USER MOD reduce.3.24.130724 H: found=0, std=0, add=3293, rem=0, adj=94 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE 31-OCT-03 1RAK TITLE BACTERIAL CYTOSINE DEAMINASE D314S MUTANT BOUND TO 5-FLUORO-4-(S)- TITLE 2 HYDROXYL-3,4-DIHYDROPYRIMIDINE. COMPND MOL_ID: 1; COMPND 2 MOLECULE: CYTOSINE DEAMINASE; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: CYTOSINE AMINOHYDROLASE; COMPND 5 EC: 3.5.4.1; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 562; SOURCE 4 GENE: CODA, B0337; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3)-RIL; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET15B KEYWDS CYTOSINE DEAMINASE, ALPHA-BETA BARREL, HEXAMER, CONFORMATIONAL KEYWDS 2 CHANGE, D314S MUTANT, HYDROLASE EXPDTA X-RAY DIFFRACTION AUTHOR S.D.MAHAN,G.C.IRETON,B.L.STODDARD,M.E.BLACK REVDAT 4 13-JUL-11 1RAK 1 VERSN REVDAT 3 24-FEB-09 1RAK 1 VERSN REVDAT 2 04-JAN-05 1RAK 1 JRNL REVDAT 1 05-OCT-04 1RAK 0 JRNL AUTH S.D.MAHAN,G.C.IRETON,C.KNOEBER,B.L.STODDARD,M.E.BLACK JRNL TITL RANDOM MUTAGENESIS AND SELECTION OF ESCHERICHIA COLI JRNL TITL 2 CYTOSINE DEAMINASE FOR CANCER GENE THERAPY. JRNL REF PROTEIN ENG.DES.SEL. V. 17 625 2004 JRNL REFN ISSN 1741-0126 JRNL PMID 15381761 JRNL DOI 10.1093/PROTEIN/GZH074 REMARK 2 REMARK 2 RESOLUTION. 1.32 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES,PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.32 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 19.89 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 247101.640 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 95.2 REMARK 3 NUMBER OF REFLECTIONS : 124047 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) : 0.172 REMARK 3 FREE R VALUE : 0.179 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 6221 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.002 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 6 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.32 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.40 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 92.10 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 18796 REMARK 3 BIN R VALUE (WORKING SET) : 0.2070 REMARK 3 BIN FREE R VALUE : 0.2140 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 5.10 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 1019 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.007 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3323 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 16 REMARK 3 SOLVENT ATOMS : 440 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 10.00 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 12.20 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.24000 REMARK 3 B22 (A**2) : 0.24000 REMARK 3 B33 (A**2) : -0.48000 REMARK 3 B12 (A**2) : 0.64000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.13 REMARK 3 ESD FROM SIGMAA (A) : 0.08 REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.13 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.08 