0.00 H ATOM 3037 N SER A 252 -25.703 39.127 88.248 1.00 16.86 N ATOM 3038 CA SER A 252 -24.450 38.861 88.954 1.00 10.55 C ATOM 3039 C SER A 252 -24.497 37.515 89.626 1.00 10.20 C ATOM 3040 O SER A 252 -25.575 37.000 89.814 1.00 17.45 O ATOM 3041 CB SER A 252 -24.171 39.958 89.980 1.00 11.72 C ATOM 3042 OG SER A 252 -25.345 40.365 90.655 1.00 11.15 O ATOM 3043 H SER A 252 -26.527 38.975 88.744 1.00 0.00 H ATOM 3044 HG SER A 252 -25.858 40.979 90.105 1.00 0.00 H ATOM 3045 N ALA A 253 -23.348 36.992 90.060 1.00 11.08 N ATOM 3046 CA ALA A 253 -23.256 35.667 90.697 1.00 7.56 C ATOM 3047 C ALA A 253 -23.286 35.588 92.222 1.00 14.81 C ATOM 3048 O ALA A 253 -23.711 34.569 92.781 1.00 19.10 O ATOM 3049 CB ALA A 253 -22.024 34.921 90.180 1.00 3.49 C ATOM 3050 H ALA A 253 -22.534 37.506 89.881 1.00 0.00 H ATOM 3051 N TYR A 254 -22.704 36.583 92.889 1.00 13.97 N ATOM 3052 CA TYR A 254 -22.680 36.616 94.352 1.00 16.01 C ATOM 3053 C TYR A 254 -23.497 37.811 94.833 1.00 15.64 C ATOM 3054 O TYR A 254 -23.550 38.108 96.021 1.00 16.64 O ATOM 3055 CB TYR A 254 -21.238 36.721 94.874 1.00 11.72 C ATOM 3056 CG TYR A 254 -20.346 35.577 94.441 1.00 11.74 C ATOM 3057 CD1 TYR A 254 -19.699 35.604 93.211 1.00 14.70 C ATOM 3058 CD2 TYR A 254 -20.173 34.458 95.237 1.00 10.72 C ATOM 3059 CE1 TYR A 254 -18.915 34.550 92.788 1.00 11.82 C ATOM 3060 CE2 TYR A 254 -19.387 33.396 94.819 1.00 12.15 C ATOM 3061 CZ TYR A 254 -18.764 33.453 93.589 1.00 12.06 C ATOM 3062 OH TYR A 254 -17.988 32.408 93.134 1.00 18.10 O ATOM 3063 H TYR A 254 -22.294 37.309 92.397 1.00 0.00 H ATOM 3064 HH TYR A 254 -17.378 32.748 92.461 1.00 0.00 H ATOM 3065 N GLY A 255 -24.144 38.472 93.880 1.00 15.54 N ATOM 3066 CA GLY A 255 -24.961 39.643 94.136 1.00 12.27 C ATOM 3067 C GLY A 255 -25.903 39.442 95.285 1.00 14.61 C ATOM 3068 O GLY A 255 -26.311 38.317 95.558 1.00 18.69 O ATOM 3069 H GLY A 255 -24.125 38.137 92.968 1.00 0.00 H ATOM 3070 N GLY A 256 -26.256 40.541 95.944 1.00 17.36 N ATOM 3071 CA GLY A 256 -27.140 40.484 97.087 1.00 12.86 C ATOM 3072 C GLY A 256 -28.161 41.590 96.961 1.00 20.00 C ATOM 3073 O GLY A 256 -28.217 42.294 95.937 1.00 24.23 O ATOM 3074 H GLY A 256 -25.962 41.426 95.643 1.00 0.00 H ATOM 3075 N GLY A 257 -28.933 41.776 98.022 1.00 19.86 N ATOM 3076 CA GLY A 257 -29.977 42.775 98.017 1.00 21.36 C ATOM 3077 C GLY A 257 -31.256 41.982 97.980 1.00 21.52 C ATOM 3078 O GLY A 257 -31.211 40.765 97.866 1.00 26.64 O ATOM 3079 H GLY A 257 -28.794 41.219 98.815 1.00 0.00 H ATOM 3080 N ILE A 258 -32.402 42.632 98.048 1.00 19.72 N ATOM 3081 CA ILE A 258 -33.626 41.855 98.029 1.00 22.59 C ATOM 3082 C ILE A 258 -33.909 41.282 96.639 1.00 22.20 C ATOM 3083 O ILE A 258 -34.584 40.279 96.510 1.00 27.12 O ATOM 3084 CB ILE A 258 -34.810 42.680 98.567 1.00 23.75 C ATOM 3085 CG1 ILE A 258 -35.973 41.757 98.923 1.00 26.47 C ATOM 3086 CG2 ILE A 258 -35.207 43.744 97.580 1.00 26.11 C ATOM 3087 CD1 ILE A 258 -35.727 40.911 100.148 1.00 21.57 C ATOM 3088 H ILE A 258 -32.455 43.610 98.026 1.00 0.00 H ATOM 3089 N PHE A 259 -33.352 41.920 95.615 1.00 23.59 N ATOM 3090 CA PHE A 259 -33.507 41.518 94.211 1.00 19.79 C ATOM 3091 C PHE A 259 -32.181 40.949 93.747 1.00 16.38 C ATOM 3092 O PHE A 259 -31.693 41.234 92.660 1.00 19.47 O ATOM 3093 CB PHE A 259 -33.837 42.740 93.361 1.00 19.95 C ATOM 3094 CG PHE A 259 -35.114 43.436 93.750 1.00 17.08 C ATOM 3095 CD1 PHE A 259 -35.103 44.749 94.178 1.00 18.32 C ATOM 3096 CD2 PHE A 259 -36.334 42.809 93.607 1.00 14.81 C ATOM 3097 CE1 PHE A 259 -36.303 45.421 94.455 1.00 21.04 C ATOM 3098 CE2 PHE A 259 -37.518 43.476 93.879 1.00 8.30 C ATOM 3099 CZ PHE A 259 -37.506 44.771 94.301 1.00 10.79 C ATOM 3100 H PHE A 259 -32.826 42.717 95.802 1.00 0.00 H ATOM 3101 N ALA A 260 -31.633 40.094 94.581 1.00 16.50 N ATOM 3102 CA ALA A 260 -30.343 39.476 94.372 1.00 15.14 C ATOM 3103 C ALA A 260 -30.046 38.960 93.009 1.00 17.49 C ATOM 3104 O ALA A 260 -30.833 38.216 92.444 1.00 25.49 O ATOM 3105 CB ALA A 260 -30.149 38.361 95.361 1.00 12.44 C ATOM 3106 H ALA A 260 -32.143 39.821 95.368 1.00 0.00 H ATOM 3107 N LYS A 261 -28.882 39.331 92.495 1.00 14.37 N ATOM 3108 CA LYS A 261 -28.425 38.855 91.202 1.00 14.97 C ATOM 3109 C LYS A 261 -29.281 39.198 89.998 1.00 11.55 C ATOM 3110 O LYS A 261 -28.863 38.937 88.878 1.00 13.30 O ATOM 3111 CB LYS A 261 -28.237 37.342 91.225 1.00 14.82 C ATOM 3112 CG LYS A 261 -27.450 36.737 92.394 1.00 12.61 C ATOM 3113 CD LYS A 261 -28.151 35.437 92.745 1.00 15.10 C ATOM 3114 CE LYS A 261 -27.234 34.375 93.236 1.00 12.77 C ATOM 3115 NZ LYS A 261 -27.074 34.472 94.672 1.00 21.56 N ATOM 3116 H LYS A 261 -28.322 39.948 93.027 1.00 0.00 H ATOM 3117 HZ1 LYS A 261 -27.996 34.233 95.083 1.00 0.00 H ATOM 3118 HZ2 LYS A 261 -26.783 35.424 94.968 1.00 0.00 H ATOM 3119 HZ3 LYS A 261 -26.346 33.773 94.946 1.00 0.00 H ATOM 3120 N THR A 262 -30.462 39.772 90.194 1.00 15.01 N ATOM 3121 CA THR A 262 -31.288 40.106 89.036 1.00 13.02 C ATOM 3122 C THR A 262 -31.704 41.572 88.956 1.00 15.10 C ATOM 3123 O THR A 262 -31.808 42.127 87.866 1.00 17.17 O ATOM 3124 CB THR A 262 -32.579 39.244 88.950 1.00 12.55 C ATOM 3125 OG1 THR A 262 -33.602 39.810 89.777 1.00 17.99 O ATOM 3126 CG2 THR A 262 -32.342 37.837 89.413 1.00 6.19 C ATOM 3127 H THR A 262 -30.805 39.933 91.095 1.00 0.00 H ATOM 3128 HG1 THR A 262 -33.912 40.668 89.445 1.00 0.00 H ATOM 3129 N GLY A 263 -31.899 42.204 90.106 1.00 13.55 N ATOM 3130 CA GLY A 263 -32.373 43.565 90.089 1.00 15.29 C ATOM 3131 C GLY A 263 -33.897 43.502 90.035 1.00 18.76 C ATOM 3132 O GLY A 263 -34.477 42.493 89.622 1.00 17.67 O ATOM 3133 H GLY A 263 -31.771 41.742 90.942 1.00 0.00 H ATOM 3134 N GLY A 264 -34.549 44.592 90.401 1.00 18.54 N ATOM 3135 CA GLY A 264 -35.991 44.577 90.413 1.00 21.74 C ATOM 3136 C GLY A 264 -36.589 45.186 89.185 1.00 20.32 C ATOM 3137 O GLY A 264 -35.993 46.038 88.552 1.00 23.02 O ATOM 3138 H GLY A 264 -34.072 45.428 90.586 1.00 0.00 H ATOM 3139 N TYR A 265 -37.812 44.797 88.887 1.00 22.23 N ATOM 3140 CA TYR A 265 -38.469 45.308 87.715 1.00 23.51 C ATOM 3141 C TYR A 265 -39.940 45.547 87.995 1.00 28.20 C ATOM 3142 O TYR A 265 -40.594 44.793 88.739 1.00 24.19 O ATOM 3143 CB TYR A 265 -38.312 44.324 86.552 1.00 20.90 C ATOM 3144 CG TYR A 265 -36.890 44.186 86.052 1.00 19.37 C ATOM 3145 CD1 TYR A 265 -35.963 43.401 86.725 1.00 19.15 C ATOM 3146 CD2 TYR A 265 -36.468 44.871 84.928 1.00 16.91 C ATOM 3147 CE1 TYR A 265 -34.659 43.313 86.288 1.00 17.67 C ATOM 3148 CE2 TYR A 265 -35.182 44.792 84.490 1.00 15.12 C ATOM 3149 CZ TYR A 265 -34.276 44.017 85.170 1.00 14.00 C ATOM 3150 OH TYR A 265 -32.975 43.974 84.734 1.00 16.65 O ATOM 3151 H TYR A 265 -38.335 44.210 89.472 1.00 0.00 H ATOM 3152 HH TYR A 265 -32.504 43.290 85.233 1.00 0.00 H ATOM 3153 N LEU A 266 -40.437 46.638 87.421 1.00 28.13 N ATOM 3154 CA LEU A 266 -41.836 47.019 87.537 1.00 26.18 C ATOM 3155 C LEU A 266 -42.641 46.296 86.442 1.00 25.60 C ATOM 3156 O LEU A 266 -42.535 46.637 85.272 1.00 26.36 O ATOM 3157 CB LEU A 266 -41.967 48.534 87.372 1.00 26.04 C ATOM 3158 CG LEU A 266 -43.369 49.130 87.480 1.00 25.68 C ATOM 3159 CD1 LEU A 266 -44.009 48.763 88.812 1.00 17.40 C ATOM 3160 CD2 LEU A 266 -43.274 50.635 87.315 1.00 24.00 C ATOM 3161 H LEU A 266 -39.820 47.188 86.898 1.00 0.00 H ATOM 3162 N VAL A 267 -43.385 45.259 86.812 1.00 25.69 N ATOM 3163 CA VAL A 267 -44.193 44.518 85.853 1.00 24.27 C ATOM 3164 C VAL A 267 -45.652 44.672 86.257 1.00 31.51 C ATOM 3165 O VAL A 267 -46.054 44.194 87.323 1.00 31.19 O ATOM 3166 CB VAL A 267 -43.878 43.026 85.866 1.00 21.23 C ATOM 3167 CG1 VAL A 267 -44.394 42.385 84.590 1.00 18.50 C ATOM 3168 CG2 VAL A 267 -42.399 42.791 86.057 1.00 20.65 C ATOM 3169 H VAL A 267 -43.393 44.993 87.750 1.00 0.00 H ATOM 3170 N ASN A 268 -46.440 45.315 85.389 1.00 34.06 N ATOM 3171 CA ASN A 268 -47.881 45.580 85.613 1.00 31.57 C ATOM 3172 C ASN A 268 -48.208 46.188 87.007 1.00 30.09 C ATOM 3173 O ASN A 268 -49.109 45.709 87.705 1.00 28.85 O ATOM 3174 CB ASN A 268 -48.761 44.319 85.367 1.00 27.83 C ATOM 3175 CG ASN A 268 -48.782 43.853 83.904 1.00 22.41 C ATOM 3176 OD1 ASN A 268 -48.897 42.660 83.632 1.00 29.00 O ATOM 3177 ND2 ASN A 268 -48.691 44.776 82.973 1.00 21.55 N ATOM 3178 H ASN A 268 -45.984 45.628 84.573 1.00 0.00 H ATOM 3179 HD21 ASN A 268 -48.680 45.734 83.166 1.00 0.00 H ATOM 3180 HD22 ASN A 268 -48.590 44.385 82.064 1.00 0.00 H ATOM 3181 N GLY A 269 -47.486 47.242 87.398 1.00 29.10 N ATOM 3182 CA GLY A 269 -47.728 47.897 88.681 1.00 24.92 C ATOM 3183 C GLY A 269 -47.108 47.235 89.896 1.00 25.24 C ATOM 3184 O GLY A 269 -47.096 47.812 90.990 1.00 25.53 O ATOM 3185 H GLY A 269 -46.773 47.586 86.824 1.00 0.00 H ATOM 3186 N LYS A 270 -46.612 46.014 89.710 1.00 24.80 N ATOM 3187 CA LYS A 270 -45.971 45.244 90.776 1.00 25.21 C ATOM 3188 C LYS A 270 -44.456 45.315 90.577 1.00 22.48 C ATOM 3189 O LYS A 270 -43.983 45.559 89.479 1.00 26.10 O ATOM 3190 CB LYS A 270 -46.437 43.787 90.739 1.00 26.75 C ATOM 3191 CG LYS A 270 -47.801 43.488 91.363 1.00 31.27 C ATOM 3192 CD LYS A 270 -48.201 42.026 91.068 1.00 40.13 C ATOM 3193 CE LYS A 270 -49.565 41.620 91.626 1.00 39.85 C ATOM 3194 NZ LYS A 270 -49.502 41.207 93.057 1.00 44.94 N ATOM 3195 H LYS A 270 -46.650 45.600 88.821 1.00 0.00 H ATOM 3196 HZ1 LYS A 270 -49.152 42.023 93.605 1.00 0.00 H ATOM 3197 HZ2 LYS A 270 -48.838 40.413 93.164 1.00 0.00 H ATOM 3198 HZ3 LYS A 270 -50.440 40.938 93.405 1.00 0.00 H ATOM 3199 N THR A 271 -43.707 44.969 91.606 1.00 23.53 N ATOM 3200 CA THR A 271 -42.264 45.069 91.575 1.00 20.50 C ATOM 3201 C THR A 271 -41.683 43.708 91.923 1.00 18.65 C ATOM 3202 O THR A 271 -41.957 43.145 92.964 1.00 21.22 O ATOM 3203 CB THR A 271 -41.859 46.198 92.566 1.00 21.69 C ATOM 3204 OG1 THR A 271 -40.774 46.961 92.036 1.00 30.40 O ATOM 3205 CG2 THR A 271 -41.530 45.680 93.940 1.00 11.93 C ATOM 3206 H THR A 271 -44.076 44.563 92.409 1.00 0.00 H ATOM 3207 HG1 THR A 271 -40.016 46.374 91.935 1.00 0.00 H ATOM 3208 N ARG A 272 -40.932 43.135 91.012 1.00 19.26 N ATOM 3209 CA ARG A 272 -40.378 41.826 91.267 1.00 18.17 C ATOM 3210 C ARG A 272 -39.004 41.642 90.644 1.00 16.87 C ATOM 3211 O ARG A 272 -38.505 42.524 89.943 1.00 17.06 O ATOM 3212 CB ARG A 272 -41.328 40.763 90.713 1.00 18.01 C ATOM 3213 CG ARG A 272 -41.510 40.809 89.196 1.00 21.87 C ATOM 3214 CD ARG A 272 -42.218 39.593 88.703 1.00 18.45 C ATOM 3215 NE ARG A 272 -42.312 39.532 87.240 1.00 21.56 N ATOM 3216 CZ ARG A 272 -41.441 38.887 86.465 1.00 19.85 C ATOM 3217 NH1 ARG A 272 -40.405 38.272 87.012 1.00 19.11 N ATOM 3218 NH2 ARG A 272 -41.656 38.770 85.168 1.00 11.39 N ATOM 3219 H ARG A 272 -40.710 43.569 90.156 1.00 0.00 H ATOM 3220 HE ARG A 272 -43.044 40.001 86.799 1.00 0.00 H ATOM 3221 HH11 ARG A 272 -40.283 38.292 88.001 1.00 0.00 H ATOM 3222 HH12 ARG A 272 -39.744 37.791 86.466 1.00 0.00 H ATOM 3223 HH21 ARG A 272 -42.473 39.175 84.771 1.00 0.00 H ATOM 3224 HH22 ARG A 272 -40.998 38.293 84.594 1.00 0.00 H ATOM 3225 N LYS A 273 -38.385 40.512 90.959 1.00 16.70 N ATOM 3226 CA LYS A 273 -37.089 40.150 90.406 1.00 20.76 C ATOM 3227 C LYS A 273 -37.400 39.126 89.306 1.00 20.74 C ATOM 3228 O LYS A 273 -38.523 