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.008 REMARK 3 BOND ANGLES (DEGREES) : 1.40 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 23.00 REMARK 3 IMPROPER ANGLES (DEGREES) : 0.95 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 0.880 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 1.310 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 1.620 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 2.340 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.38 REMARK 3 BSOL : 58.34 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 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : ION.PARAM REMARK 3 PARAMETER FILE 3 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 4 : 5FHDP.PARAM REMARK 3 PARAMETER FILE 5 : GLYCEROL.PARAM REMARK 3 PARAMETER FILE 6 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : ION.TOP REMARK 3 TOPOLOGY FILE 3 : WATER.TOP REMARK 3 TOPOLOGY FILE 4 : 5FHDP.TOP REMARK 3 TOPOLOGY FILE 5 : GLYCEROL.TOP REMARK 3 TOPOLOGY FILE 6 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1RAK COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 10-NOV-03. REMARK 100 THE RCSB ID CODE IS RCSB020628. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 24-JUN-03 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 5.0.2 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.00 REMARK 200 MONOCHROMATOR : DOUBLE CRYSTAL SI (111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 210 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 126518 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.320 REMARK 200 RESOLUTION RANGE LOW (A) : 20.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.6 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : 0.07600 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 18.8000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.32 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.36 REMARK 200 COMPLETENESS FOR SHELL (%) : 95.7 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : 0.33000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 3.500 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: FOURIER SYNTHESIS REMARK 200 SOFTWARE USED: CNS REMARK 200 STARTING MODEL: 1K70 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 57.68 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.91 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 8000, MAGNESIUM CHLORIDE, HEPES, REMARK 280 PH 7.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K 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 54.74050 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 31.60444 REMARK 290 SMTRY3 7 0.000000 0.000000 1.000000 80.36267 REMARK 290 SMTRY1 8 -0.500000 -0.866025 0.000000 54.74050 REMARK 290 SMTRY2 8 0.866025 -0.500000 0.000000 31.60444 REMARK 290 SMTRY3 8 0.000000 0.000000 1.000000 80.36267 REMARK 290 SMTRY1 9 -0.500000 0.866025 0.000000 54.74050 REMARK 290 SMTRY2 9 -0.866025 -0.500000 0.000000 31.60444 REMARK 290 SMTRY3 9 0.000000 0.000000 1.000000 80.36267 REMARK 290 SMTRY1 10 -0.500000 0.866025 0.000000 54.74050 REMARK 290 SMTRY2 10 0.866025 0.500000 0.000000 31.60444 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 80.36267 REMARK 290 SMTRY1 11 1.000000 0.000000 0.000000 54.74050 REMARK 290 SMTRY2 11 0.000000 -1.000000 0.000000 31.60444 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 80.36267 REMARK 290 SMTRY1 12 -0.500000 -0.866025 0.000000 54.74050 REMARK 290 SMTRY2 12 -0.866025 0.500000 0.000000 31.60444 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 80.36267 REMARK 290 SMTRY1 13 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 13 0.000000 1.000000 0.000000 63.20888 REMARK 290 SMTRY3 13 0.000000 0.000000 1.000000 160.72533 REMARK 290 SMTRY1 14 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 14 0.866025 -0.500000 0.000000 63.20888 REMARK 290 SMTRY3 14 0.000000 0.000000 1.000000 160.72533 REMARK 290 SMTRY1 15 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 15 -0.866025 -0.500000 0.000000 63.20888 REMARK 290 SMTRY3 15 0.000000 0.000000 1.000000 160.72533 REMARK 290 SMTRY1 16 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 16 0.866025 0.500000 0.000000 63.20888 REMARK 290 SMTRY3 16 0.000000 0.000000 -1.000000 160.72533 REMARK 290 SMTRY1 17 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 17 0.000000 -1.000000 0.000000 63.20888 REMARK 290 SMTRY3 17 0.000000 0.000000 -1.000000 160.72533 REMARK 290 SMTRY1 18 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 18 -0.866025 0.500000 0.000000 63.20888 REMARK 290 SMTRY3 18 0.000000 0.000000 -1.000000 160.72533 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 HEXAMER GENERATED FROM THE REMARK 300 MONOMER IN THE ASYMMETRIC UNIT BY THE OPERATIONS: Y,X,-Z;Y,Y-X,-X, REMARK 300 Z;Y,X,-Z;X-Y,-Y,-Z;-X,Y-X,-Z 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: HEXAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: HEXAMERIC REMARK 350 SOFTWARE USED: PISA,PQS REMARK 350 TOTAL BURIED SURFACE AREA: 31950 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 77510 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -184.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 350 BIOMT2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 350 BIOMT2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 350 BIOMT3 3 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 350 BIOMT2 4 0.866025 0.500000 0.000000 0.00000 REMARK 350 BIOMT3 4 0.000000 0.000000 -1.000000 241.08800 REMARK 350 BIOMT1 5 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT3 5 0.000000 0.000000 -1.000000 241.08800 REMARK 350 BIOMT1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 350 BIOMT2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 350 BIOMT3 6 0.000000 0.000000 -1.000000 241.08800 REMARK 375 REMARK 375 SPECIAL POSITION REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL REMARK 375 POSITIONS. REMARK 375 REMARK 375 ATOM RES CSSEQI REMARK 375 HOH A 922 LIES ON A SPECIAL POSITION. REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A -3 REMARK 