38.617 89.213 1.00 20.82 O ATOM 3229 CB LYS A 273 -36.192 39.524 91.480 1.00 25.54 C ATOM 3230 CG LYS A 273 -36.796 38.310 92.180 1.00 27.85 C ATOM 3231 CD LYS A 273 -35.899 37.806 93.287 1.00 26.70 C ATOM 3232 CE LYS A 273 -34.747 37.017 92.727 1.00 30.21 C ATOM 3233 NZ LYS A 273 -33.785 36.592 93.800 1.00 38.45 N ATOM 3234 H LYS A 273 -38.846 39.871 91.545 1.00 0.00 H ATOM 3235 HZ1 LYS A 273 -34.291 36.049 94.526 1.00 0.00 H ATOM 3236 HZ2 LYS A 273 -33.343 37.424 94.233 1.00 0.00 H ATOM 3237 HZ3 LYS A 273 -33.053 36.003 93.362 1.00 0.00 H ATOM 3238 N LEU A 274 -36.416 38.846 88.461 1.00 17.61 N ATOM 3239 CA LEU A 274 -36.592 37.910 87.376 1.00 14.14 C ATOM 3240 C LEU A 274 -36.582 36.469 87.899 1.00 16.06 C ATOM 3241 O LEU A 274 -36.091 36.204 88.985 1.00 17.15 O ATOM 3242 CB LEU A 274 -35.491 38.127 86.321 1.00 7.22 C ATOM 3243 CG LEU A 274 -35.354 39.523 85.725 1.00 5.96 C ATOM 3244 CD1 LEU A 274 -34.392 39.518 84.576 1.00 8.25 C ATOM 3245 CD2 LEU A 274 -36.680 39.988 85.193 1.00 13.48 C ATOM 3246 H LEU A 274 -35.545 39.251 88.627 1.00 0.00 H ATOM 3247 N HIS A 275 -37.205 35.566 87.146 1.00 19.81 N ATOM 3248 CA HIS A 275 -37.276 34.128 87.449 1.00 17.62 C ATOM 3249 C HIS A 275 -36.046 33.542 86.746 1.00 18.04 C ATOM 3250 O HIS A 275 -35.635 34.069 85.717 1.00 24.13 O ATOM 3251 CB HIS A 275 -38.553 33.594 86.800 1.00 21.59 C ATOM 3252 CG HIS A 275 -38.702 32.105 86.838 1.00 23.71 C ATOM 3253 ND1 HIS A 275 -38.074 31.269 85.939 1.00 25.68 N ATOM 3254 CD2 HIS A 275 -39.447 31.304 87.634 1.00 21.27 C ATOM 3255 CE1 HIS A 275 -38.417 30.019 86.187 1.00 25.07 C ATOM 3256 NE2 HIS A 275 -39.254 30.015 87.208 1.00 25.08 N ATOM 3257 H HIS A 275 -37.607 35.913 86.339 1.00 0.00 H ATOM 3258 HD1 HIS A 275 -37.606 31.580 85.139 1.00 0.00 H ATOM 3259 HE2 HIS A 275 -39.648 29.208 87.596 1.00 0.00 H ATOM 3260 N PRO A 276 -35.506 32.402 87.206 1.00 12.63 N ATOM 3261 CA PRO A 276 -34.320 31.863 86.525 1.00 11.32 C ATOM 3262 C PRO A 276 -34.454 31.697 85.024 1.00 15.71 C ATOM 3263 O PRO A 276 -33.481 31.781 84.288 1.00 20.36 O ATOM 3264 CB PRO A 276 -34.118 30.537 87.206 1.00 12.65 C ATOM 3265 CG PRO A 276 -34.563 30.837 88.597 1.00 12.86 C ATOM 3266 CD PRO A 276 -35.839 31.592 88.380 1.00 9.32 C ATOM 3267 N ARG A 277 -35.683 31.476 84.574 1.00 19.16 N ATOM 3268 CA ARG A 277 -35.972 31.309 83.155 1.00 17.01 C ATOM 3269 C ARG A 277 -35.832 32.627 82.442 1.00 18.20 C ATOM 3270 O ARG A 277 -35.386 32.674 81.298 1.00 21.26 O ATOM 3271 CB ARG A 277 -37.385 30.791 82.921 1.00 17.50 C ATOM 3272 CG ARG A 277 -37.694 30.623 81.446 1.00 16.59 C ATOM 3273 CD ARG A 277 -37.437 29.178 81.010 1.00 22.17 C ATOM 3274 NE ARG A 277 -36.149 28.981 80.371 1.00 19.32 N ATOM 3275 CZ ARG A 277 -35.410 27.881 80.489 1.00 21.96 C ATOM 3276 NH1 ARG A 277 -35.804 26.855 81.239 1.00 16.99 N ATOM 3277 NH2 ARG A 277 -34.292 27.793 79.798 1.00 23.63 N ATOM 3278 H ARG A 277 -36.309 31.422 85.316 1.00 0.00 H ATOM 3279 HE ARG A 277 -35.788 29.714 79.835 1.00 0.00 H ATOM 3280 HH11 ARG A 277 -36.671 26.887 81.738 1.00 0.00 H ATOM 3281 HH12 ARG A 277 -35.218 26.047 81.321 1.00 0.00 H ATOM 3282 HH21 ARG A 277 -34.024 28.542 79.194 1.00 0.00 H ATOM 3283 HH22 ARG A 277 -33.709 26.987 79.875 1.00 0.00 H ATOM 3284 N GLU A 278 -36.269 33.701 83.081 1.00 16.65 N ATOM 3285 CA GLU A 278 -36.125 34.992 82.442 1.00 18.55 C ATOM 3286 C GLU A 278 -34.625 35.319 82.399 1.00 19.67 C ATOM 3287 O GLU A 278 -34.157 35.976 81.483 1.00 24.38 O ATOM 3288 CB GLU A 278 -36.941 36.043 83.181 1.00 17.95 C ATOM 3289 CG GLU A 278 -38.390 35.618 83.310 1.00 22.20 C ATOM 3290 CD GLU A 278 -39.261 36.624 84.013 1.00 24.36 C ATOM 3291 OE1 GLU A 278 -38.957 36.974 85.165 1.00 25.31 O ATOM 3292 OE2 GLU A 278 -40.278 37.037 83.423 1.00 27.10 O ATOM 3293 H GLU A 278 -36.633 33.675 83.985 1.00 0.00 H ATOM 3294 N CYS A 279 -33.859 34.830 83.373 1.00 18.32 N ATOM 3295 CA CYS A 279 -32.428 35.071 83.354 1.00 13.64 C ATOM 3296 C CYS A 279 -31.860 34.349 82.150 1.00 12.67 C ATOM 3297 O CYS A 279 -31.074 34.915 81.413 1.00 22.70 O ATOM 3298 CB CYS A 279 -31.767 34.580 84.620 1.00 9.99 C ATOM 3299 SG CYS A 279 -32.302 35.470 86.037 1.00 14.19 S ATOM 3300 H CYS A 279 -34.256 34.320 84.107 1.00 0.00 H ATOM 3301 N ALA A 280 -32.325 33.131 81.890 1.00 15.21 N ATOM 3302 CA ALA A 280 -31.855 32.358 80.736 1.00 8.54 C ATOM 3303 C ALA A 280 -32.051 33.139 79.462 1.00 13.07 C ATOM 3304 O ALA A 280 -31.151 33.266 78.653 1.00 21.25 O ATOM 3305 CB ALA A 280 -32.580 31.058 80.647 1.00 2.78 C ATOM 3306 H ALA A 280 -32.990 32.744 82.480 1.00 0.00 H ATOM 3307 N ARG A 281 -33.209 33.752 79.325 1.00 19.82 N ATOM 3308 CA ARG A 281 -33.530 34.502 78.116 1.00 19.17 C ATOM 3309 C ARG A 281 -32.728 35.778 77.966 1.00 19.37 C ATOM 3310 O ARG A 281 -32.348 36.147 76.856 1.00 17.75 O ATOM 3311 CB ARG A 281 -35.021 34.803 78.092 1.00 20.84 C ATOM 3312 CG ARG A 281 -35.873 33.559 78.131 1.00 18.71 C ATOM 3313 CD ARG A 281 -37.334 33.910 78.237 1.00 20.30 C ATOM 3314 NE ARG A 281 -38.194 32.734 78.101 1.00 22.49 N ATOM 3315 CZ ARG A 281 -39.517 32.768 78.202 1.00 21.25 C ATOM 3316 NH1 ARG A 281 -40.127 33.916 78.459 1.00 22.52 N ATOM 3317 NH2 ARG A 281 -40.234 31.674 77.983 1.00 21.43 N ATOM 3318 H ARG A 281 -33.889 33.685 80.028 1.00 0.00 H ATOM 3319 HE ARG A 281 -37.782 31.871 77.934 1.00 0.00 H ATOM 3320 HH11 ARG A 281 -41.107 33.961 78.590 1.00 0.00 H ATOM 3321 HH12 ARG A 281 -39.582 34.748 78.541 1.00 0.00 H ATOM 3322 HH21 ARG A 281 -39.781 30.819 77.746 1.00 0.00 H ATOM 3323 HH22 ARG A 281 -41.232 31.704 78.057 1.00 0.00 H ATOM 3324 N VAL A 282 -32.465 36.432 79.094 1.00 20.42 N ATOM 3325 CA VAL A 282 -31.695 37.668 79.140 1.00 19.66 C ATOM 3326 C VAL A 282 -30.216 37.381 78.819 1.00 18.82 C ATOM 3327 O VAL A 282 -29.480 38.281 78.403 1.00 20.43 O ATOM 3328 CB VAL A 282 -31.921 38.386 80.507 1.00 22.00 C ATOM 3329 CG1 VAL A 282 -30.832 39.373 80.815 1.00 26.60 C ATOM 3330 CG2 VAL A 282 -33.257 39.127 80.468 1.00 23.69 C ATOM 3331 H VAL A 282 -32.811 36.073 79.935 1.00 0.00 H ATOM 3332 N MET A 283 -29.804 36.117 78.963 1.00 14.72 N ATOM 3333 CA MET A 283 -28.441 35.699 78.633 1.00 12.96 C ATOM 3334 C MET A 283 -28.452 35.022 77.277 1.00 12.89 C ATOM 3335 O MET A 283 -27.457 34.441 76.855 1.00 16.23 O ATOM 3336 CB MET A 283 -27.898 34.706 79.637 1.00 13.89 C ATOM 3337 CG MET A 283 -27.788 35.247 81.034 1.00 16.73 C ATOM 3338 SD MET A 283 -26.559 36.503 81.103 1.00 17.33 S ATOM 3339 CE MET A 283 -25.235 35.614 81.276 1.00 13.31 C ATOM 3340 H MET A 283 -30.426 35.448 79.321 1.00 0.00 H ATOM 3341 N GLY A 284 -29.600 35.066 76.617 1.00 14.76 N ATOM 3342 CA GLY A 284 -29.734 34.472 75.313 1.00 12.54 C ATOM 3343 C GLY A 284 -29.747 32.960 75.306 1.00 15.65 C ATOM 3344 O GLY A 284 -29.412 32.374 74.282 1.00 19.32 O ATOM 3345 H GLY A 284 -30.386 35.491 76.990 1.00 0.00 H ATOM 3346 N TYR A 285 -30.082 32.319 76.419 1.00 13.05 N ATOM 3347 CA TYR A 285 -30.141 30.860 76.461 1.00 12.07 C ATOM 3348 C TYR A 285 -31.505 30.441 75.936 1.00 15.22 C ATOM 3349 O TYR A 285 -32.481 31.147 76.140 1.00 16.11 O ATOM 3350 CB TYR A 285 -29.976 30.349 77.891 1.00 10.91 C ATOM 3351 CG TYR A 285 -28.540 30.189 78.352 1.00 10.44 C ATOM 3352 CD1 TYR A 285 -27.703 31.278 78.535 1.00 9.48 C ATOM 3353 CD2 TYR A 285 -28.008 28.931 78.563 1.00 10.30 C ATOM 3354 CE1 TYR A 285 -26.361 31.101 78.912 1.00 9.15 C ATOM 3355 CE2 TYR A 285 -26.687 28.754 78.932 1.00 7.07 C ATOM 3356 CZ TYR A 285 -25.863 29.826 79.104 1.00 8.61 C ATOM 3357 OH TYR A 285 -24.539 29.579 79.446 1.00 15.78 O ATOM 3358 H TYR A 285 -30.294 32.859 77.190 1.00 0.00 H ATOM 3359 HH TYR A 285 -23.960 30.366 79.413 1.00 0.00 H ATOM 3360 N PRO A 286 -31.582 29.319 75.200 1.00 16.71 N ATOM 3361 CA PRO A 286 -32.834 28.802 74.634 1.00 15.76 C ATOM 3362 C PRO A 286 -33.721 28.215 75.694 1.00 17.69 C ATOM 3363 O PRO A 286 -33.226 27.670 76.683 1.00 22.89 O ATOM 3364 CB PRO A 286 -32.349 27.723 73.682 1.00 16.51 C ATOM 3365 CG PRO A 286 -31.134 27.236 74.337 1.00 18.73 C ATOM 3366 CD PRO A 286 -30.448 28.507 74.738 1.00 13.70 C ATOM 3367 N ASP A 287 -35.025 28.213 75.451 1.00 19.20 N ATOM 3368 CA ASP A 287 -35.953 27.706 76.451 1.00 20.60 C ATOM 3369 C ASP A 287 -35.753 26.219 76.741 1.00 20.46 C ATOM 3370 O ASP A 287 -36.094 25.729 77.825 1.00 22.63 O ATOM 3371 CB ASP A 287 -37.400 28.046 76.077 1.00 19.75 C ATOM 3372 CG ASP A 287 -37.699 29.534 76.173 1.00 17.73 C ATOM 3373 OD1 ASP A 287 -38.746 29.965 75.646 1.00 28.18 O ATOM 3374 OD2 ASP A 287 -36.910 30.286 76.789 1.00 24.37 O ATOM 3375 H ASP A 287 -35.399 28.462 74.562 1.00 0.00 H ATOM 3376 N SER A 288 -35.124 25.518 75.804 1.00 20.99 N ATOM 3377 CA SER A 288 -34.843 24.100 75.975 1.00 21.52 C ATOM 3378 C SER A 288 -33.761 23.828 77.016 1.00 23.07 C ATOM 3379 O SER A 288 -33.619 22.696 77.473 1.00 28.85 O ATOM 3380 CB SER A 288 -34.451 23.467 74.632 1.00 21.95 C ATOM 3381 OG SER A 288 -33.859 24.401 73.740 1.00 20.60 O ATOM 3382 H SER A 288 -34.918 25.965 74.950 1.00 0.00 H ATOM 3383 HG SER A 288 -34.540 25.003 73.321 1.00 0.00 H ATOM 3384 N TYR A 289 -32.985 24.848 77.377 1.00 21.23 N ATOM 3385 CA TYR A 289 -31.929 24.661 78.346 1.00 19.80 C ATOM 3386 C TYR A 289 -32.530 24.433 79.722 1.00 18.93 C ATOM 3387 O TYR A 289 -33.326 25.233 80.207 1.00 22.89 O ATOM 3388 CB TYR A 289 -30.978 25.862 78.350 1.00 20.47 C ATOM 3389 CG TYR A 289 -29.694 25.637 79.132 1.00 18.45 C ATOM 3390 CD1 TYR A 289 -28.589 25.050 78.539 1.00 17.59 C ATOM 3391 CD2 TYR A 289 -29.612 25.953 80.488 1.00 22.17 C ATOM 3392 CE1 TYR A 289 -27.433 24.766 79.288 1.00 19.60 C ATOM 3393 CE2 TYR A 289 -28.459 25.674 81.237 1.00 17.98 C ATOM 3394 CZ TYR A 289 -27.386 25.080 80.633 1.00 13.89 C ATOM 3395 OH TYR A 289 -26.282 24.775 81.377 1.00 14.49 O ATOM 3396 H TYR A 289 -33.137 25.746 77.011 1.00 0.00 H ATOM 3397 HH TYR A 289 -25.602 24.422 80.792 1.00 0.00 H ATOM 3398 N LYS A 290 -32.146 23.323 80.341 1.00 19.88 N ATOM 3399 CA LYS A 290 -32.630 22.927 81.665 1.00 19.43 C ATOM 3400 C LYS A 290 -31.955 23.695 82.806 1.00 18.84 C ATOM 3401 O LYS A 290 -30.738 23.608 82.969 1.00 23.77 O ATOM 3402 CB LYS A 290 -32.392 21.413 81.861 1.00 18.84 C ATOM 3403 CG LYS A 290 -32.726 20.559 80.637 1.00 22.26 C ATOM 3404 CD LYS A 290 -32.486 19.063 80.836 1.00 27.87 C ATOM 3405 CE LYS A 290 -33.804 18.309 80.891 1.00 30.22 C ATOM 3406 NZ LYS A 290 -34.783 18.945 79.960 1.00 36.77 N ATOM 3407 H LYS A 290 -31.503 22.744 79.883 1.00 0.00 H ATOM 3408 HZ1 LYS A 290 -34.369 18.945 79.004 1.00 0.00 H ATOM 3409 HZ2 LYS A 290 -34.948 19.939 80.240 1.00 0.00 H ATOM 3410 HZ3 LYS A 290 -35.707 18.469 79.936 1.00 0.00 H ATOM 3411 N VAL A 291 -32.716 24.468 83.581 1.00 21.49 N ATOM 3412 CA VAL A 291 -32.092 25.180 84.689 1.00 21.02 C ATOM 3413 C VAL A 291 -31.886 24.312 85.940 1.00 20.11 C ATOM 3414 O VAL A 291 -32.616 23.362 86.208 1.00 21.52 O ATOM 3415 CB VAL A 291 -32.768 26.530 85.065 1.00 16.82 C ATOM 3416 CG1 VAL A 291 -33.386 27.205 83.855 1.00 16.29 C ATOM 3417 CG2 VAL A 291 -33.730 26.352 86.189 1.00 23.15 C ATOM 3418 H VAL A 291 -33.642 24.623 83.297 1.00 0.00 H ATOM 3419 N HIS A 292 -30.834 24.623 86.666 1.00 