465 SER A -2 REMARK 465 SER A -1 REMARK 465 MET A 0 REMARK 465 ALA A 1 REMARK 465 ASN A 2 REMARK 465 ASN A 3 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 O HOH A 952 O HOH A 952 17555 0.31 REMARK 500 O HOH A 927 O HOH A 927 17555 0.31 REMARK 500 O HOH A 951 O HOH A 951 17555 0.32 REMARK 500 O HOH A 986 O HOH A 986 2655 0.34 REMARK 500 O HOH A 935 O HOH A 935 4556 0.38 REMARK 500 O HOH A 988 O HOH A 988 4556 0.39 REMARK 500 O HOH A 917 O HOH A 917 4556 0.41 REMARK 500 O HOH A 989 O HOH A 989 4556 2.03 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 ASN A 44 5.17 81.35 REMARK 500 ASP A 127 111.64 -165.78 REMARK 500 ILE A 183 68.41 -153.92 REMARK 500 HIS A 246 -73.66 75.85 REMARK 500 THR A 288 -92.59 -102.42 REMARK 500 ASP A 313 -65.00 72.23 REMARK 500 TYR A 320 112.59 -165.43 REMARK 500 LEU A 322 -162.38 -125.58 REMARK 500 THR A 354 -97.25 -131.97 REMARK 500 LEU A 416 -137.54 -96.53 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 907 DISTANCE = 5.75 ANGSTROMS REMARK 525 HOH A1033 DISTANCE = 5.20 ANGSTROMS REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 FE A 500 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS A 63 NE2 REMARK 620 2 HIS A 61 NE2 109.6 REMARK 620 3 HIS A 214 NE2 102.1 94.8 REMARK 620 4 ASP A 313 OD1 85.9 79.9 171.6 REMARK 620 5 FPY A 501 O4 117.7 126.5 98.3 80.0 REMARK 620 N 1 2 3 4 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FE A 500 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FPY A 501 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL A 502 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1K7O RELATED DB: PDB REMARK 900 RELATED ID: 1R9X RELATED DB: PDB REMARK 900 RELATED ID: 1R9Y RELATED DB: PDB REMARK 900 RELATED ID: 1R9Z RELATED DB: PDB REMARK 900 RELATED ID: 1RA0 RELATED DB: PDB REMARK 900 RELATED ID: 1RA5 RELATED DB: PDB REMARK 900 RELATED ID: 1RB7 RELATED DB: PDB DBREF 1RAK A -1 426 UNP P25524 CODA_ECOLI 1 426 SEQADV 1RAK GLY A -3 UNP P25524 CLONING ARTIFACT SEQADV 1RAK SER A -2 UNP P25524 CLONING ARTIFACT SEQADV 1RAK SER A -1 UNP P25524 CLONING ARTIFACT SEQADV 1RAK MET A 0 UNP P25524 CLONING ARTIFACT SEQADV 1RAK ALA A 1 UNP P25524 SER 1 ENGINEERED SEQADV 1RAK SER A 314 UNP P25524 ASP 314 ENGINEERED SEQRES 1 A 430 GLY SER SER MET ALA ASN ASN ALA LEU GLN THR ILE ILE SEQRES 2 A 430 ASN ALA ARG LEU PRO GLY GLU GLU GLY LEU TRP GLN ILE SEQRES 3 A 430 HIS LEU GLN ASP GLY LYS ILE SER ALA ILE ASP ALA GLN SEQRES 4 A 430 SER GLY VAL MET PRO ILE THR GLU ASN SER LEU ASP ALA SEQRES 5 A 430 GLU GLN GLY LEU VAL ILE PRO PRO PHE VAL GLU PRO HIS SEQRES 6 A 430 ILE HIS LEU ASP THR THR GLN THR ALA GLY GLN PRO ASN SEQRES 7 A 430 TRP ASN GLN SER GLY THR LEU PHE GLU GLY ILE GLU ARG SEQRES 8 A 430 TRP ALA GLU ARG LYS ALA LEU LEU THR HIS ASP ASP VAL SEQRES 9 A 430 LYS GLN ARG ALA TRP GLN THR LEU LYS TRP GLN ILE ALA SEQRES 10 A 430 ASN GLY ILE GLN HIS VAL ARG THR HIS VAL ASP VAL SER SEQRES 11 A 430 ASP ALA THR LEU THR ALA LEU LYS ALA MET LEU GLU VAL SEQRES 12 A 430 LYS GLN GLU VAL ALA PRO TRP ILE