16.02 N ATOM 3420 CA HIS A 292 -30.505 23.896 87.844 1.00 14.12 C ATOM 3421 C HIS A 292 -31.678 24.048 88.798 1.00 16.31 C ATOM 3422 O HIS A 292 -32.288 25.116 88.861 1.00 16.40 O ATOM 3423 CB HIS A 292 -29.240 24.484 88.430 1.00 13.18 C ATOM 3424 CG HIS A 292 -28.666 23.656 89.520 1.00 12.23 C ATOM 3425 ND1 HIS A 292 -29.120 23.730 90.813 1.00 12.71 N ATOM 3426 CD2 HIS A 292 -27.750 22.666 89.488 1.00 9.63 C ATOM 3427 CE1 HIS A 292 -28.513 22.807 91.538 1.00 10.92 C ATOM 3428 NE2 HIS A 292 -27.677 22.153 90.758 1.00 13.82 N ATOM 3429 H HIS A 292 -30.269 25.393 86.425 1.00 0.00 H ATOM 3430 HD1 HIS A 292 -29.688 24.462 91.123 1.00 0.00 H ATOM 3431 HE2 HIS A 292 -27.078 21.427 91.031 1.00 0.00 H ATOM 3432 N PRO A 293 -31.999 22.984 89.561 1.00 14.65 N ATOM 3433 CA PRO A 293 -33.096 22.932 90.527 1.00 13.57 C ATOM 3434 C PRO A 293 -33.043 23.897 91.692 1.00 16.98 C ATOM 3435 O PRO A 293 -34.058 24.191 92.303 1.00 19.38 O ATOM 3436 CB PRO A 293 -33.088 21.470 90.977 1.00 13.98 C ATOM 3437 CG PRO A 293 -31.722 21.022 90.722 1.00 12.68 C ATOM 3438 CD PRO A 293 -31.412 21.646 89.401 1.00 15.70 C ATOM 3439 N SER A 294 -31.846 24.354 92.030 1.00 19.10 N ATOM 3440 CA SER A 294 -31.683 25.318 93.105 1.00 16.67 C ATOM 3441 C SER A 294 -31.721 26.694 92.457 1.00 18.92 C ATOM 3442 O SER A 294 -30.841 27.033 91.680 1.00 23.84 O ATOM 3443 CB SER A 294 -30.346 25.131 93.779 1.00 9.45 C ATOM 3444 OG SER A 294 -30.080 26.238 94.609 1.00 18.50 O ATOM 3445 H SER A 294 -31.119 23.996 91.514 1.00 0.00 H ATOM 3446 HG SER A 294 -30.000 27.070 94.149 1.00 0.00 H ATOM 3447 N THR A 295 -32.744 27.478 92.745 1.00 20.75 N ATOM 3448 CA THR A 295 -32.844 28.796 92.160 1.00 20.38 C ATOM 3449 C THR A 295 -31.631 29.656 92.474 1.00 18.61 C ATOM 3450 O THR A 295 -31.170 30.404 91.630 1.00 23.07 O ATOM 3451 CB THR A 295 -34.145 29.504 92.593 1.00 23.50 C ATOM 3452 OG1 THR A 295 -34.306 29.398 94.014 1.00 29.75 O ATOM 3453 CG2 THR A 295 -35.343 28.884 91.885 1.00 24.99 C ATOM 3454 H THR A 295 -33.510 27.146 93.284 1.00 0.00 H ATOM 3455 HG1 THR A 295 -34.396 30.312 94.439 1.00 0.00 H ATOM 3456 N SER A 296 -31.067 29.488 93.662 1.00 20.55 N ATOM 3457 CA SER A 296 -29.904 30.273 94.065 1.00 19.56 C ATOM 3458 C SER A 296 -28.679 29.993 93.192 1.00 18.54 C ATOM 3459 O SER A 296 -27.996 30.906 92.738 1.00 23.80 O ATOM 3460 CB SER A 296 -29.594 30.000 95.531 1.00 16.54 C ATOM 3461 OG SER A 296 -28.959 31.110 96.112 1.00 19.37 O ATOM 3462 H SER A 296 -31.477 28.889 94.313 1.00 0.00 H ATOM 3463 HG SER A 296 -29.549 31.858 96.040 1.00 0.00 H ATOM 3464 N GLN A 297 -28.393 28.720 92.981 1.00 16.91 N ATOM 3465 CA GLN A 297 -27.275 28.326 92.165 1.00 12.68 C ATOM 3466 C GLN A 297 -27.606 28.646 90.719 1.00 15.84 C ATOM 3467 O GLN A 297 -26.752 29.031 89.951 1.00 21.00 O ATOM 3468 CB GLN A 297 -27.004 26.835 92.332 1.00 13.86 C ATOM 3469 CG GLN A 297 -26.536 26.416 93.708 1.00 9.36 C ATOM 3470 CD GLN A 297 -25.345 27.207 94.172 1.00 11.95 C ATOM 3471 OE1 GLN A 297 -24.396 27.454 93.411 1.00 18.54 O ATOM 3472 NE2 GLN A 297 -25.379 27.615 95.422 1.00 12.70 N ATOM 3473 H GLN A 297 -28.923 28.037 93.413 1.00 0.00 H ATOM 3474 HE21 GLN A 297 -26.152 27.391 95.951 1.00 0.00 H ATOM 3475 HE22 GLN A 297 -24.598 28.120 95.718 1.00 0.00 H ATOM 3476 N ALA A 298 -28.864 28.514 90.348 1.00 17.56 N ATOM 3477 CA ALA A 298 -29.259 28.810 88.987 1.00 14.56 C ATOM 3478 C ALA A 298 -28.912 30.259 88.708 1.00 14.35 C ATOM 3479 O ALA A 298 -28.226 30.553 87.722 1.00 18.58 O ATOM 3480 CB ALA A 298 -30.737 28.575 88.828 1.00 13.54 C ATOM 3481 H ALA A 298 -29.564 28.248 90.975 1.00 0.00 H ATOM 3482 N TYR A 299 -29.340 31.147 89.610 1.00 15.85 N ATOM 3483 CA TYR A 299 -29.078 32.594 89.519 1.00 14.66 C ATOM 3484 C TYR A 299 -27.579 32.857 89.503 1.00 19.62 C ATOM 3485 O TYR A 299 -27.102 33.715 88.766 1.00 22.26 O ATOM 3486 CB TYR A 299 -29.644 33.338 90.722 1.00 15.20 C ATOM 3487 CG TYR A 299 -31.122 33.604 90.706 1.00 16.74 C ATOM 3488 CD1 TYR A 299 -31.725 34.199 89.609 1.00 18.68 C ATOM 3489 CD2 TYR A 299 -31.923 33.267 91.796 1.00 16.70 C ATOM 3490 CE1 TYR A 299 -33.099 34.455 89.587 1.00 18.81 C ATOM 3491 CE2 TYR A 299 -33.303 33.514 91.783 1.00 18.38 C ATOM 3492 CZ TYR A 299 -33.882 34.108 90.670 1.00 19.10 C ATOM 3493 OH TYR A 299 -35.244 34.326 90.610 1.00 16.90 O ATOM 3494 H TYR A 299 -29.854 30.823 90.377 1.00 0.00 H ATOM 3495 HH TYR A 299 -35.377 35.068 90.040 1.00 0.00 H ATOM 3496 N LYS A 300 -26.841 32.175 90.372 1.00 19.42 N ATOM 3497 CA LYS A 300 -25.400 32.347 90.426 1.00 13.87 C ATOM 3498 C LYS A 300 -24.809 31.914 89.102 1.00 15.78 C ATOM 3499 O LYS A 300 -24.006 32.618 88.504 1.00 22.65 O ATOM 3500 CB LYS A 300 -24.831 31.516 91.562 1.00 14.72 C ATOM 3501 CG LYS A 300 -23.357 31.665 91.744 1.00 18.24 C ATOM 3502 CD LYS A 300 -22.925 30.909 92.953 1.00 20.10 C ATOM 3503 CE LYS A 300 -21.432 30.951 93.080 1.00 20.92 C ATOM 3504 NZ LYS A 300 -21.042 30.128 94.240 1.00 28.59 N ATOM 3505 H LYS A 300 -27.258 31.569 91.016 1.00 0.00 H ATOM 3506 HZ1 LYS A 300 -21.357 29.152 94.059 1.00 0.00 H ATOM 3507 HZ2 LYS A 300 -21.489 30.486 95.108 1.00 0.00 H ATOM 3508 HZ3 LYS A 300 -20.009 30.122 94.354 1.00 0.00 H ATOM 3509 N GLN A 301 -25.291 30.789 88.599 1.00 17.32 N ATOM 3510 CA GLN A 301 -24.833 30.224 87.349 1.00 14.14 C ATOM 3511 C GLN A 301 -25.092 31.147 86.181 1.00 14.05 C ATOM 3512 O GLN A 301 -24.204 31.384 85.371 1.00 16.98 O ATOM 3513 CB GLN A 301 -25.471 28.862 87.146 1.00 16.54 C ATOM 3514 CG GLN A 301 -24.866 27.826 88.051 1.00 14.26 C ATOM 3515 CD GLN A 301 -25.702 26.579 88.172 1.00 14.80 C ATOM 3516 OE1 GLN A 301 -26.734 26.424 87.509 1.00 16.05 O ATOM 3517 NE2 GLN A 301 -25.275 25.685 89.047 1.00 17.37 N ATOM 3518 H GLN A 301 -26.006 30.339 89.067 1.00 0.00 H ATOM 3519 HE21 GLN A 301 -24.496 25.969 89.550 1.00 0.00 H ATOM 3520 HE22 GLN A 301 -25.735 24.843 89.111 1.00 0.00 H ATOM 3521 N PHE A 302 -26.301 31.682 86.096 1.00 13.93 N ATOM 3522 CA PHE A 302 -26.619 32.631 85.029 1.00 11.47 C ATOM 3523 C PHE A 302 -25.863 33.941 85.180 1.00 11.62 C ATOM 3524 O PHE A 302 -25.428 34.493 84.183 1.00 14.80 O ATOM 3525 CB PHE A 302 -28.129 32.892 84.920 1.00 10.10 C ATOM 3526 CG PHE A 302 -28.855 31.826 84.165 1.00 12.08 C ATOM 3527 CD1 PHE A 302 -29.912 31.155 84.735 1.00 13.25 C ATOM 3528 CD2 PHE A 302 -28.411 31.424 82.922 1.00 8.66 C ATOM 3529 CE1 PHE A 302 -30.509 30.091 84.081 1.00 16.15 C ATOM 3530 CE2 PHE A 302 -29.001 30.366 82.261 1.00 12.00 C ATOM 3531 CZ PHE A 302 -30.047 29.695 82.832 1.00 12.96 C ATOM 3532 H PHE A 302 -26.959 31.401 86.744 1.00 0.00 H ATOM 3533 N GLY A 303 -25.653 34.394 86.421 1.00 10.67 N ATOM 3534 CA GLY A 303 -24.935 35.637 86.675 1.00 10.65 C ATOM 3535 C GLY A 303 -23.455 35.620 86.303 1.00 12.15 C ATOM 3536 O GLY A 303 -22.862 36.656 86.111 1.00 14.42 O ATOM 3537 H GLY A 303 -25.986 33.885 87.197 1.00 0.00 H ATOM 3538 N ASN A 304 -22.851 34.442 86.294 1.00 14.89 N ATOM 3539 CA ASN A 304 -21.450 34.238 85.922 1.00 13.96 C ATOM 3540 C ASN A 304 -21.303 34.055 84.408 1.00 12.70 C ATOM 3541 O ASN A 304 -20.221 34.191 83.857 1.00 14.51 O ATOM 3542 CB ASN A 304 -20.967 32.918 86.530 1.00 10.24 C ATOM 3543 CG ASN A 304 -20.155 33.095 87.771 1.00 10.43 C ATOM 3544 OD1 ASN A 304 -19.657 34.179 88.062 1.00 15.15 O ATOM 3545 ND2 ASN A 304 -19.986 32.014 88.507 1.00 10.89 N ATOM 3546 H ASN A 304 -23.375 33.657 86.558 1.00 0.00 H ATOM 3547 HD21 ASN A 304 -20.424 31.181 88.215 1.00 0.00 H ATOM 3548 HD22 ASN A 304 -19.428 32.063 89.303 1.00 0.00 H ATOM 3549 N SER A 305 -22.388 33.678 83.760 1.00 14.49 N ATOM 3550 CA SER A 305 -22.371 33.350 82.345 1.00 14.63 C ATOM 3551 C SER A 305 -22.091 34.404 81.311 1.00 15.62 C ATOM 3552 O SER A 305 -21.646 35.499 81.619 1.00 20.21 O ATOM 3553 CB SER A 305 -23.640 32.598 81.982 1.00 8.86 C ATOM 3554 OG SER A 305 -23.369 31.629 80.999 1.00 14.03 O ATOM 3555 H SER A 305 -23.238 33.640 84.229 1.00 0.00 H ATOM 3556 HG SER A 305 -24.122 31.032 81.091 1.00 0.00 H ATOM 3557 N VAL A 306 -22.345 34.041 80.060 1.00 14.50 N ATOM 3558 CA VAL A 306 -22.118 34.912 78.922 1.00 9.78 C ATOM 3559 C VAL A 306 -23.384 34.995 78.098 1.00 9.66 C ATOM 3560 O VAL A 306 -24.239 34.148 78.214 1.00 11.25 O ATOM 3561 CB VAL A 306 -21.004 34.342 78.051 1.00 11.22 C ATOM 3562 CG1 VAL A 306 -21.349 32.941 77.610 1.00 2.39 C ATOM 3563 CG2 VAL A 306 -20.774 35.242 76.876 1.00 15.73 C ATOM 3564 H VAL A 306 -22.715 33.147 79.881 1.00 0.00 H ATOM 3565 N VAL A 307 -23.545 36.056 77.323 1.00 14.61 N ATOM 3566 CA VAL A 307 -24.730 36.184 76.487 1.00 14.70 C ATOM 3567 C VAL A 307 -24.365 35.387 75.236 1.00 17.82 C ATOM 3568 O VAL A 307 -23.404 35.699 74.533 1.00 19.96 O ATOM 3569 CB VAL A 307 -25.049 37.661 76.179 1.00 6.83 C ATOM 3570 CG1 VAL A 307 -26.200 37.766 75.264 1.00 3.72 C ATOM 3571 CG2 VAL A 307 -25.380 38.381 77.445 1.00 4.47 C ATOM 3572 H VAL A 307 -22.864 36.763 77.306 1.00 0.00 H ATOM 3573 N ILE A 308 -25.093 34.308 75.014 1.00 18.32 N ATOM 3574 CA ILE A 308 -24.814 33.429 73.902 1.00 16.40 C ATOM 3575 C ILE A 308 -24.684 34.145 72.570 1.00 18.35 C ATOM 3576 O ILE A 308 -23.647 34.091 71.922 1.00 24.85 O ATOM 3577 CB ILE A 308 -25.884 32.336 73.814 1.00 18.63 C ATOM 3578 CG1 ILE A 308 -26.046 31.667 75.169 1.00 16.64 C ATOM 3579 CG2 ILE A 308 -25.498 31.278 72.812 1.00 14.30 C ATOM 3580 CD1 ILE A 308 -24.810 30.985 75.647 1.00 22.15 C ATOM 3581 H ILE A 308 -25.811 34.095 75.655 1.00 0.00 H ATOM 3582 N ASN A 309 -25.707 34.907 72.226 1.00 18.52 N ATOM 3583 CA ASN A 309 -25.769 35.630 70.961 1.00 15.06 C ATOM 3584 C ASN A 309 -24.467 36.309 70.590 1.00 17.95 C ATOM 3585 O ASN A 309 -23.967 36.151 69.473 1.00 22.71 O ATOM 3586 CB ASN A 309 -26.874 36.688 71.030 1.00 18.67 C ATOM 3587 CG ASN A 309 -28.244 36.102 71.346 1.00 16.67 C ATOM 3588 OD1 ASN A 309 -29.236 36.489 70.748 1.00 20.49 O ATOM 3589 ND2 ASN A 309 -28.304 35.173 72.292 1.00 14.74 N ATOM 3590 H ASN A 309 -26.346 35.068 72.938 1.00 0.00 H ATOM 3591 HD21 ASN A 309 -27.583 34.752 72.784 1.00 0.00 H ATOM 3592 HD22 ASN A 309 -29.249 35.005 72.486 1.00 0.00 H ATOM 3593 N VAL A 310 -23.915 37.076 71.525 1.00 16.24 N ATOM 3594 CA VAL A 310 -22.674 37.797 71.276 1.00 14.17 C ATOM 3595 C VAL A 310 -21.620 36.814 70.808 1.00 15.74 C ATOM 3596 O VAL A 310 -20.972 36.985 69.765 1.00 19.78 O ATOM 3597 CB VAL A 310 -22.175 38.506 72.556 1.00 12.88 C ATOM 3598 CG1 VAL A 310 -20.821 39.119 72.343 1.00 11.43 C ATOM 3599 CG2 VAL A 310 -23.126 39.573 72.961 1.00 13.02 C ATOM 3600 H VAL A 310 -24.333 37.151 72.408 1.00 0.00 H ATOM 3601 N LEU A 311 -21.518 35.737 71.557 1.00 16.35 N ATOM 3602 CA LEU A 311 -20.558 34.707 71.281 1.00 14.89 C ATOM 3603 C LEU A 311 -20.724 34.015 69.958 1.00 15.63 C ATOM 3604 O LEU A 311 -19.760 33.503 69.399 1.00 20.38 O ATOM 3605 CB LEU A 311 -20.631 33.688 72.372 1.00 11.69 C ATOM 3606 CG LEU A 311 -19.544 33.831 73.380 1.00 4.74 C ATOM 3607 CD1 LEU A 311 -19.536 35.203 73.919 1.00 11.08 C ATOM 3608 CD2 LEU A 311 -19.877 32.848 74.410 1.00 9.17 C ATOM 3609 H LEU A 311 -22.125 35.619 72.313 1.00 0.00 H ATOM 3610 N GLN A 312 -21.955 33.937 69.492 1.00 15.23 N ATOM 3611 CA GLN A 