ASP LEU GLN ILE VAL SEQRES 13 A 430 ALA PHE PRO GLN GLU GLY ILE LEU SER TYR PRO ASN GLY SEQRES 14 A 430 GLU ALA LEU LEU GLU GLU ALA LEU ARG LEU GLY ALA ASP SEQRES 15 A 430 VAL VAL GLY ALA ILE PRO HIS PHE GLU PHE THR ARG GLU SEQRES 16 A 430 TYR GLY VAL GLU SER LEU HIS LYS THR PHE ALA LEU ALA SEQRES 17 A 430 GLN LYS TYR ASP ARG LEU ILE ASP VAL HIS CYS ASP GLU SEQRES 18 A 430 ILE ASP ASP GLU GLN SER ARG PHE VAL GLU THR VAL ALA SEQRES 19 A 430 ALA LEU ALA HIS HIS GLU GLY MET GLY ALA ARG VAL THR SEQRES 20 A 430 ALA SER HIS THR THR ALA MET HIS SER TYR ASN GLY ALA SEQRES 21 A 430 TYR THR SER ARG LEU PHE ARG LEU LEU LYS MET SER GLY SEQRES 22 A 430 ILE ASN PHE VAL ALA ASN PRO LEU VAL ASN ILE HIS LEU SEQRES 23 A 430 GLN GLY ARG PHE ASP THR TYR PRO LYS ARG ARG GLY ILE SEQRES 24 A 430 THR ARG VAL LYS GLU MET LEU GLU SER GLY ILE ASN VAL SEQRES 25 A 430 CYS PHE GLY HIS ASP SER VAL PHE ASP PRO TRP TYR PRO SEQRES 26 A 430 LEU GLY THR ALA ASN MET LEU GLN VAL LEU HIS MET GLY SEQRES 27 A 430 LEU HIS VAL CYS GLN LEU MET GLY TYR GLY GLN ILE ASN SEQRES 28 A 430 ASP GLY LEU ASN LEU ILE THR HIS HIS SER ALA ARG THR SEQRES 29 A 430 LEU ASN LEU GLN ASP TYR GLY ILE ALA ALA GLY ASN SER SEQRES 30 A 430 ALA ASN LEU ILE ILE LEU PRO ALA GLU ASN GLY PHE ASP SEQRES 31 A 430 ALA LEU ARG ARG GLN VAL PRO VAL ARG TYR SER VAL ARG SEQRES 32 A 430 GLY GLY LYS VAL ILE ALA SER THR GLN PRO ALA GLN THR SEQRES 33 A 430 THR VAL TYR LEU GLU GLN PRO GLU ALA ILE ASP TYR LYS SEQRES 34 A 430 ARG HET FE A 500 1 HET FPY A 501 9 HET GOL A 502 6 HETNAM FE FE (III) ION HETNAM FPY (4S)-5-FLUORO-4-HYDROXY-3,4-DIHYDROPYRIMIDIN-2(1H)-ONE HETNAM GOL GLYCEROL HETSYN FPY 5-FLUORO-4-(S)-HYDROXY-3,4-DIHYDROPYRIMIDINE HETSYN GOL GLYCERIN; PROPANE-1,2,3-TRIOL FORMUL 2 FE FE 3+ FORMUL 3 FPY C4 H5 F N2 O2 FORMUL 4 GOL C3 H8 O3 FORMUL 5 HOH *440(H2 O) HELIX 1 1 THR A 80 ALA A 93 1 14 HELIX 2 2 THR A 96 ASN A 114 1 19 HELIX 3 3 LEU A 130 ALA A 144 1 15 HELIX 4 4 ASN A 164 LEU A 175 1 12 HELIX 5 5 ILE A 183 GLU A 187 5 5 HELIX 6 6 THR A 189 ASP A 208 1 20 HELIX 7 7 ARG A 224 GLY A 237 1 14 HELIX 8 8 MET A 238 ALA A 240 5 3 HELIX 9 9 THR A 248 TYR A 253 5 6 HELIX 10 10 ASN A 254 GLY A 269 1 16 HELIX 11 11 ASN A 275 GLN A 283 1 9 HELIX 12 12 ARG A 297 SER A 304 1 8 HELIX 13 13 ASN A 326 CYS A 338 1 13 HELIX 14 14 GLY A 342 ASP A 348 1 7 HELIX 15 15 GLY A 349 ILE A 353 5 5 HELIX 16 16 THR A 354 LEU A 361 1 8 HELIX 17 17 ASN A 383 GLN A 391 1 9 SHEET 1 A 4 LYS A 28 GLN A 35 0 SHEET 2 A 4 LEU A 19 GLN A 25 -1 N GLN A 21 O ASP A 33 SHEET 3 A 4 THR A 7 ALA A 11 -1 N ILE A 8 O ILE A 22 SHEET 4 A 4 SER A 45 ASP A 47 1 O LEU A 46 N THR A 7 SHEET 1 B 4 LEU A 52 ILE A 54 0 SHEET 2 B 4 LEU A 376 LEU A 379 -1 O ILE A 377 N ILE A 54 SHEET 3 B 4 TYR A 396 ARG A 399 -1 O VAL A 398 N LEU A 376 SHEET 4 B 4 LYS A 402 SER A 406 -1 O ILE A 404 N SER A 397 SHEET 1 C 8 PHE A 57 ILE A 62 0 SHEET 2 C 8 ILE A 116 ASP A 124 1 O HIS A 118 N GLU A 59 SHEET 3 C 8 ASP A 148 PHE A 154 1 O GLN A 150 N VAL A 119 SHEET 4 C 8 VAL A 179 ALA A 182 1 O VAL A 179 