312 -22.222 33.293 68.225 1.00 14.57 C ATOM 3612 C GLN A 312 -21.600 34.121 67.140 1.00 17.47 C ATOM 3613 O GLN A 312 -20.830 33.614 66.336 1.00 20.43 O ATOM 3614 CB GLN A 312 -23.711 33.170 67.990 1.00 14.31 C ATOM 3615 CG GLN A 312 -24.343 32.201 68.936 1.00 16.08 C ATOM 3616 CD GLN A 312 -25.761 31.946 68.593 1.00 19.46 C ATOM 3617 OE1 GLN A 312 -26.654 32.683 69.021 1.00 22.95 O ATOM 3618 NE2 GLN A 312 -26.000 30.906 67.790 1.00 25.47 N ATOM 3619 H GLN A 312 -22.669 34.329 70.041 1.00 0.00 H ATOM 3620 HE21 GLN A 312 -25.228 30.386 67.478 1.00 0.00 H ATOM 3621 HE22 GLN A 312 -26.919 30.678 67.535 1.00 0.00 H ATOM 3622 N TYR A 313 -21.886 35.412 67.146 1.00 19.31 N ATOM 3623 CA TYR A 313 -21.322 36.273 66.129 1.00 20.19 C ATOM 3624 C TYR A 313 -19.791 36.226 66.160 1.00 22.80 C ATOM 3625 O TYR A 313 -19.148 36.193 65.115 1.00 24.88 O ATOM 3626 CB TYR A 313 -21.826 37.696 66.313 1.00 20.74 C ATOM 3627 CG TYR A 313 -23.325 37.812 66.290 1.00 16.55 C ATOM 3628 CD1 TYR A 313 -24.012 38.342 67.374 1.00 18.89 C ATOM 3629 CD2 TYR A 313 -24.055 37.395 65.193 1.00 17.39 C ATOM 3630 CE1 TYR A 313 -25.377 38.457 67.369 1.00 4.78 C ATOM 3631 CE2 TYR A 313 -25.432 37.507 65.181 1.00 16.14 C ATOM 3632 CZ TYR A 313 -26.084 38.045 66.270 1.00 16.21 C ATOM 3633 OH TYR A 313 -27.456 38.225 66.239 1.00 22.55 O ATOM 3634 H TYR A 313 -22.484 35.780 67.836 1.00 0.00 H ATOM 3635 HH TYR A 313 -27.700 38.563 67.119 1.00 0.00 H ATOM 3636 N ILE A 314 -19.197 36.232 67.350 1.00 23.91 N ATOM 3637 CA ILE A 314 -17.745 36.173 67.424 1.00 18.39 C ATOM 3638 C ILE A 314 -17.315 34.820 66.873 1.00 16.66 C ATOM 3639 O ILE A 314 -16.502 34.773 65.959 1.00 23.55 O ATOM 3640 CB ILE A 314 -17.211 36.427 68.856 1.00 12.51 C ATOM 3641 CG1 ILE A 314 -17.614 37.812 69.318 1.00 8.24 C ATOM 3642 CG2 ILE A 314 -15.719 36.465 68.869 1.00 10.98 C ATOM 3643 CD1 ILE A 314 -17.393 38.024 70.768 1.00 8.49 C ATOM 3644 H ILE A 314 -19.737 36.295 68.165 1.00 0.00 H ATOM 3645 N ALA A 315 -17.957 33.740 67.306 1.00 12.87 N ATOM 3646 CA ALA A 315 -17.606 32.400 66.818 1.00 12.20 C ATOM 3647 C ALA A 315 -17.727 32.273 65.296 1.00 12.62 C ATOM 3648 O ALA A 315 -16.891 31.664 64.636 1.00 16.35 O ATOM 3649 CB ALA A 315 -18.458 31.362 67.497 1.00 13.75 C ATOM 3650 H ALA A 315 -18.702 33.842 67.927 1.00 0.00 H ATOM 3651 N TYR A 316 -18.740 32.897 64.724 1.00 17.86 N ATOM 3652 CA TYR A 316 -18.929 32.851 63.286 1.00 17.76 C ATOM 3653 C TYR A 316 -17.769 33.525 62.609 1.00 18.99 C ATOM 3654 O TYR A 316 -17.291 33.069 61.568 1.00 20.26 O ATOM 3655 CB TYR A 316 -20.203 33.590 62.870 1.00 17.34 C ATOM 3656 CG TYR A 316 -20.548 33.406 61.399 1.00 19.24 C ATOM 3657 CD1 TYR A 316 -21.480 32.469 61.004 1.00 20.07 C ATOM 3658 CD2 TYR A 316 -19.922 34.155 60.411 1.00 22.22 C ATOM 3659 CE1 TYR A 316 -21.778 32.279 59.676 1.00 25.45 C ATOM 3660 CE2 TYR A 316 -20.213 33.979 59.087 1.00 18.40 C ATOM 3661 CZ TYR A 316 -21.144 33.034 58.721 1.00 28.97 C ATOM 3662 OH TYR A 316 -21.434 32.814 57.391 1.00 38.21 O ATOM 3663 H TYR A 316 -19.370 33.411 65.270 1.00 0.00 H ATOM 3664 HH TYR A 316 -22.108 32.145 57.296 1.00 0.00 H ATOM 3665 N ASN A 317 -17.368 34.659 63.164 1.00 20.32 N ATOM 3666 CA ASN A 317 -16.276 35.448 62.615 1.00 19.69 C ATOM 3667 C ASN A 317 -14.888 34.858 62.773 1.00 22.11 C ATOM 3668 O ASN A 317 -13.972 35.186 61.998 1.00 22.24 O ATOM 3669 CB ASN A 317 -16.348 36.858 63.162 1.00 20.45 C ATOM 3670 CG ASN A 317 -17.456 37.636 62.528 1.00 17.64 C ATOM 3671 OD1 ASN A 317 -18.248 37.077 61.778 1.00 17.86 O ATOM 3672 ND2 ASN A 317 -17.495 38.939 62.770 1.00 21.24 N ATOM 3673 H ASN A 317 -17.843 34.992 63.956 1.00 0.00 H ATOM 3674 HD21 ASN A 317 -16.810 39.309 63.357 1.00 0.00 H ATOM 3675 HD22 ASN A 317 -18.188 39.501 62.336 1.00 0.00 H ATOM 3676 N ILE A 318 -14.719 34.048 63.818 1.00 22.13 N ATOM 3677 CA ILE A 318 -13.472 33.331 64.061 1.00 20.27 C ATOM 3678 C ILE A 318 -13.437 32.311 62.918 1.00 23.39 C ATOM 3679 O ILE A 318 -12.456 32.235 62.175 1.00 25.65 O ATOM 3680 CB ILE A 318 -13.490 32.625 65.449 1.00 19.66 C ATOM 3681 CG1 ILE A 318 -13.358 33.680 66.562 1.00 17.94 C ATOM 3682 CG2 ILE A 318 -12.388 31.585 65.544 1.00 10.63 C ATOM 3683 CD1 ILE A 318 -13.366 33.130 67.977 1.00 15.26 C ATOM 3684 H ILE A 318 -15.466 33.965 64.451 1.00 0.00 H ATOM 3685 N GLY A 319 -14.558 31.612 62.720 1.00 23.54 N ATOM 3686 CA GLY A 319 -14.658 30.635 61.655 1.00 19.26 C ATOM 3687 C GLY A 319 -14.479 31.291 60.306 1.00 22.30 C ATOM 3688 O GLY A 319 -13.748 30.786 59.456 1.00 26.31 O ATOM 3689 H GLY A 319 -15.326 31.729 63.319 1.00 0.00 H ATOM 3690 N SER A 320 -15.103 32.442 60.110 1.00 22.01 N ATOM 3691 CA SER A 320 -14.975 33.137 58.848 1.00 22.89 C ATOM 3692 C SER A 320 -13.512 33.435 58.539 1.00 27.76 C ATOM 3693 O SER A 320 -13.050 33.140 57.439 1.00 33.45 O ATOM 3694 CB SER A 320 -15.799 34.421 58.831 1.00 24.48 C ATOM 3695 OG SER A 320 -17.187 34.135 58.839 1.00 26.37 O ATOM 3696 H SER A 320 -15.631 32.835 60.828 1.00 0.00 H ATOM 3697 HG SER A 320 -17.413 33.681 59.658 1.00 0.00 H ATOM 3698 N SER A 321 -12.765 33.962 59.509 1.00 27.21 N ATOM 3699 CA SER A 321 -11.349 34.267 59.283 1.00 22.51 C ATOM 3700 C SER A 321 -10.571 33.008 59.007 1.00 20.45 C ATOM 3701 O SER A 321 -9.889 32.914 58.003 1.00 22.28 O ATOM 3702 CB SER A 321 -10.730 34.986 60.478 1.00 21.12 C ATOM 3703 OG SER A 321 -11.469 36.145 60.803 1.00 20.80 O ATOM 3704 H SER A 321 -13.159 34.160 60.381 1.00 0.00 H ATOM 3705 HG SER A 321 -12.210 35.767 61.296 1.00 0.00 H ATOM 3706 N LEU A 322 -10.688 32.033 59.898 1.00 24.47 N ATOM 3707 CA LEU A 322 -9.992 30.762 59.738 1.00 23.34 C ATOM 3708 C LEU A 322 -10.252 30.135 58.372 1.00 28.73 C ATOM 3709 O LEU A 322 -9.351 29.555 57.761 1.00 28.76 O ATOM 3710 CB LEU A 322 -10.411 29.773 60.833 1.00 14.99 C ATOM 3711 CG LEU A 322 -9.856 30.003 62.240 1.00 12.95 C ATOM 3712 CD1 LEU A 322 -10.329 28.934 63.163 1.00 8.74 C ATOM 3713 CD2 LEU A 322 -8.370 29.982 62.216 1.00 13.12 C ATOM 3714 H LEU A 322 -11.237 32.154 60.695 1.00 0.00 H ATOM 3715 N ASN A 323 -11.476 30.295 57.879 1.00 29.53 N ATOM 3716 CA ASN A 323 -11.868 29.697 56.609 1.00 27.53 C ATOM 3717 C ASN A 323 -11.346 30.323 55.328 1.00 27.76 C ATOM 3718 O ASN A 323 -11.348 29.668 54.270 1.00 28.46 O ATOM 3719 CB ASN A 323 -13.393 29.540 56.538 1.00 29.17 C ATOM 3720 CG ASN A 323 -13.905 28.396 57.409 1.00 28.60 C ATOM 3721 OD1 ASN A 323 -13.237 27.365 57.563 1.00 27.21 O ATOM 3722 ND2 ASN A 323 -15.104 28.559 57.961 1.00 30.01 N ATOM 3723 H ASN A 323 -12.129 30.819 58.385 1.00 0.00 H ATOM 3724 HD21 ASN A 323 -15.625 29.377 57.825 1.00 0.00 H ATOM 3725 HD22 ASN A 323 -15.401 27.814 58.527 1.00 0.00 H ATOM 3726 N PHE A 324 -10.900 31.572 55.400 1.00 26.93 N ATOM 3727 CA PHE A 324 -10.391 32.261 54.214 1.00 24.23 C ATOM 3728 C PHE A 324 -8.930 31.894 53.984 1.00 25.00 C ATOM 3729 O PHE A 324 -8.043 32.533 54.530 1.00 28.71 O ATOM 3730 CB PHE A 324 -10.554 33.778 54.371 1.00 20.67 C ATOM 3731 CG PHE A 324 -10.219 34.569 53.121 1.00 17.08 C ATOM 3732 CD1 PHE A 324 -11.025 34.494 51.997 1.00 19.01 C ATOM 3733 CD2 PHE A 324 -9.090 35.379 53.071 1.00 20.71 C ATOM 3734 CE1 PHE A 324 -10.717 35.209 50.846 1.00 19.01 C ATOM 3735 CE2 PHE A 324 -8.775 36.100 51.918 1.00 21.14 C ATOM 3736 CZ PHE A 324 -9.591 36.012 50.807 1.00 19.20 C ATOM 3737 H PHE A 324 -10.871 32.034 56.266 1.00 0.00 H ATOM 3738 N LYS A 325 -8.682 30.872 53.168 1.00 27.00 N ATOM 3739 CA LYS A 325 -7.317 30.408 52.894 1.00 31.18 C ATOM 3740 C LYS A 325 -7.118 30.254 51.392 1.00 30.95 C ATOM 3741 O LYS A 325 -6.803 29.165 50.908 1.00 36.60 O ATOM 3742 CB LYS A 325 -7.073 29.030 53.562 1.00 34.76 C ATOM 3743 CG LYS A 325 -7.335 28.919 55.078 1.00 36.73 C ATOM 3744 CD LYS A 325 -7.372 27.443 55.527 1.00 42.74 C ATOM 3745 CE LYS A 325 -7.400 27.316 57.058 1.00 52.62 C ATOM 3746 NZ LYS A 325 -7.247 25.935 57.636 1.00 57.53 N ATOM 3747 H LYS A 325 -9.424 30.383 52.772 1.00 0.00 H ATOM 3748 HZ1 LYS A 325 -6.358 25.496 57.308 1.00 0.00 H ATOM 3749 HZ2 LYS A 325 -8.061 25.345 57.373 1.00 0.00 H ATOM 3750 HZ3 LYS A 325 -7.205 26.035 58.673 1.00 0.00 H ATOM 3751 N PRO A 326 -7.224 31.348 50.634 1.00 30.23 N ATOM 3752 CA PRO A 326 -7.052 31.234 49.182 1.00 31.40 C ATOM 3753 C PRO A 326 -5.662 30.846 48.696 1.00 30.29 C ATOM 3754 O PRO A 326 -4.724 30.683 49.478 1.00 32.95 O ATOM 3755 CB PRO A 326 -7.472 32.608 48.681 1.00 29.27 C ATOM 3756 CG PRO A 326 -6.979 33.487 49.757 1.00 34.02 C ATOM 3757 CD PRO A 326 -7.367 32.752 51.032 1.00 30.70 C ATOM 3758 N TYR A 327 -5.572 30.648 47.389 1.00 29.93 N ATOM 3759 CA TYR A 327 -4.332 30.270 46.747 1.00 26.42 C ATOM 3760 C TYR A 327 -3.513 31.490 46.453 1.00 26.47 C ATOM 3761 O TYR A 327 -2.279 31.342 46.352 1.00 27.80 O ATOM 3762 CB TYR A 327 -4.621 29.517 45.453 1.00 22.33 C ATOM 3763 CG TYR A 327 -4.914 28.067 45.703 1.00 16.31 C ATOM 3764 CD1 TYR A 327 -6.205 27.571 45.607 1.00 20.49 C ATOM 3765 CD2 TYR A 327 -3.898 27.191 46.058 1.00 17.97 C ATOM 3766 CE1 TYR A 327 -6.483 26.240 45.856 1.00 17.55 C ATOM 3767 CE2 TYR A 327 -4.166 25.863 46.315 1.00 18.83 C ATOM 3768 CZ TYR A 327 -5.463 25.396 46.206 1.00 16.87 C ATOM 3769 OH TYR A 327 -5.739 24.070 46.421 1.00 25.52 O ATOM 3770 OXT TYR A 327 -4.134 32.563 46.320 1.00 27.33 O ATOM 3771 H TYR A 327 -6.359 30.800 46.834 1.00 0.00 H ATOM 3772 HH TYR A 327 -4.942 23.553 46.554 1.00 0.00 H TER 3773 TYR A 327 HETATM 3774 S SO4 A 600 -36.669 17.224 77.849 1.00 53.19 S HETATM 3775 O1 SO4 A 600 -35.993 16.631 78.944 1.00 56.60 O HETATM 3776 O2 SO4 A 600 -36.175 16.670 76.643 1.00 52.87 O HETATM 3777 O3 SO4 A 600 -36.278 18.596 77.794 1.00 59.91 O HETATM 3778 O4 SO4 A 600 -38.094 17.143 78.046 1.00 53.19 O HETATM 3779 S SO4 A 601 -40.698 24.116 81.038 1.00 61.29 S HETATM 3780 O1 SO4 A 601 -39.298 24.398 80.833 1.00 61.97 O HETATM 3781 O2 SO4 A 601 -41.280 23.643 79.817 1.00 64.99 O HETATM 3782 O3 SO4 A 601 -41.455 25.219 81.581 1.00 62.60 O HETATM 3783 O4 SO4 A 601 -40.765 23.047 81.963 1.00 66.00 O HETATM 3784 N SAH A 328 -18.668 31.220 80.671 1.00 14.00 N HETATM 3785 CA SAH A 328 -19.097 30.259 81.660 1.00 16.73 C HETATM 3786 CB SAH A 328 -19.105 30.832 83.072 1.00 13.96 C HETATM 3787 CG SAH A 328 -17.743 31.362 83.480 1.00 17.91 C HETATM 3788 SD SAH A 328 -17.590 31.961 85.181 1.00 22.79 S HETATM 3789 C SAH A 328 -20.493 29.940 81.203 1.00 17.33 C HETATM 3790 O SAH A 328 -21.455 29.980 82.057 1.00 19.14 O HETATM 3791 OXT SAH A 328 -20.687 30.075 79.921 1.00 28.06 O HETATM 3792 C5' SAH A 328 -16.127 31.398 86.057 1.00 14.01 C HETATM 3793 C4' SAH A 328 -16.421 29.937 86.125 1.00 9.92 C HETATM 3794 O4' SAH A 328 -15.182 29.215 86.319 1.00 12.80 O HETATM 3795 C3' SAH A 328 -17.347 29.508 87.260 1.00 14.46 C HETATM 3796 O3' SAH A 328 -18.142 28.402 86.842 1.00 18.58 O HETATM 3797 C2' SAH A 328 -16.374 28.983 88.298 1.00 16.00 C HETATM 3798 O2' SAH A 328 -16.970 28.007 89.121 1.00 18.74 O HETATM 3799 C1' SAH A 328 -15.340 28.328 87.399 1.00 13.84 C HETATM 3800 N9 SAH A 328 -14.050 28.125 88.039 1.00 17.32 N HETATM 3801 C8 SAH A 328 -13.335 29.007 88.803 1.00 17.36 C HETATM 3802 N7 SAH A 328 -12.196 28.525 89.242 1.00 19.93 N HETATM 3803 C5 SAH A 328 -12.155 27.235 88.723 1.00 18.02 C HETATM 3804 C6 SAH A 328 -11.207 26.199 88.820 1.00 15.50 C HETATM 3805 N6 SAH A 328 -10.080 26.290 89.513 1.00 14.83 N HETATM 3806 N1 SAH A 328 -11.471 25.044 88.177 1.00 21.08 N HETATM 3807 C2 SAH A 328 -12.621 24.935 87.490 1.00 16.70 C HETATM 3808 N3 SAH A 328 -13.589 25.830 87.333 1.00 18.81 N HETATM 3809 C4 SAH A 328 -13.292 26.978 87.982 1.00 17.55 C HETATM 3810 HN1 SAH A 328 -18.958 31.007 79.764 1.00 0.00 H HETATM 3811 HN2 SAH A 328 -18.054 31.969 80.882 1.00 0.00 H HETATM 3812 HO3' SAH A 328 -17.503 27.739 86.600 1.00 0.00 H HETATM 3813 HO2' SAH A 328 -17.009 27.205 88.603 1.00 0.00 H HETATM 3814 HN61 SAH A 328 -9.856 27.156 89.985 1.00 0.00 H HETATM 3815 HN62 SAH A 328 -9.463 25.500 89.583 1.00 0.00 H HETATM 3816 O HOH C 414 -23.007 29.040 99.188 1.00 34.08 O HETATM 3817 H1 HOH C 414 -22.269 28.818 99.765 1.00 0.00 H HETATM 3818 H2 HOH C 414 -22.707 29.892 98.828 1.00 0.00 H HETATM 3819 O HOH C 415 -21.873 27.137 97.628 1.00 36.51 O HETATM 3820 H1 HOH C 415 -22.193 26.631 98.376 1.00 0.00 H HETATM 3821 H2 HOH C 415 -21.259 27.770 98.012 1.00 0.00 H HETATM 3822 O HOH C 416 -30.846 33.974 97.622 1.00 18.51 O HETATM 3823 H1 HOH C 416 -31.287 34.820 97.473 1.00 0.00 H HETATM 3824 H2 HOH C 416 -30.170 33.963 96.939 1.00 0.00 H HETATM 3825 O HOH C 417 -26.953 49.703 100.462 1.00 32.36 O HETATM 3826 H1 HOH C 417 -27.893 49.584 100.363 1.00 0.00 H HETATM 3827 H2 HOH C 417 -26.859 50.217 101.269 1.00 0.00 H HETATM 3828 O HOH C 418 -15.159 24.645 94.812 1.00 34.89 O HETATM 3829 H1 HOH C 418 -14.294 24.702 94.405 1.00 0.00 H HETATM 3830 H2 HOH C 418 -15.500 23.812 94.466 1.00 0.00 H HETATM 3831 O HOH C 419 -20.067 44.950 101.674 1.00 33.48 O HETATM 3832 H1 HOH C 419 -19.380 45.609 101.790 1.00 0.00 H HETATM 3833 H2 HOH C 419 -19.532 44.154 101.556 1.00 0.00 H HETATM 3834 O HOH C 420 -27.076 41.172 106.338 1.00 34.24 O HETATM 3835 H1 HOH C 420 -27.510 41.984 106.068 1.00 0.00 H HETATM 3836 H2 HOH C 420 -26.734 41.363 107.212 1.00 0.00 H HETATM 3837 O HOH C 421 -19.917 54.542 82.059 1.00 43.20 O HETATM 3838 H1 HOH C 421 -19.228 54.577 81.398 1.00 0.00 H HETATM 3839 H2 HOH C 421 -19.516 54.930 82.844 1.00 0.00 H HETATM 3840 O HOH C 422 -12.321 57.732 82.079 1.00 33.32 O HETATM 3841 H1 HOH C 422 -13.026 57.082 82.050 1.00 0.00 H HETATM 3842 H2 HOH C 422 -12.621 58.428 81.498 1.00 0.00 H HETATM 3843 O HOH C 423 -21.456 29.384 105.432 1.00 29.55 O HETATM 3844 H1 HOH C 423 -20.766 29.972 105.090 1.00 0.00 H HETATM 3845 H2 HOH C 423 -22.132 30.039 105.593 1.00 0.00 H HETATM 3846 O HOH C 424 -17.015 57.393 92.947 1.00 46.01 O HETATM 3847 H1 HOH C 424 -17.227 57.350 92.008 1.00 0.00 H HETATM 3848 H2 HOH C 424 -16.489 58.198 93.012 1.00 0.00 H HETATM 3849 O HOH C 425 -31.582 50.423 105.981 1.00 49.01 O HETATM 3850 H1 HOH C 425 -30.632 50.476 106.120 1.00 0.00 H HETATM 3851 H2 HOH C 425 -31.657 50.296 105.037 1.00 0.00 H HETATM 3852 O HOH C 426 -9.219 56.813 83.459 1.00 40.72 O HETATM 3853 H1 HOH C 426 -8.912 56.947 82.562 1.00 0.00 H HETATM 3854 H2 HOH C 426 -9.906 56.152 83.369 1.00 0.00 H HETATM 3855 O HOH C 427 -14.678 27.204 96.987 1.00 45.16 O HETATM 3856 H1 HOH C 427 -13.972 26.588 97.177 1.00 0.00 H HETATM 3857 H2 HOH C 427 -14.236 28.046 96.881 1.00 0.00 H HETATM 3858 O HOH C 428 -21.946 45.312 105.295 1.00 43.74 O HETATM 3859 H1 HOH C 428 -22.168 44.517 104.813 1.00 0.00 H HETATM 3860 H2 HOH C 428 -22.541 45.964 104.942 1.00 0.00 H HETATM 3861 O HOH C 429 -31.342 29.413 103.875 1.00 28.84 O HETATM 3862 H1 HOH C 429 -30.714 28.700 103.929 1.00 0.00 H HETATM 3863 H2 HOH C 429 -30.799 30.203 103.839 1.00 0.00 H HETATM 3864 O HOH C 430 -23.838 31.422 100.275 1.00 41.38 O HETATM 3865 H1 HOH C 430 -24.118 30.596 99.858 1.00 0.00 H HETATM 3866 H2 HOH C 430 -24.600 31.654 100.804 1.00 0.00 H HETATM 3867 O HOH D 434 -15.981 45.177 86.096 1.00 32.99 O HETATM 3868 H1 HOH D 434 -16.778 44.817 85.691 1.00 0.00 H HETATM 3869 H2 HOH D 434 -15.850 45.952 85.515 1.00 0.00 H HETATM 3870 O HOH D 435 -22.169 30.497 110.200 1.00 38.23 O HETATM 3871 H1 HOH D 435 -21.849 29.614 110.468 1.00 0.00 H HETATM 3872 H2 HOH D 435 -21.883 30.525 109.290 1.00 0.00 H HETATM 3873 O HOH D 436 -19.160 35.728 109.334 1.00 45.60 O HETATM 3874 H1 HOH D 436 -19.429 36.393 109.966 1.00 0.00 H HETATM 3875 H2 HOH D 436 -18.472 36.159 108.823 1.00 0.00 H HETATM 3876 O HOH D 437 -23.632 45.054 82.975 1.00 26.40 O HETATM 3877 H1 HOH D 437 -24.484 44.652 82.933 1.00 0.00 H HETATM 3878 H2 HOH D 437 -23.324 44.667 83.755 1.00 0.00 H HETATM 3879 O HOH D 438 -24.391 56.886 83.583 1.00 45.37 O HETATM 3880 H1 HOH D 438 -24.526 57.380 82.778 1.00 0.00 H HETATM 3881 H2 HOH D 438 -24.163 57.550 84.236 1.00 0.00 H HETATM 3882 O HOH D 439 -17.752 35.558 89.797 1.00 15.20 O HETATM 3883 H1 HOH D 439 -18.628 35.391 89.399 1.00 0.00 H HETATM 3884 H2 HOH D 439 -17.909 36.306 90.361 1.00 0.00 H HETATM 3885 O HOH D 440 -25.624 53.636 92.756 1.00 29.95 O HETATM 3886 H1 HOH D 440 -25.785 54.414 92.231 1.00 0.00 H HETATM 3887 H2 HOH D 440 -26.480 53.469 93.175 1.00 0.00 H HETATM 3888 O HOH D 441 -23.093 42.151 86.599 1.00 21.20 O HETATM 3889 H1 HOH D 441 -23.111 43.032 86.994 1.00 0.00 H HETATM 3890 H2 HOH D 441 -24.022 41.880 86.587 1.00 0.00 H HETATM 3891 O HOH D 442 -20.441 33.672 102.338 1.00 13.75 O HETATM 3892 H1 HOH D 442 -21.397 33.721 102.360 1.00 0.00 H HETATM 3893 H2 HOH D 442 -20.217 33.805 101.419 1.00 0.00 H HETATM 3894 O HOH D 443 -24.452 42.019 108.749 1.00 41.62 O HETATM 3895 H1 HOH D 443 -24.572 42.682 109.428 1.00 0.00 H HETATM 3896 H2 HOH D 443 -24.433 41.185 109.224 1.00 0.00 H HETATM 3897 O HOH D 444 -18.733 43.099 103.112 1.00 34.84 O HETATM 3898 H1 HOH D 444 -19.067 43.761 103.723 1.00 0.00 H HETATM 3899 H2 HOH D 444 -19.518 42.553 102.997 1.00 0.00 H HETATM 3900 O HOH D 445 -20.593 32.517 98.260 1.00 36.70 O HETATM 3901 H1 HOH D 445 -19.804 33.045 98.159 1.00 0.00 H HETATM 3902 H2 HOH D 445 -20.243 31.693 98.630 1.00 0.00 H HETATM 3903 O HOH D 446 -18.864 29.939 102.660 1.00 55.08 O HETATM 3904 H1 HOH D 446 -18.356 30.625 103.097 1.00 0.00 H HETATM 3905 H2 HOH D 446 -18.273 29.572 102.008 1.00 0.00 H HETATM 3906 O HOH D 447 -22.999 33.709 98.828 1.00 53.55 O HETATM 3907 H1 HOH D 447 -22.086 33.380 98.830 1.00 0.00 H HETATM 3908 H2 HOH D 447 -23.388 33.126 99.505 1.00 0.00 H HETATM 3909 O HOH D 448 -19.561 29.899 99.322 1.00 40.27 O HETATM 3910 H1 HOH D 448 -18.808 30.276 98.866 1.00 0.00 H HETATM 3911 H2 HOH D 448 -19.469 28.986 99.025 1.00 0.00 H HETATM 3912 O HOH D 449 -16.153 44.189 102.463 1.00 38.10 O HETATM 3913 H1 HOH D 449 -16.841 43.498 102.495 1.00 0.00 H HETATM 3914 H2 HOH D 449 -15.337 43.746 102.704 1.00 0.00 H HETATM 3915 O HOH D 450 -20.657 42.595 105.581 1.00 47.41 O HETATM 3916 H1 HOH D 450 -20.797 42.503 106.527 1.00 0.00 H HETATM 3917 H2 HOH D 450 -20.664 41.667 105.301 1.00 0.00 H HETATM 3918 O HOH D 451 -24.910 54.161 83.202 1.00 45.98 O HETATM 3919 H1 HOH D 451 -24.582 54.444 84.067 1.00 0.00 H HETATM 3920 H2 HOH D 451 -24.270 54.580 82.625 1.00 0.00 H HETATM 3921 O HOH D 452 -20.903 32.068 105.182 1.00 38.29 O HETATM 3922 H1 HOH D 452 -21.388 32.761 105.637 1.00 0.00 H HETATM 3923 H2 HOH D 452 -20.059 32.479 104.980 1.00 0.00 H HETATM 3924 O HOH D 453 -22.903 40.942 105.717 1.00 40.52 O HETATM 3925 H1 HOH D 453 -22.698 41.756 105.253 1.00 0.00 H HETATM 3926 H2 HOH D 453 -23.443 41.232 106.462 1.00 0.00 H HETATM 3927 O HOH D 454 -25.320 46.744 88.453 1.00 37.00 O HETATM 3928 H1 HOH D 454 -25.406 45.855 88.031 1.00 0.00 H HETATM 3929 H2 HOH D 454 -26.269 46.867 88.675 1.00 0.00 H HETATM 3930 O HOH D 455 -17.350 61.514 92.517 1.00 53.32 O HETATM 3931 H1 HOH D 455 -17.449 61.044 91.684 1.00 0.00 H HETATM 3932 H2 HOH D 455 -17.829 62.327 92.350 1.00 0.00 H HETATM 3933 O HOH D 456 -14.900 45.779 109.733 1.00 42.38 O HETATM 3934 H1 HOH D 456 -15.719 46.244 109.574 1.00 0.00 H HETATM 3935 H2 HOH D 456 -15.147 44.859 109.784 1.00 0.00 H HETATM 3936 O HOH D 457 -33.875 29.899 112.000 1.00 33.55 O HETATM 3937 H1 HOH D 457 -33.195 30.037 111.342 1.00 0.00 H HETATM 3938 H2 HOH D 457 -34.096 30.751 112.370 1.00 0.00 H HETATM 3939 O HOH A 329 -28.251 43.360 91.322 1.00 23.81 O HETATM 3940 H1 HOH A 329 -27.524 43.977 91.159 1.00 0.00 H HETATM 3941 H2 HOH A 329 -29.054 43.900 91.357 1.00 0.00 H HETATM 3942 O HOH A 330 -27.596 41.682 93.079 1.00 16.29 O HETATM 3943 H1 HOH A 330 -28.188 42.271 93.557 1.00 0.00 H HETATM 3944 H2 HOH A 330 -27.525 42.187 92.228 1.00 0.00 H HETATM 3945 O HOH A 332 -18.854 28.903 90.558 1.00 21.71 O HETATM 3946 H1 HOH A 332 -19.147 28.863 91.486 1.00 0.00 H HETATM 3947 H2 HOH A 332 -18.187 28.218 90.540 1.00 0.00 H HETATM 3948 O HOH A 333 -20.684 29.164 87.161 1.00 9.67 O HETATM 3949 H1 HOH A 333 -20.977 28.486 86.552 1.00 0.00 H HETATM 3950 H2 HOH A 333 -19.744 29.178 87.190 1.00 0.00 H HETATM 3951 O HOH A 335 -12.588 43.250 92.089 1.00 29.42 O HETATM 3952 H1 HOH A 335 -12.991 43.999 91.628 1.00 0.00 H HETATM 3953 H2 HOH A 335 -12.991 42.481 91.696 1.00 0.00 H HETATM 3954 O HOH A 336 -14.462 49.757 83.926 1.00 26.09 O HETATM 3955 H1 HOH A 336 -13.704 49.651 84.523 1.00 0.00 H HETATM 3956 H2 HOH A 336 -14.953 48.945 84.030 1.00 0.00 H HETATM 3957 O HOH A 337 -25.300 44.641 90.781 1.00 31.30 O HETATM 3958 H1 HOH A 337 -24.788 45.457 90.678 1.00 0.00 H HETATM 3959 H2 HOH A 337 -24.812 44.002 91.344 1.00 0.00 H HETATM 3960 O HOH A 338 -23.463 26.795 90.749 1.00 16.75 O HETATM 3961 H1 HOH A 338 -23.560 27.031 91.693 1.00 0.00 H HETATM 3962 H2 HOH A 338 -22.666 26.294 90.703 1.00 0.00 H HETATM 3963 O HOH A 340 -18.095 31.460 90.394 1.00 15.63 O HETATM 3964 H1 HOH A 340 -17.885 30.587 90.766 1.00 0.00 H HETATM 3965 H2 HOH A 340 -18.291 31.996 91.166 1.00 0.00 H HETATM 3966 O HOH A 341 -26.625 30.263 96.983 1.00 20.51 O HETATM 3967 H1 HOH A 341 -26.048 30.999 96.707 1.00 0.00 H HETATM 3968 H2 HOH A 341 -26.060 29.512 97.148 1.00 0.00 H HETATM 3969 O HOH A 342 -31.429 41.848 85.033 1.00 22.11 O HETATM 3970 H1 HOH A 342 -30.795 41.609 84.346 1.00 0.00 H HETATM 3971 H2 HOH A 342 -31.022 41.566 85.858 1.00 0.00 H HETATM 3972 O HOH A 344 -28.959 27.041 85.827 1.00 14.44 O HETATM 3973 H1 HOH A 344 -28.965 26.495 85.036 1.00 0.00 H HETATM 3974 H2 HOH A 344 -29.386 27.857 85.568 1.00 0.00 H HETATM 3975 O HOH A 345 -17.856 30.683 96.455 1.00 35.71 O HETATM 3976 H1 HOH A 345 -17.607 30.845 95.544 1.00 0.00 H HETATM 3977 H2 HOH A 345 -17.032 30.908 96.909 1.00 0.00 H HETATM 3978 O HOH A 348 -21.451 28.844 89.884 1.00 11.27 O HETATM 3979 H1 HOH A 348 -21.508 28.071 90.424 1.00 0.00 H HETATM 3980 H2 HOH A 348 -20.630 29.291 90.143 1.00 0.00 H HETATM 3981 O HOH A 349 -22.138 30.052 85.257 1.00 13.34 O HETATM 3982 H1 HOH A 349 -22.751 30.564 84.725 1.00 0.00 H HETATM 3983 H2 HOH A 349 -22.335 30.243 86.170 1.00 0.00 H HETATM 3984 O HOH A 351 -34.143 49.216 82.085 1.00 30.30 O HETATM 3985 H1 HOH A 351 -34.855 48.570 82.194 1.00 0.00 H HETATM 3986 H2 HOH A 351 -33.391 48.647 81.897 1.00 0.00 H HETATM 3987 O HOH A 352 -21.297 38.056 77.414 1.00 31.71 O HETATM 3988 H1 HOH A 352 -21.721 