N ALA A 153 SHEET 5 C 8 LEU A 210 CYS A 215 1 O LEU A 210 N VAL A 180 SHEET 6 C 8 VAL A 242 HIS A 246 1 O SER A 245 N VAL A 213 SHEET 7 C 8 ASN A 271 ALA A 274 1 O ASN A 271 N ALA A 244 SHEET 8 C 8 VAL A 308 PHE A 310 1 O CYS A 309 N ALA A 274 SHEET 1 D 2 THR A 412 TYR A 415 0 SHEET 2 D 2 PRO A 419 ILE A 422 -1 O ILE A 422 N THR A 412 LINK NE2 HIS A 63 FE FE A 500 1555 1555 2.06 LINK NE2 HIS A 61 FE FE A 500 1555 1555 2.06 LINK FE FE A 500 NE2 HIS A 214 1555 1555 2.26 LINK FE FE A 500 OD1 ASP A 313 1555 1555 2.50 LINK FE FE A 500 O4 FPY A 501 1555 1555 1.99 CISPEP 1 GLN A 72 PRO A 73 0 -0.37 CISPEP 2 TYR A 289 PRO A 290 0 -0.26 SITE *** AC1 5 HIS A 61 HIS A 63 HIS A 214 ASP A 313 SITE *** AC1 5 FPY A 501 SITE *** AC2 14 HIS A 61 HIS A 63 LEU A 81 PHE A 154 SITE *** AC2 14 GLN A 156 ILE A 183 HIS A 214 GLU A 217 SITE *** AC2 14 HIS A 246 ASP A 313 SER A 314 TRP A 319 SITE *** AC2 14 FE A 500 HOH A 665 SITE *** AC3 6 ALA A 128 LYS A 134 ARG A 174 LEU A 175 SITE *** AC3 6 HOH A 951 HOH A 976 CRYST1 109.481 109.481 241.088 90.00 90.00 120.00 H 3 2 18 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 0.009134 0.005274 0.000000 0.00000 SCALE2 0.000000 0.010547 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004148 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 61 HIS HE2 : A 61 HIS NE2 : A 500 FEFE :(H bumps) USER MOD NoAdj-H: A 63 HIS HE2 : A 63 HIS NE2 : A 500 FEFE :(H bumps) USER MOD NoAdj-H: A 214 HIS HE2 : A 214 HIS NE2 : A 500 FEFE :(H bumps) USER MOD NoAdj-H: A 502 GOL HO2 : A 502 GOL O2 : A 502 GOL C2 :(short bond) USER MOD NoAdj-H: A 502 GOL H32 : A 502 GOL C3 : A 502 GOL C2 :(H bumps) USER MOD NoAdj-H: A 502 GOL H31 : A 502 GOL C3 : A 502 GOL C2 :(H bumps) USER MOD NoAdj-H: A 502 GOL H2 : A 502 GOL C2 : A 502 GOL C3 :(H bumps) USER MOD Set 1.1: A 271 ASN : amide:sc= 0.862 K(o=4.5,f=0.91) USER MOD Set 1.2: A 307 ASN : amide:sc= 1.64 K(o=4.5,f=1.6) USER MOD Set 1.3: A 309 CYS SG : rot 60:sc= 0.044 USER MOD Set 1.4: A 356 HIS : +bothHN:sc= 1.49 K(o=4.5,f=-2.9!) USER MOD Set 1.5: A 360 THR OG1 : rot 162:sc= 0.464 USER MOD Set 2.1: A 248 THR OG1 : rot 180:sc= -0.289 USER MOD Set 2.2: A 283 GLN : amide:sc= 2.59 K(o=2.3,f=1) USER MOD Set 3.1: A 247 THR OG1 : rot -4:sc= 1.96 USER MOD Set 3.2: A 250 MET CE :methyl -167:sc= -0.0232 (180deg=-0.209) USER MOD Set 3.3: A 296 THR OG1 : rot 152:sc= 0.944 USER MOD Set 3.4: A 301 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 246 HIS : no HD1:sc= 1 K(o=1.4,f=-4.6!) USER MOD Set 4.2: A 275 ASN :FLIP amide:sc= -1.12 F(o=0.74,f=1.4) USER MOD Set 4.3: A 279 ASN :FLIP amide:sc= 1.56 F(o=-1.4,f=1.4) USER MOD Set 5.1: A 129 THR OG1 : rot -62:sc= 1.84 USER MOD Set 5.2: A 131 THR OG1 : rot 72:sc= 2.06 USER MOD Set 6.1: A 117 GLN :FLIP amide:sc= 0.545 F(o=-1.6!,f=1.8) USER MOD Set 6.2: A 397 SER OG : rot -171:sc= 1.29 USER MOD Set 7.1: A 76 ASN :FLIP amide:sc= -0.0783 F(o=-1.8!,f=2.8) USER MOD Set 7.2: A 78 SER OG : rot -90:sc= 1.81 USER MOD Set 7.3: A 80 THR OG1 : rot -82:sc= 1.11 USER MOD Set 8.1: A 