37.949 78.255 1.00 0.00 H HETATM 3989 H2 HOH A 352 -21.830 37.708 76.718 1.00 0.00 H HETATM 3990 O HOH A 353 -29.197 38.137 68.693 1.00 24.84 O HETATM 3991 H1 HOH A 353 -29.618 37.355 69.066 1.00 0.00 H HETATM 3992 H2 HOH A 353 -29.655 38.290 67.872 1.00 0.00 H HETATM 3993 O HOH A 354 -13.501 37.750 60.478 1.00 34.38 O HETATM 3994 H1 HOH A 354 -13.201 36.927 60.833 1.00 0.00 H HETATM 3995 H2 HOH A 354 -12.709 38.108 60.045 1.00 0.00 H HETATM 3996 O HOH A 355 -0.757 41.548 68.161 1.00 33.00 O HETATM 3997 H1 HOH A 355 -0.825 40.968 68.931 1.00 0.00 H HETATM 3998 H2 HOH A 355 0.074 41.271 67.774 1.00 0.00 H HETATM 3999 O HOH A 356 -5.663 45.689 82.458 1.00 39.46 O HETATM 4000 H1 HOH A 356 -5.407 46.398 81.853 1.00 0.00 H HETATM 4001 H2 HOH A 356 -6.573 45.519 82.161 1.00 0.00 H HETATM 4002 O HOH A 357 -8.443 44.748 66.803 1.00 43.99 O HETATM 4003 H1 HOH A 357 -7.825 44.572 67.515 1.00 0.00 H HETATM 4004 H2 HOH A 357 -9.096 45.315 67.237 1.00 0.00 H HETATM 4005 O HOH A 358 -3.266 22.798 63.808 1.00 14.88 O HETATM 4006 H1 HOH A 358 -3.281 23.002 64.751 1.00 0.00 H HETATM 4007 H2 HOH A 358 -4.173 22.516 63.621 1.00 0.00 H HETATM 4008 O HOH A 360 -34.182 32.413 74.005 1.00 22.21 O HETATM 4009 H1 HOH A 360 -34.773 32.646 73.290 1.00 0.00 H HETATM 4010 H2 HOH A 360 -34.397 31.489 74.180 1.00 0.00 H HETATM 4011 O HOH A 361 -30.162 21.326 76.327 1.00 15.84 O HETATM 4012 H1 HOH A 361 -30.665 21.739 77.031 1.00 0.00 H HETATM 4013 H2 HOH A 361 -30.703 21.456 75.552 1.00 0.00 H HETATM 4014 O HOH A 362 -34.137 25.962 95.610 1.00 24.08 O HETATM 4015 H1 HOH A 362 -33.222 26.180 95.616 1.00 0.00 H HETATM 4016 H2 HOH A 362 -34.752 26.596 96.054 1.00 0.00 H HETATM 4017 O HOH A 363 -16.959 14.843 74.914 1.00 33.80 O HETATM 4018 H1 HOH A 363 -17.302 14.267 75.592 1.00 0.00 H HETATM 4019 H2 HOH A 363 -16.261 14.337 74.498 1.00 0.00 H HETATM 4020 O HOH A 364 -43.855 44.601 81.361 1.00 22.55 O HETATM 4021 H1 HOH A 364 -43.230 45.155 81.820 1.00 0.00 H HETATM 4022 H2 HOH A 364 -43.621 44.692 80.410 1.00 0.00 H HETATM 4023 O HOH A 366 -28.751 45.959 90.904 1.00 16.80 O HETATM 4024 H1 HOH A 366 -28.793 46.639 90.211 1.00 0.00 H HETATM 4025 H2 HOH A 366 -28.573 45.183 90.341 1.00 0.00 H HETATM 4026 O HOH A 368 -16.179 32.542 96.092 1.00 31.75 O HETATM 4027 H1 HOH A 368 -15.548 32.974 95.510 1.00 0.00 H HETATM 4028 H2 HOH A 368 -16.992 32.534 95.559 1.00 0.00 H HETATM 4029 O HOH A 369 -49.264 50.542 91.001 1.00 41.28 O HETATM 4030 H1 HOH A 369 -49.526 50.006 90.255 1.00 0.00 H HETATM 4031 H2 HOH A 369 -48.484 50.077 91.324 1.00 0.00 H HETATM 4032 O HOH A 370 -11.203 36.426 89.942 1.00 17.58 O HETATM 4033 H1 HOH A 370 -11.309 36.663 90.867 1.00 0.00 H HETATM 4034 H2 HOH A 370 -11.728 36.955 89.361 1.00 0.00 H HETATM 4035 O HOH A 371 -16.268 30.076 79.934 1.00 12.58 O HETATM 4036 H1 HOH A 371 -16.920 30.230 80.621 1.00 0.00 H HETATM 4037 H2 HOH A 371 -16.520 30.620 79.193 1.00 0.00 H HETATM 4038 O HOH A 372 -15.539 28.133 78.039 1.00 19.97 O HETATM 4039 H1 HOH A 372 -15.152 28.999 78.149 1.00 0.00 H HETATM 4040 H2 HOH A 372 -15.420 27.787 78.944 1.00 0.00 H HETATM 4041 O HOH A 373 -20.086 18.179 70.834 1.00 36.56 O HETATM 4042 H1 HOH A 373 -19.514 18.049 71.597 1.00 0.00 H HETATM 4043 H2 HOH A 373 -20.716 18.855 71.071 1.00 0.00 H HETATM 4044 O HOH A 374 -18.774 33.564 81.488 1.00 24.99 O HETATM 4045 H1 HOH A 374 -19.528 32.965 81.609 1.00 0.00 H HETATM 4046 H2 HOH A 374 -19.018 34.203 82.180 1.00 0.00 H HETATM 4047 O HOH A 376 -15.797 32.263 89.078 1.00 22.46 O HETATM 4048 H1 HOH A 376 -16.445 32.127 88.387 1.00 0.00 H HETATM 4049 H2 HOH A 376 -16.160 33.034 89.517 1.00 0.00 H HETATM 4050 O HOH A 377 -13.944 31.347 91.618 1.00 35.87 O HETATM 4051 H1 HOH A 377 -13.713 30.995 90.766 1.00 0.00 H HETATM 4052 H2 HOH A 377 -14.871 31.534 91.447 1.00 0.00 H HETATM 4053 O HOH A 378 -12.419 15.976 88.206 1.00 21.79 O HETATM 4054 H1 HOH A 378 -12.550 15.323 88.899 1.00 0.00 H HETATM 4055 H2 HOH A 378 -13.221 16.518 88.269 1.00 0.00 H HETATM 4056 O HOH A 379 -7.259 48.334 89.341 1.00 24.68 O HETATM 4057 H1 HOH A 379 -6.911 48.801 88.569 1.00 0.00 H HETATM 4058 H2 HOH A 379 -6.473 48.057 89.833 1.00 0.00 H HETATM 4059 O HOH A 380 -19.077 49.071 84.736 1.00 26.96 O HETATM 4060 H1 HOH A 380 -19.501 48.571 84.007 1.00 0.00 H HETATM 4061 H2 HOH A 380 -19.316 48.552 85.514 1.00 0.00 H HETATM 4062 O HOH A 381 -27.346 21.384 73.006 1.00 20.78 O HETATM 4063 H1 HOH A 381 -28.116 21.203 73.558 1.00 0.00 H HETATM 4064 H2 HOH A 381 -26.646 20.901 73.471 1.00 0.00 H HETATM 4065 O HOH A 382 -6.898 35.584 85.423 1.00 17.01 O HETATM 4066 H1 HOH A 382 -7.458 35.196 84.754 1.00 0.00 H HETATM 4067 H2 HOH A 382 -6.367 34.923 85.814 1.00 0.00 H HETATM 4068 O HOH A 383 -38.564 28.487 88.972 1.00 33.14 O HETATM 4069 H1 HOH A 383 -37.899 27.918 89.425 1.00 0.00 H HETATM 4070 H2 HOH A 383 -39.276 27.826 88.859 1.00 0.00 H HETATM 4071 O HOH A 384 -0.813 14.325 87.220 1.00 57.65 O HETATM 4072 H1 HOH A 384 -1.560 14.380 87.833 1.00 0.00 H HETATM 4073 H2 HOH A 384 -1.089 14.894 86.511 1.00 0.00 H HETATM 4074 O HOH A 385 -12.372 45.023 64.443 1.00 32.25 O HETATM 4075 H1 HOH A 385 -11.846 44.453 63.877 1.00 0.00 H HETATM 4076 H2 HOH A 385 -11.800 45.785 64.580 1.00 0.00 H HETATM 4077 O HOH A 386 -33.539 36.559 72.759 1.00 30.13 O HETATM 4078 H1 HOH A 386 -34.468 36.516 72.545 1.00 0.00 H HETATM 4079 H2 HOH A 386 -33.081 36.528 71.921 1.00 0.00 H HETATM 4080 O HOH A 387 -41.357 48.202 83.626 1.00 40.66 O HETATM 4081 H1 HOH A 387 -41.215 49.119 83.569 1.00 0.00 H HETATM 4082 H2 HOH A 387 -40.732 47.938 84.291 1.00 0.00 H HETATM 4083 O HOH A 388 -44.897 45.337 94.413 1.00 24.99 O HETATM 4084 H1 HOH A 388 -45.686 45.852 94.238 1.00 0.00 H HETATM 4085 H2 HOH A 388 -44.658 44.938 93.612 1.00 0.00 H HETATM 4086 O HOH A 389 -28.939 45.262 69.277 1.00 29.42 O HETATM 4087 H1 HOH A 389 -29.550 44.599 68.965 1.00 0.00 H HETATM 4088 H2 HOH A 389 -28.651 45.689 68.465 1.00 0.00 H HETATM 4089 O HOH A 390 -31.898 44.546 99.854 1.00 31.51 O HETATM 4090 H1 HOH A 390 -31.713 44.620 98.930 1.00 0.00 H HETATM 4091 H2 HOH A 390 -32.535 43.848 100.003 1.00 0.00 H HETATM 4092 O HOH A 392 -28.774 49.926 71.144 1.00 40.85 O HETATM 4093 H1 HOH A 392 -27.950 49.437 71.063 1.00 0.00 H HETATM 4094 H2 HOH A 392 -29.366 49.265 71.507 1.00 0.00 H HETATM 4095 O HOH A 393 -7.918 49.588 93.959 1.00 40.92 O HETATM 4096 H1 HOH A 393 -8.483 48.808 94.005 1.00 0.00 H HETATM 4097 H2 HOH A 393 -8.308 50.096 93.249 1.00 0.00 H HETATM 4098 O HOH A 394 -12.376 47.914 73.777 1.00 26.75 O HETATM 4099 H1 HOH A 394 -11.951 48.604 74.292 1.00 0.00 H HETATM 4100 H2 HOH A 394 -11.600 47.382 73.541 1.00 0.00 H HETATM 4101 O HOH A 395 -24.959 42.511 92.334 1.00 26.24 O HETATM 4102 H1 HOH A 395 -25.250 42.984 93.120 1.00 0.00 H HETATM 4103 H2 HOH A 395 -25.139 41.595 92.579 1.00 0.00 H HETATM 4104 O HOH A 396 -19.320 27.603 78.907 1.00 26.46 O HETATM 4105 H1 HOH A 396 -19.584 28.130 79.692 1.00 0.00 H HETATM 4106 H2 HOH A 396 -18.965 28.283 78.345 1.00 0.00 H HETATM 4107 O HOH A 397 -21.572 41.369 75.901 1.00 26.41 O HETATM 4108 H1 HOH A 397 -20.875 42.098 75.801 1.00 0.00 H HETATM 4109 H2 HOH A 397 -21.151 40.548 75.647 1.00 0.00 H HETATM 4110 O HOH A 398 -35.979 27.625 87.968 1.00 19.81 O HETATM 4111 H1 HOH A 398 -36.651 28.261 87.788 1.00 0.00 H HETATM 4112 H2 HOH A 398 -35.991 27.421 88.915 1.00 0.00 H HETATM 4113 O HOH A 399 -12.506 26.429 53.899 1.00 40.04 O HETATM 4114 H1 HOH A 399 -12.861 26.133 54.739 1.00 0.00 H HETATM 4115 H2 HOH A 399 -12.175 27.316 54.090 1.00 0.00 H HETATM 4116 O HOH A 400 -10.579 29.678 51.597 1.00 20.70 O HETATM 4117 H1 HOH A 400 -11.217 29.705 52.316 1.00 0.00 H HETATM 4118 H2 HOH A 400 -11.124 29.882 50.822 1.00 0.00 H HETATM 4119 O HOH A 401 -3.935 21.479 61.780 1.00 41.77 O HETATM 4120 H1 HOH A 401 -3.281 21.899 62.378 1.00 0.00 H HETATM 4121 H2 HOH A 401 -3.450 21.389 60.962 1.00 0.00 H HETATM 4122 O HOH A 402 -4.175 29.542 89.389 1.00 25.59 O HETATM 4123 H1 HOH A 402 -4.286 28.601 89.233 1.00 0.00 H HETATM 4124 H2 HOH A 402 -4.423 29.645 90.329 1.00 0.00 H HETATM 4125 O HOH A 403 -36.484 25.572 91.862 1.00 20.26 O HETATM 4126 H1 HOH A 403 -37.321 25.990 91.617 1.00 0.00 H HETATM 4127 H2 HOH A 403 -36.628 25.427 92.833 1.00 0.00 H HETATM 4128 O HOH A 405 -35.822 54.930 101.542 1.00 43.57 O HETATM 4129 H1 HOH A 405 -35.061 54.428 101.210 1.00 0.00 H HETATM 4130 H2 HOH A 405 -35.454 55.700 101.963 1.00 0.00 H HETATM 4131 O HOH A 407 -2.435 42.742 89.479 1.00 51.90 O HETATM 4132 H1 HOH A 407 -2.087 43.170 88.668 1.00 0.00 H HETATM 4133 H2 HOH A 407 -1.745 42.979 90.113 1.00 0.00 H HETATM 4134 O HOH A 408 -17.849 51.214 83.650 1.00 53.26 O HETATM 4135 H1 HOH A 408 -18.348 50.520 83.220 1.00 0.00 H HETATM 4136 H2 HOH A 408 -16.950 50.893 83.658 1.00 0.00 H HETATM 4137 O HOH A 409 -34.481 30.338 78.261 1.00 33.74 O HETATM 4138 H1 HOH A 409 -35.295 30.037 78.654 1.00 0.00 H HETATM 4139 H2 HOH A 409 -33.786 29.969 78.799 1.00 0.00 H HETATM 4140 O HOH A 410 -25.391 43.957 88.292 1.00 17.28 O HETATM 4141 H1 HOH A 410 -26.037 43.253 88.229 1.00 0.00 H HETATM 4142 H2 HOH A 410 -25.288 44.013 89.261 1.00 0.00 H HETATM 4143 O HOH A 412 -22.368 31.210 96.554 1.00 26.75 O HETATM 4144 H1 HOH A 412 -21.829 31.951 96.887 1.00 0.00 H HETATM 4145 H2 HOH A 412 -22.583 31.491 95.657 1.00 0.00 H HETATM 4146 O HOH A 414 -23.751 34.208 96.369 1.00 24.85 O HETATM 4147 H1 HOH A 414 -23.967 33.693 97.170 1.00 0.00 H HETATM 4148 H2 HOH A 414 -23.434 34.993 96.832 1.00 0.00 H HETATM 4149 O HOH A 415 -27.713 47.748 89.387 1.00 25.00 O HETATM 4150 H1 HOH A 415 -28.377 48.457 89.412 1.00 0.00 H HETATM 4151 H2 HOH A 415 -27.399 47.737 90.290 1.00 0.00 H HETATM 4152 O HOH A 416 -22.571 42.977 84.130 1.00 23.07 O HETATM 4153 H1 HOH A 416 -22.157 43.667 84.617 1.00 0.00 H HETATM 4154 H2 HOH A 416 -22.258 42.195 84.606 1.00 0.00 H HETATM 4155 O HOH A 418 -15.065 29.079 92.635 1.00 27.56 O HETATM 4156 H1 HOH A 418 -14.206 28.806 92.981 1.00 0.00 H HETATM 4157 H2 HOH A 418 -15.114 29.916 93.117 1.00 0.00 H HETATM 4158 O HOH A 419 -21.963 27.315 94.436 1.00 37.64 O HETATM 4159 H1 HOH A 419 -21.732 27.478 95.366 1.00 0.00 H HETATM 4160 H2 HOH A 419 -21.141 27.163 93.991 1.00 0.00 H HETATM 4161 O HOH A 420 -17.723 28.476 93.182 1.00 5.27 O HETATM 4162 H1 HOH A 420 -17.786 27.498 93.238 1.00 0.00 H HETATM 4163 H2 HOH A 420 -16.765 28.636 93.213 1.00 0.00 H HETATM 4164 O HOH A 421 -17.243 26.010 93.711 1.00 20.66 O HETATM 4165 H1 HOH A 421 -16.585 26.697 93.900 1.00 0.00 H HETATM 4166 H2 HOH A 421 -16.751 25.309 94.191 1.00 0.00 H HETATM 4167 O HOH A 422 -6.474 26.430 93.582 1.00 51.85 O HETATM 4168 H1 HOH A 422 -5.998 27.256 93.656 1.00 0.00 H HETATM 4169 H2 HOH A 422 -6.564 26.278 92.639 1.00 0.00 H HETATM 4170 O HOH A 423 -14.694 17.179 90.937 1.00 17.14 O HETATM 4171 H1 HOH A 423 -13.918 17.052 91.487 1.00 0.00 H HETATM 4172 H2 HOH A 423 -15.034 18.039 91.203 1.00 0.00 H HETATM 4173 O HOH A 427 -28.807 35.488 87.996 1.00 19.34 O HETATM 4174 H1 HOH A 427 -28.098 35.760 88.591 1.00 0.00 H HETATM 4175 H2 HOH A 427 -28.614 34.570 87.849 1.00 0.00 H HETATM 