67 THR OG1 : rot 33:sc= 1.46 USER MOD Set 8.2: A 68 GLN : amide:sc= 0.295 K(o=2.8,f=1.6) USER MOD Set 8.3: A 107 THR OG1 : rot 179:sc= 1.01 USER MOD Set 9.1: A 10 ASN :FLIP amide:sc= 1.84 F(o=-11!,f=2.5) USER MOD Set 9.2: A 35 GLN : amide:sc= 0.702 K(o=2.5,f=-3.4!) USER MOD Set10.1: A 6 GLN : amide:sc=-0.00888 X(o=-0.061,f=-0.047) USER MOD Set10.2: A 44 ASN : amide:sc= -0.052 X(o=-0.061,f=-0.1) USER MOD Single : A 7 THR OG1 : rot -80:sc= 1.28 USER MOD Single : A 21 GLN : amide:sc= -0.41! C(o=-0.41!,f=-3.2!) USER MOD Single : A 23 HIS : no HD1:sc= 0.993 K(o=0.99,f=-2.9!) USER MOD Single : A 25 GLN : amide:sc= 0.485 K(o=0.49,f=-0.047) USER MOD Single : A 28 LYS NZ :NH3+ 165:sc= -0.0322 (180deg=-0.224) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -120:sc= 0.482 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc=-0.00614 USER MOD Single : A 45 SER OG : rot 41:sc= 1.53 USER MOD Single : A 50 GLN : amide:sc= 0.108 X(o=0.11,f=0.33) USER MOD Single : A 66 THR OG1 : rot 118:sc= 0.929 USER MOD Single : A 69 THR OG1 : rot -80:sc= 1.08 USER MOD Single : A 72 GLN : amide:sc= 0.199 K(o=0.2,f=-3.9!) USER MOD Single : A 74 ASN : amide:sc= 1.16 X(o=1.2,f=0.87) USER MOD Single : A 77 GLN :FLIP amide:sc= -2.06! C(o=-3.8!,f=-2.1!) USER MOD Single : A 92 LYS NZ :NH3+ 176:sc= 2.77 (180deg=2.73) USER MOD Single : A 96 THR OG1 : rot -144:sc= 0.274 USER MOD Single : A 97 HIS : no HD1:sc= 1.17 K(o=1.2,f=-5!) USER MOD Single : A 101 LYS NZ :NH3+ -172:sc= 2.58 (180deg=2.51) USER MOD Single : A 102 GLN : amide:sc= 1.03 K(o=1,f=-0.13) USER MOD Single : A 106 GLN : amide:sc= -0.0353 K(o=-0.035,f=-0.82) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 GLN : amide:sc= 0.00765 K(o=0.0076,f=-2.2!) USER MOD Single : A 114 ASN : amide:sc= 0.89 K(o=0.89,f=-1) USER MOD Single : A 118 HIS : no HE2:sc= 1.58 K(o=1.6,f=-2.6!) USER MOD Single : A 121 THR OG1 : rot -140:sc= 0.571 USER MOD Single : A 122 HIS : no HD1:sc= 1.77 K(o=1.8,f=-3.4!) USER MOD Single : A 126 SER OG : rot -44:sc= 1.73 USER MOD Single : A 134 LYS NZ :NH3+ 176:sc= 2.55 (180deg=2.52) USER MOD Single : A 136 MET CE :methyl 167:sc= -0.0872 (180deg=-0.324) USER MOD Single : A 140 LYS NZ :NH3+ 178:sc= 1.98 (180deg=1.96) USER MOD Single : A 141 GLN : amide:sc= 0.0515 X(o=0.051,f=0.023) USER MOD Single : A 150 GLN :FLIP amide:sc= 1.32 F(o=-5.8!,f=1.3) USER MOD Single : A 156 GLN : amide:sc= 1.83 K(o=1.8,f=-4.5!) USER MOD Single : A 161 SER OG : rot 78:sc= 1.61 USER MOD Single : A 162 TYR OH : rot 20:sc= 2.53 USER MOD Single : A 164 ASN : amide:sc= 1.28 X(o=1.3,f=1) USER MOD Single : A 185 HIS : no HE2:sc= 0.601 K(o=0.6,f=-3.5!) USER MOD Single : A 189 THR OG1 : rot -165:sc= 1.39 USER MOD Single : A 192 TYR OH : rot 163:sc= 1.96 USER MOD Single : A 196 SER OG : rot -53:sc= 2.05 USER MOD Single : A 198 HIS : no HE2:sc= 2.6 K(o=2.6,f=-6.2!) USER MOD Single : A 199 LYS NZ :NH3+ -169:sc= 1.25 (180deg=1.07) USER MOD Single : A 200 THR OG1 : rot 75:sc= 0.588 USER MOD Single : A 205 GLN : amide:sc= 0.28 K(o=0.28,f=-7!) USER