4176 O HOH A 428 -40.630 26.692 88.276 1.00 32.29 O HETATM 4177 H1 HOH A 428 -40.205 25.889 88.624 1.00 0.00 H HETATM 4178 H2 HOH A 428 -41.065 26.310 87.503 1.00 0.00 H HETATM 4179 O HOH A 429 -37.934 25.644 85.462 1.00 26.67 O HETATM 4180 H1 HOH A 429 -38.500 25.523 84.639 1.00 0.00 H HETATM 4181 H2 HOH A 429 -37.182 26.067 85.044 1.00 0.00 H HETATM 4182 O HOH A 430 -11.408 25.521 83.669 1.00 23.35 O HETATM 4183 H1 HOH A 430 -10.539 25.682 84.046 1.00 0.00 H HETATM 4184 H2 HOH A 430 -11.690 26.387 83.373 1.00 0.00 H HETATM 4185 O HOH A 431 -25.910 24.870 69.880 1.00 18.16 O HETATM 4186 H1 HOH A 431 -25.030 24.849 69.527 1.00 0.00 H HETATM 4187 H2 HOH A 431 -25.765 25.355 70.700 1.00 0.00 H HETATM 4188 O HOH A 432 -5.550 26.342 50.261 1.00 20.95 O HETATM 4189 H1 HOH A 432 -5.127 25.636 49.799 1.00 0.00 H HETATM 4190 H2 HOH A 432 -5.504 27.097 49.647 1.00 0.00 H HETATM 4191 O HOH A 433 -31.272 45.783 91.784 1.00 29.81 O HETATM 4192 H1 HOH A 433 -31.425 45.159 92.474 1.00 0.00 H HETATM 4193 H2 HOH A 433 -32.136 46.199 91.636 1.00 0.00 H HETATM 4194 O HOH A 435 -37.352 19.956 80.898 1.00 40.88 O HETATM 4195 H1 HOH A 435 -37.356 19.481 80.037 1.00 0.00 H HETATM 4196 H2 HOH A 435 -37.327 20.892 80.658 1.00 0.00 H HETATM 4197 O HOH A 436 -27.675 41.637 89.105 1.00 25.45 O HETATM 4198 H1 HOH A 436 -28.115 40.802 89.148 1.00 0.00 H HETATM 4199 H2 HOH A 436 -27.709 41.817 88.158 1.00 0.00 H HETATM 4200 O HOH A 437 -36.621 22.822 80.176 1.00 24.24 O HETATM 4201 H1 HOH A 437 -35.925 23.393 79.849 1.00 0.00 H HETATM 4202 H2 HOH A 437 -37.317 23.446 80.482 1.00 0.00 H HETATM 4203 O HOH A 438 -46.796 51.619 89.267 1.00 22.26 O HETATM 4204 H1 HOH A 438 -46.527 51.680 90.179 1.00 0.00 H HETATM 4205 H2 HOH A 438 -46.664 52.517 88.932 1.00 0.00 H HETATM 4206 O HOH A 439 -7.185 35.618 97.230 1.00 42.51 O HETATM 4207 H1 HOH A 439 -6.434 35.259 97.714 1.00 0.00 H HETATM 4208 H2 HOH A 439 -7.118 36.566 97.425 1.00 0.00 H HETATM 4209 O HOH A 440 -9.767 47.363 75.397 1.00 29.78 O HETATM 4210 H1 HOH A 440 -10.030 48.204 75.805 1.00 0.00 H HETATM 4211 H2 HOH A 440 -9.155 47.001 76.038 1.00 0.00 H HETATM 4212 O HOH A 441 -10.362 44.495 59.711 1.00 35.20 O HETATM 4213 H1 HOH A 441 -10.051 44.472 60.617 1.00 0.00 H HETATM 4214 H2 HOH A 441 -10.138 45.364 59.388 1.00 0.00 H HETATM 4215 O HOH A 442 -38.554 21.830 78.445 1.00 39.36 O HETATM 4216 H1 HOH A 442 -37.839 21.225 78.627 1.00 0.00 H HETATM 4217 H2 HOH A 442 -38.791 22.164 79.334 1.00 0.00 H HETATM 4218 O HOH A 443 -45.612 39.263 80.772 1.00 30.05 O HETATM 4219 H1 HOH A 443 -45.149 38.438 80.622 1.00 0.00 H HETATM 4220 H2 HOH A 443 -46.374 38.992 81.315 1.00 0.00 H HETATM 4221 O HOH A 444 -8.189 28.232 91.509 1.00 19.62 O HETATM 4222 H1 HOH A 444 -7.982 29.152 91.300 1.00 0.00 H HETATM 4223 H2 HOH A 444 -9.091 28.306 91.847 1.00 0.00 H HETATM 4224 O HOH A 445 -1.445 29.110 87.743 1.00 35.06 O HETATM 4225 H1 HOH A 445 -2.146 28.463 87.882 1.00 0.00 H HETATM 4226 H2 HOH A 445 -1.731 29.792 88.351 1.00 0.00 H HETATM 4227 O HOH A 446 0.262 20.989 87.551 1.00 43.91 O HETATM 4228 H1 HOH A 446 1.020 20.624 88.008 1.00 0.00 H HETATM 4229 H2 HOH A 446 0.542 21.079 86.640 1.00 0.00 H HETATM 4230 O HOH A 448 -28.559 35.544 96.862 1.00 28.59 O HETATM 4231 H1 HOH A 448 -28.029 36.350 96.892 1.00 0.00 H HETATM 4232 H2 HOH A 448 -28.780 35.357 97.772 1.00 0.00 H HETATM 4233 O HOH A 449 -11.000 30.191 91.622 1.00 29.65 O HETATM 4234 H1 HOH A 449 -11.599 30.724 91.080 1.00 0.00 H HETATM 4235 H2 HOH A 449 -11.485 29.369 91.717 1.00 0.00 H HETATM 4236 O HOH A 450 -26.632 52.365 98.124 1.00 25.46 O HETATM 4237 H1 HOH A 450 -26.460 51.947 97.275 1.00 0.00 H HETATM 4238 H2 HOH A 450 -25.794 52.307 98.586 1.00 0.00 H HETATM 4239 O HOH A 451 -32.906 56.578 81.738 1.00 35.86 O HETATM 4240 H1 HOH A 451 -32.664 55.869 82.348 1.00 0.00 H HETATM 4241 H2 HOH A 451 -32.255 56.516 81.042 1.00 0.00 H HETATM 4242 O HOH A 452 -31.500 55.165 84.328 1.00 46.53 O HETATM 4243 H1 HOH A 452 -31.244 55.775 85.024 1.00 0.00 H HETATM 4244 H2 HOH A 452 -30.825 54.481 84.345 1.00 0.00 H HETATM 4245 O HOH A 453 -38.760 26.904 83.394 1.00 50.36 O HETATM 4246 H1 HOH A 453 -38.105 27.244 82.790 1.00 0.00 H HETATM 4247 H2 HOH A 453 -39.494 27.528 83.255 1.00 0.00 H HETATM 4248 O HOH A 454 -33.240 25.382 98.127 1.00 25.52 O HETATM 4249 H1 HOH A 454 -34.160 25.109 98.273 1.00 0.00 H HETATM 4250 H2 HOH A 454 -33.380 25.869 97.310 1.00 0.00 H HETATM 4251 O HOH A 455 -34.230 22.115 94.990 1.00 46.26 O HETATM 4252 H1 HOH A 455 -34.321 21.394 95.608 1.00 0.00 H HETATM 4253 H2 HOH A 455 -35.005 22.687 95.154 1.00 0.00 H HETATM 4254 O HOH A 459 -26.103 32.012 59.144 1.00 41.44 O HETATM 4255 H1 HOH A 459 -25.723 32.691 58.574 1.00 0.00 H HETATM 4256 H2 HOH A 459 -26.694 31.530 58.578 1.00 0.00 H HETATM 4257 O HOH A 460 -38.701 23.015 75.855 1.00 36.06 O HETATM 4258 H1 HOH A 460 -39.097 22.779 76.725 1.00 0.00 H HETATM 4259 H2 HOH A 460 -38.020 23.639 76.100 1.00 0.00 H HETATM 4260 O HOH A 461 -45.962 36.565 77.755 1.00 40.36 O HETATM 4261 H1 HOH A 461 -46.658 35.922 77.626 1.00 0.00 H HETATM 4262 H2 HOH A 461 -46.373 37.305 78.210 1.00 0.00 H HETATM 4263 O HOH A 462 -44.281 41.465 79.660 1.00 38.76 O HETATM 4264 H1 HOH A 462 -44.022 41.732 78.765 1.00 0.00 H HETATM 4265 H2 HOH A 462 -45.049 42.045 79.746 1.00 0.00 H HETATM 4266 O HOH A 463 -0.122 18.432 71.704 1.00 34.84 O HETATM 4267 H1 HOH A 463 -0.681 17.978 71.081 1.00 0.00 H HETATM 4268 H2 HOH A 463 -0.412 19.345 71.678 1.00 0.00 H HETATM 4269 O HOH A 464 -24.217 19.000 72.717 1.00 60.73 O HETATM 4270 H1 HOH A 464 -24.030 18.075 72.931 1.00 0.00 H HETATM 4271 H2 HOH A 464 -23.366 19.338 72.458 1.00 0.00 H HETATM 4272 O HOH A 465 -19.524 12.550 82.111 1.00 54.50 O HETATM 4273 H1 HOH A 465 -18.746 11.992 82.131 1.00 0.00 H HETATM 4274 H2 HOH A 465 -20.039 12.201 82.842 1.00 0.00 H HETATM 4275 O HOH A 466 -46.360 55.872 86.062 1.00 37.25 O HETATM 4276 H1 HOH A 466 -45.526 55.964 85.607 1.00 0.00 H HETATM 4277 H2 HOH A 466 -46.975 55.643 85.354 1.00 0.00 H HETATM 4278 O HOH A 467 -38.552 30.261 91.185 1.00 34.93 O HETATM 4279 H1 HOH A 467 -38.572 31.131 91.602 1.00 0.00 H HETATM 4280 H2 HOH A 467 -39.244 30.214 90.543 1.00 0.00 H HETATM 4281 O HOH A 468 -5.679 29.231 92.056 1.00 50.06 O HETATM 4282 H1 HOH A 468 -6.283 29.915 92.363 1.00 0.00 H HETATM 4283 H2 HOH A 468 -6.221 28.431 92.017 1.00 0.00 H HETATM 4284 O HOH A 469 -26.951 52.353 80.370 1.00 47.48 O HETATM 4285 H1 HOH A 469 -27.735 52.799 80.682 1.00 0.00 H HETATM 4286 H2 HOH A 469 -26.698 51.799 81.112 1.00 0.00 H HETATM 4287 O HOH A 470 -19.555 48.554 75.624 1.00 32.07 O HETATM 4288 H1 HOH A 470 -19.882 48.877 74.781 1.00 0.00 H HETATM 4289 H2 HOH A 470 -18.693 48.205 75.378 1.00 0.00 H HETATM 4290 O HOH A 471 5.040 25.202 67.630 1.00 52.77 O HETATM 4291 H1 HOH A 471 4.582 26.004 67.362 1.00 0.00 H HETATM 4292 H2 HOH A 471 4.603 24.509 67.138 1.00 0.00 H HETATM 4293 O HOH A 472 -15.748 34.848 88.112 1.00 39.20 O HETATM 4294 H1 HOH A 472 -15.937 34.850 87.158 1.00 0.00 H HETATM 4295 H2 HOH A 472 -16.634 34.865 88.532 1.00 0.00 H HETATM 4296 O HOH A 474 -24.998 32.157 95.642 1.00 41.62 O HETATM 4297 H1 HOH A 474 -24.656 33.042 95.361 1.00 0.00 H HETATM 4298 H2 HOH A 474 -24.320 31.843 96.242 1.00 0.00 H HETATM 4299 O HOH A 477 -38.824 26.869 90.905 1.00 44.63 O HETATM 4300 H1 HOH A 477 -39.082 27.375 91.696 1.00 0.00 H HETATM 4301 H2 HOH A 477 -39.466 27.116 90.232 1.00 0.00 H HETATM 4302 O HOH A 478 -45.915 49.313 84.153 1.00 45.01 O HETATM 4303 H1 HOH A 478 -46.359 48.903 83.403 1.00 0.00 H HETATM 4304 H2 HOH A 478 -46.185 50.226 84.023 1.00 0.00 H HETATM 4305 O HOH A 479 -41.458 46.264 104.932 1.00 60.12 O HETATM 4306 H1 HOH A 479 -40.665 46.710 104.648 1.00 0.00 H HETATM 4307 H2 HOH A 479 -41.779 45.791 104.162 1.00 0.00 H HETATM 4308 O HOH A 480 -46.753 41.834 88.558 1.00 25.70 O HETATM 4309 H1 HOH A 480 -45.969 42.356 88.723 1.00 0.00 H HETATM 4310 H2 HOH A 480 -46.607 41.027 89.060 1.00 0.00 H HETATM 4311 O HOH A 481 -31.637 34.424 70.774 1.00 43.87 O HETATM 4312 H1 HOH A 481 -31.425 35.332 70.508 1.00 0.00 H HETATM 4313 H2 HOH A 481 -32.299 34.299 70.055 1.00 0.00 H HETATM 4314 O HOH A 482 -33.504 35.431 68.625 1.00 36.01 O HETATM 4315 H1 HOH A 482 -33.599 35.081 67.687 1.00 0.00 H HETATM 4316 H2 HOH A 482 -34.266 35.992 68.741 1.00 0.00 H HETATM 4317 O HOH A 483 -28.162 21.129 63.368 1.00 42.47 O HETATM 4318 H1 HOH A 483 -28.750 20.449 63.048 1.00 0.00 H HETATM 4319 H2 HOH A 483 -27.485 20.665 63.857 1.00 0.00 H HETATM 4320 O HOH A 484 -14.381 16.731 79.912 1.00 25.64 O HETATM 4321 H1 HOH A 484 -15.290 17.031 80.021 1.00 0.00 H HETATM 4322 H2 HOH A 484 -13.921 17.217 80.610 1.00 0.00 H HETATM 4323 O HOH A 486 -45.327 39.691 87.302 1.00 34.59 O HETATM 4324 H1 HOH A 486 -46.165 40.120 87.104 1.00 0.00 H HETATM 4325 H2 HOH A 486 -45.046 39.324 86.451 1.00 0.00 H HETATM 4326 O HOH A 487 -1.732 44.301 87.379 1.00 30.87 O HETATM 4327 H1 HOH A 487 -2.109 44.036 86.535 1.00 0.00 H HETATM 4328 H2 HOH A 487 -1.418 45.192 87.212 1.00 0.00 H HETATM 4329 O HOH A 488 -46.019 45.724 82.676 1.00 39.70 O HETATM 4330 H1 HOH A 488 -46.691 45.062 82.486 1.00 0.00 H HETATM 4331 H2 HOH A 488 -45.322 45.428 82.023 1.00 0.00 H HETATM 4332 O HOH A 489 -45.018 54.093 89.265 1.00 51.99 O HETATM 4333 H1 HOH A 489 -44.651 53.489 89.913 1.00 0.00 H HETATM 4334 H2 HOH A 489 -44.240 54.579 88.972 1.00 0.00 H HETATM 4335 O HOH A 490 -33.802 60.775 88.238 1.00 59.80 O HETATM 4336 H1 HOH A 490 -34.589 61.147 87.821 1.00 0.00 H HETATM 4337 H2 HOH A 490 -33.377 61.533 88.642 1.00 0.00 H HETATM 4338 O HOH A 493 -3.457 33.069 52.807 1.00 48.06 O HETATM 4339 H1 HOH A 493 -4.108 33.413 53.424 1.00 0.00 H HETATM 4340 H2 HOH A 493 -2.629 33.381 53.203 1.00 0.00 H HETATM 4341 O HOH A 494 -46.066 29.952 90.374 1.00 37.59 O HETATM 4342 H1 HOH A 494 -46.873 29.520 90.673 1.00 0.00 H HETATM 4343 H2 HOH A 494 -45.397 29.284 90.538 1.00 0.00 H HETATM 4344 O HOH A 495 -41.498 27.463 85.026 1.00 46.59 O HETATM 4345 H1 HOH A 495 -42.145 28.151 84.858 1.00 0.00 H HETATM 4346 H2 HOH A 495 -41.126 27.654 85.878 1.00 0.00 H HETATM 4347 O HOH A 496 -41.413 28.510 80.653 1.00 38.38 O HETATM 4348 H1 HOH A 496 -42.352 28.436 80.805 1.00 0.00 H HETATM 4349 H2 HOH A 496 -41.327 29.281 80.089 1.00 0.00 H HETATM 4350 O HOH A 497 -27.193 23.269 67.613 1.00 39.72 O HETATM 4351 H1 HOH A 497 -26.447 23.724 67.226 1.00 0.00 H HETATM 4352 H2 HOH A 497 -26.861 22.830 68.395 1.00 0.00 H HETATM 4353 O HOH A 498 -16.721 30.114 54.938 1.00 46.26 O HETATM 4354 H1 HOH A 498 -15.896 29.618 54.921 1.00 0.00 H HETATM 4355 H2 HOH A 498 -16.857 30.223 55.878 1.00 0.00 H HETATM 4356 O HOH A 499 -15.993 32.657 55.882 1.00 52.87 O HETATM 4357 H1 HOH A 499 -15.700 32.078 56.580 1.00 0.00 H HETATM 4358 H2 HOH A 499 -16.609 32.111 55.377 1.00 0.00 H HETATM 4359 O HOH A 500 -6.254 35.140 56.674 1.00 53.59 O HETATM 4360 H1 HOH A 500 -6.912 34.522 56.317 1.00 0.00 H HETATM 4361 H2 HOH A 500 -5.507 34.551 56.840 1.00 0.00 H HETATM 4362 O HOH A 501 -46.356 58.188 88.031 1.00 44.36 O HETATM 4363 H1 HOH A 501 -46.919 57.885 87.315 1.00 0.00 H HETATM 4364 H2 HOH A 501 -45.692 57.502 88.044 1.00 0.00 H HETATM 4365 O HOH A 502 -47.313 50.785 81.545 1.00 32.38 O HETATM 4366 H1 HOH A 502 -47.738 49.932 81.476 1.00 0.00 H HETATM 4367 H2 HOH A 502 -47.521 51.155 80.677 1.00 0.00 H HETATM 4368 O HOH A 503 -32.339 27.974 96.311 1.00 24.18 O HETATM 4369 H1 HOH A 503 -31.756 27.237 96.103 1.00 0.00 H HETATM 4370 H2 HOH A 503 -33.087 27.975 95.691 1.00 0.00 H HETATM 4371 O HOH A 504 -7.743 35.938 99.839 1.00 48.17 O HETATM 4372 H1 HOH A 504 -7.982 35.533 98.992 1.00 0.00 H HETATM 4373 H2 HOH A 504 -7.416 35.207 100.363 1.00 0.00 H HETATM 4374 O HOH A 505 -33.040 47.304 103.476 1.00 36.72 O HETATM 4375 H1 HOH A 505 -33.485 48.148 103.567 1.00 0.00 H HETATM 4376 H2 HOH A 505 -33.232 46.864 104.318 1.00 0.00 H HETATM 4377 O HOH A 507 -14.521 47.621 96.769 1.00 47.57 O HETATM 4378 H1 HOH A 507 -13.680 47.702 97.208 1.00 0.00 H HETATM 4379 H2 HOH A 507 -15.039 48.368 97.076 1.00 0.00 H HETATM 4380 O HOH A 508 -12.741 41.299 94.956 1.00 35.81 O HETATM 4381 H1 HOH A 508 -11.864 41.518 95.247 1.00 0.00 H HETATM 4382 H2 HOH A 508 -12.598 41.098 94.017 1.00 0.00 H HETATM 4383 O HOH A 510 -26.332 55.771 77.693 1.00 38.01 O HETATM 4384 H1 HOH A 510 -25.522 56.197 77.955 1.00 0.00 H HETATM 4385 H2 HOH A 510 -26.652 55.359 78.497 1.00 0.00 H HETATM 4386 O HOH A 512 -6.701 51.727 87.349 1.00 40.30 O HETATM 4387 H1 HOH A 512 -7.322 51.175 86.869 1.00 0.00 H HETATM 4388 H2 HOH A 512 -7.171 52.010 88.134 1.00 0.00 H HETATM 4389 O HOH A 513 -17.431 44.929 97.088 1.00 46.33 O HETATM 4390 H1 HOH A 513 -17.963 44.486 96.402 1.00 0.00 H HETATM 4391 H2 HOH A 513 -16.771 45.371 96.545 1.00 0.00 H HETATM 4392 O HOH A 516 -29.829 51.477 66.783 1.00 30.80 O HETATM 4393 H1 HOH A 516 -29.408 52.241 67.186 1.00 0.00 H HETATM 4394 H2 HOH A 516 -29.262 50.749 67.038 1.00 0.00 H HETATM 4395 O HOH A 518 -20.559 47.476 71.276 1.00 29.82 O HETATM 4396 H1 HOH A 518 -21.084 47.064 70.577 1.00 0.00 H HETATM 4397 H2 HOH A 518 -21.065 48.228 71.565 1.00 0.00 H HETATM 4398 O HOH A 519 -0.067 27.131 86.507 1.00 30.61 O HETATM 4399 H1 HOH A 519 0.692 27.701 86.423 1.00 0.00 H HETATM 4400 H2 HOH A 519 -0.734 27.692 86.102 1.00 0.00 H HETATM 4401 O HOH A 520 -1.862 25.954 88.459 1.00 50.94 O HETATM 4402 H1 HOH A 520 -0.908 25.960 88.519 1.00 0.00 H HETATM 4403 H2 HOH A 520 -2.047 25.107 88.051 1.00 0.00 H HETATM 4404 O HOH A 521 -0.053 24.205 91.036 1.00 46.69 O HETATM 4405 H1 HOH A 521 -0.108 23.290 90.803 1.00 0.00 H HETATM 4406 H2 HOH A 521 -0.372 24.653 90.246 1.00 0.00 H HETATM 4407 O HOH A 522 -8.717 16.489 88.503 1.00 37.58 O HETATM 4408 H1 HOH A 522 -8.698 16.843 89.397 1.00 0.00 H HETATM 4409 H2 HOH A 522 -7.880 16.784 88.144 1.00 0.00 H HETATM 4410 O HOH A 523 -4.514 15.310 86.706 1.00 49.61 O HETATM 4411 H1 HOH A 523 -4.716 15.324 85.764 1.00 0.00 H HETATM 4412 H2 HOH A 523 -4.862 16.142 87.045 1.00 0.00 H HETATM 4413 O HOH A 524 -17.155 12.089 79.572 1.00 51.53 O HETATM 4414 H1 HOH A 524 -16.951 11.639 80.388 1.00 0.00 H HETATM 4415 H2 HOH A 524 -17.243 13.008 79.838 1.00 0.00 H HETATM 4416 O HOH A 525 -24.718 22.480 65.403 1.00 37.27 O HETATM 4417 H1 HOH A 525 -24.016 22.749 65.959 1.00 0.00 H HETATM 4418 H2 HOH A 525 -24.823 21.567 65.660 1.00 0.00 H HETATM 4419 O HOH A 526 -9.213 22.563 59.425 1.00 35.34 O HETATM 4420 H1 HOH A 526 -9.906 22.093 59.886 1.00 0.00 H HETATM 4421 H2 HOH A 526 -8.637 22.878 60.125 1.00 0.00 H HETATM 4422 O HOH A 527 -2.551 34.742 63.237 1.00 31.31 O HETATM 4423 H1 HOH A 527 -2.103 34.034 62.770 1.00 0.00 H HETATM 4424 H2 HOH A 527 -2.516 35.528 62.698 1.00 0.00 H HETATM 4425 O HOH A 528 -4.975 43.554 63.218 1.00 41.10 O HETATM 4426 H1 HOH A 528 -4.585 44.232 63.776 1.00 0.00 H HETATM 4427 H2 HOH A 528 -5.917 43.717 63.295 1.00 0.00 H HETATM 4428 O HOH A 529 -20.780 51.135 85.070 1.00 50.82 O HETATM 4429 H1 HOH A 529 -20.779 50.419 84.458 1.00 0.00 H HETATM 4430 H2 HOH A 529 -19.838 51.396 85.078 1.00 0.00 H HETATM 4431 O HOH A 530 -9.506 34.712 87.054 1.00 44.23 O HETATM 4432 H1 HOH A 530 -9.940 35.098 87.832 1.00 0.00 H HETATM 4433 H2 HOH A 530 -8.661 34.490 87.425 1.00 0.00 H HETATM 4434 O HOH A 531 -10.097 41.005 94.653 1.00 30.68 O HETATM 4435 H1 HOH A 531 -10.037 40.870 95.606 1.00 0.00 H HETATM 4436 H2 HOH A 531 -10.080 41.941 94.495 1.00 0.00 H HETATM 4437 O HOH A 533 -13.077 29.429 95.012 1.00 39.93 O HETATM 4438 H1 HOH A 533 -12.331 29.066 95.491 1.00 0.00 H HETATM 4439 H2 HOH A 533 -12.734 30.290 94.735 1.00 0.00 H HETATM 4440 O HOH A 534 -13.121 33.364 98.264 1.00 52.35 O HETATM 4441 H1 HOH A 534 -13.629 33.047 99.008 1.00 0.00 H HETATM 4442 H2 HOH A 534 -13.647 34.080 97.900 1.00 0.00 H HETATM 4443 O HOH A 535 -25.610 23.057 71.795 1.00 33.69 O HETATM 4444 H1 HOH A 535 -25.496 22.117 71.937 1.00 0.00 H HETATM 4445 H2 HOH A 535 -26.554 23.130 71.975 1.00 0.00 H HETATM 4446 O HOH A 536 -28.167 26.928 65.971 1.00 50.65 O HETATM 4447 H1 HOH A 536 -28.612 27.639 66.419 1.00 0.00 H HETATM 4448 H2 HOH A 536 -27.290 27.254 65.743 1.00 0.00 H HETATM 4449 O HOH A 537 -38.753 26.667 78.738 1.00 31.52 O HETATM 4450 H1 HOH A 537 -39.495 26.357 79.327 1.00 0.00 H HETATM 4451 H2 HOH A 537 -38.159 25.925 78.909 1.00 0.00 H HETATM 4452 O HOH A 538 -31.246 49.192 102.285 1.00 35.41 O HETATM 4453 H1 HOH A 538 -30.471 48.684 102.534 1.00 0.00 H HETATM 4454 H2 HOH A 538 -31.924 48.655 102.722 1.00 0.00 H HETATM 4455 O HOH A 542 -29.814 54.661 94.701 1.00 37.06 O HETATM 4456 H1 HOH A 542 -30.126 55.527 94.454 1.00 0.00 H HETATM 4457 H2 HOH A 542 -29.913 54.633 95.660 1.00 0.00 H HETATM 4458 O HOH A 543 -36.119 56.653 78.206 1.00 45.77 O HETATM 4459 H1 HOH A 543 -35.540 57.245 78.671 1.00 0.00 H HETATM 4460 H2 HOH A 543 -37.001 57.050 78.240 1.00 0.00 H HETATM 4461 O HOH A 544 -39.572 38.558 71.034 1.00 44.29 O HETATM 4462 H1 HOH A 544 -39.527 37.681 70.658 1.00 0.00 H HETATM 4463 H2 HOH A 544 -40.417 38.558 71.504 1.00 0.00 H HETATM 4464 O HOH A 545 -44.296 38.845 84.351 1.00 44.51 O HETATM 4465 H1 HOH A 545 -44.149 38.451 83.476 1.00 0.00 H HETATM 4466 H2 HOH A 545 -43.662 39.556 84.387 1.00 0.00 H HETATM 4467 O HOH A 546 -35.486 23.073 87.122 1.00 38.35 O HETATM 4468 H1 HOH A 546 -34.702 22.636 86.784 1.00 0.00 H HETATM 4469 H2 HOH A 546 -36.128 22.366 87.206 1.00 0.00 H HETATM 4470 O HOH A 547 -35.180 23.834 83.580 1.00 47.27 O HETATM 4471 H1 HOH A 547 -34.664 23.566 84.355 1.00 0.00 H HETATM 4472 H2 HOH A 547 -36.069 23.512 83.800 1.00 0.00 H HETATM 4473 O HOH A 548 -7.087 17.687 66.491 1.00 37.08 O HETATM 4474 H1 HOH A 548 -7.150 16.791 66.145 1.00 0.00 H HETATM 4475 H2 HOH A 548 -7.171 18.235 65.713 1.00 0.00 H HETATM 4476 O HOH A 549 -6.652 29.553 58.739 1.00 41.54 O HETATM 4477 H1 HOH A 549 -7.309 28.916 59.022 1.00 0.00 H HETATM 4478 H2 HOH A 549 -5.876 29.386 59.262 1.00 0.00 H HETATM 4479 O HOH A 550 0.708 38.830 67.080 1.00 36.79 O HETATM 4480 H1 HOH A 550 1.191 39.332 66.425 1.00 0.00 H HETATM 4481 H2 HOH A 550 0.767 37.931 66.718 1.00 0.00 H HETATM 4482 O HOH A 551 -16.720 46.151 62.132 1.00 46.40 O HETATM 4483 H1 HOH A 551 -16.593 45.191 62.188 1.00 0.00 H HETATM 4484 H2 HOH A 551 -16.585 46.445 63.031 1.00 0.00 H HETATM 4485 O HOH A 552 -16.835 50.466 74.594 1.00 45.62 O HETATM 4486 H1 HOH A 552 -16.658 49.633 74.139 1.00 0.00 H HETATM 4487 H2 HOH A 552 -16.184 51.055 74.203 1.00 0.00 H HETATM 4488 O HOH A 553 -20.949 53.161 76.303 1.00 44.55 O HETATM 4489 H1 HOH A 553 -21.441 52.716 77.002 1.00 0.00 H HETATM 4490 H2 HOH A 553 -20.496 52.467 75.829 1.00 0.00 H HETATM 4491 O HOH A 554 -16.213 47.335 84.580 1.00 38.11 O HETATM 4492 H1 HOH A 554 -15.912 47.995 85.231 1.00 0.00 H HETATM 4493 H2 HOH A 554 -17.103 47.681 84.377 1.00 0.00 H HETATM 4494 O HOH A 555 -19.941 47.668 82.797 1.00 44.04 O HETATM 4495 H1 HOH A 555 -20.384 46.849 82.543 1.00 0.00 H HETATM 4496 H2 HOH A 555 -20.180 48.237 82.052 1.00 0.00 H HETATM 4497 O HOH A 556 -6.932 52.447 82.864 1.00 43.69 O HETATM 4498 H1 HOH A 556 -6.164 52.942 82.576 1.00 0.00 H HETATM 4499 H2 HOH A 556 -6.535 51.732 83.369 1.00 0.00 H HETATM 4500 O HOH A 557 -3.483 27.733 49.330 1.00 41.32 O HETATM 4501 H1 HOH A 557 -2.575 27.580 49.073 1.00 0.00 H HETATM 4502 H2 HOH A 557 -3.602 27.274 50.173 1.00 0.00 H HETATM 4503 O HOH A 558 -1.248 31.304 52.018 1.00 43.75 O HETATM 4504 H1 HOH A 558 -2.013 31.874 52.195 1.00 0.00 H HETATM 4505 H2 HOH A 558 -1.586 30.764 51.292 1.00 0.00 H HETATM 4506 O HOH A 559 -18.914 27.813 96.879 1.00 46.31 O HETATM 4507 H1 HOH A 559 -19.275 27.126 96.315 1.00 0.00 H HETATM 4508 H2 HOH A 559 -18.330 28.309 96.290 1.00 0.00 H HETATM 4509 O HOH A 560 -33.270 42.795 67.692 1.00 48.23 O HETATM 4510 H1 HOH A 560 -33.186 41.926 67.283 1.00 0.00 H HETATM 4511 H2 HOH A 560 -33.804 42.603 68.471 1.00 0.00 H HETATM 4512 O HOH A 561 -22.899 51.373 77.610 1.00 35.83 O HETATM 4513 H1 HOH A 561 -23.053 51.330 78.555 1.00 0.00 H HETATM 4514 H2 HOH A 561 -22.096 50.875 77.465 1.00 0.00 H HETATM 4515 O HOH A 562 -10.274 49.501 77.393 1.00 30.53 O HETATM 4516 H1 HOH A 562 -9.461 49.154 77.784 1.00 0.00 H HETATM 4517 H2 HOH A 562 -10.717 49.837 78.198 1.00 0.00 H HETATM 4518 O HOH A 563 -12.054 49.793 79.705 1.00 38.50 O HETATM 4519 H1 HOH A 563 -12.638 50.132 79.027 1.00 0.00 H HETATM 4520 H2 HOH A 563 -12.525 49.027 80.064 1.00 0.00 H CONECT 3774 3775 3776 3777 3778 CONECT 3775 3774 CONECT 3776 3774 CONECT 3777 3774 CONECT 3778 3774 CONECT 3779 3780 3781 3782 3783 CONECT 3780 3779 CONECT 3781 3779 CONECT 3782 3779 CONECT 3783 3779 CONECT 3784 3785 3810 3811 CONECT 3785 3784 3786 3789 CONECT 3786 3785 3787 CONECT 3787 3786 3788 CONECT 3788 3787 3792 CONECT 3789 3785 3790 3791 CONECT 3790 3789 CONECT 3791 3789 CONECT 3792 3788 3793 CONECT 3793 3792 3794 3795 CONECT 3794 3793 3799 CONECT 3795 3793 3796 3797 CONECT 3796 3795 3812 CONECT 3797 3795 3798 3799 CONECT 3798 3797 3813 CONECT 3799 3794 3797 3800 CONECT 3800 3799 3801 3809 CONECT 3801 3800 3802 CONECT 3802 3801 3803 CONECT 3803 3802 3804 3809 CONECT 3804 3803 3805 3806 CONECT 3805 3804 3814 3815 CONECT 3806 3804 3807 CONECT 3807 3806 3808 CONECT 3808 3807 3809 CONECT 3809 3800 3803 3808 CONECT 3810 3784 CONECT 3811 3784 CONECT 3812 3796 CONECT 3813 3798 CONECT 3814 3805 CONECT 3815 3805 MASTER 346 0 3 18 11 0 7 6 3396 3 42 28 END
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Entry Information
PDB ID
1fjx
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
HHAI DNA METHYLTRANSFERASE
Ligand Name
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EC.Number
E.C.2.1.1.37
Resolution
2.26(Å)
Affinity (Kd/Ki/IC50)
Kd=1.4nM
Release Year
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Protein/NA Sequence
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Primary Reference
The Journal of biological chemistry. (2000) 275, pp. 38722-30
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
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UniProtKB AC
UniProt accession number (AC):
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Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
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