MOD Single : A 206 LYS NZ :NH3+ -168:sc= 1.16 (180deg=1.06) USER MOD Single : A 207 TYR OH : rot -6:sc= 1.41 USER MOD Single : A 215 CYS SG : rot -56:sc= 0.0698 USER MOD Single : A 222 GLN : amide:sc= 1.31 X(o=1.3,f=1.1) USER MOD Single : A 223 SER OG : rot -63:sc= 1.41 USER MOD Single : A 228 THR OG1 : rot 87:sc= 1.29 USER MOD Single : A 234 HIS : no HE2:sc= 1.16 K(o=1.2,f=-2.6!) USER MOD Single : A 235 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 238 MET CE :methyl 180:sc= -0.0588 (180deg=-0.0588) USER MOD Single : A 243 THR OG1 : rot 92:sc= 0.742 USER MOD Single : A 245 SER OG : rot 101:sc= 1.86 USER MOD Single : A 251 HIS :FLIP no HE2:sc= -0.098 F(o=-0.87,f=-0.098) USER MOD Single : A 252 SER OG : rot 92:sc= 1.82 USER MOD Single : A 253 TYR OH : rot 5:sc= 2.27 USER MOD Single : A 254 ASN : amide:sc= 0.686 K(o=0.69,f=-3.8!) USER MOD Single : A 257 TYR OH : rot 5:sc= 1.22 USER MOD Single : A 258 THR OG1 : rot 80:sc= 0.495 USER MOD Single : A 259 SER OG : rot 180:sc= 0 USER MOD Single : A 266 LYS NZ :NH3+ 162:sc= 0.995 (180deg=0.815) USER MOD Single : A 267 MET CE :methyl 176:sc= 0 (180deg=-0.0261) USER MOD Single : A 268 SER OG : rot -47:sc= 0.516 USER MOD Single : A 281 HIS : no HD1:sc= 0.726 K(o=0.73,f=-4!) USER MOD Single : A 288 THR OG1 : rot 130:sc= 0.438 USER MOD Single : A 289 TYR OH : rot 180:sc= 1.05 USER MOD Single : A 291 LYS NZ :NH3+ -147:sc= 1.68 (180deg=0.623) USER MOD Single : A 299 LYS NZ :NH3+ 174:sc= 1.68 (180deg=1.64) USER MOD Single : A 304 SER OG : rot 157:sc= 1.01 USER MOD Single : A 312 HIS : no HE2:sc= 1.1 K(o=1.1,f=-3.7!) USER MOD Single : A 314 SER OG : rot -97:sc= 0.28 USER MOD Single : A 320 TYR OH : rot 180:sc= 1.05 USER MOD Single : A 324 THR OG1 : rot 121:sc= 2.01 USER MOD Single : A 326 ASN : amide:sc= 1.24 K(o=1.2,f=-4.4!) USER MOD Single : A 327 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 329 GLN : amide:sc= 2.68 K(o=2.7,f=0.053) USER MOD Single : A 332 HIS : no HD1:sc= 1.03 K(o=1,f=-1.4) USER MOD Single : A 333 MET CE :methyl 167:sc= -0.0204 (180deg=-0.18) USER MOD Single : A 336 HIS : no HE2:sc= 0.949 K(o=0.95,f=-3!) USER MOD Single : A 338 CYS SG : rot 180:sc= -0.0588 USER MOD Single : A 339 GLN : amide:sc= 0.967 K(o=0.97,f=0.063) USER MOD Single : A 341 MET CE :methyl -135:sc= 0 (180deg=-0.0713) USER MOD Single : A 343 TYR OH : rot 10:sc= 1.33 USER MOD Single : A 345 GLN : amide:sc= 1.87 K(o=1.9,f=-2!) USER MOD Single : A 347 ASN : amide:sc= 0.923 K(o=0.92,f=-4.9!) USER MOD Single : A 351 ASN : amide:sc= 0.607 K(o=0.61,f=-0.57) USER MOD Single : A 354 THR OG1 : rot -69:sc= 2.19 USER MOD Single : A 355 HIS : no HE2:sc= 2.37 K(o=2.4,f=-4.1!) USER MOD Single : A 357 SER OG : rot 173:sc= 0.561 USER MOD Single : A 362 ASN : amide:sc= 1.47 X(o=1.5,f=1.8) USER MOD Single : A 364 GLN : amide:sc= 0.488 K(o=0.49,f=-0.022) USER MOD Single : A 366 TYR OH : rot 180:sc= 1.13 USER MOD Single : A 372 ASN : amide:sc= 3.03 K(o=3,f=-1.2) USER MOD Single : A 373 SER OG : rot 120:sc= 1.36 USER MOD Single : A 375 ASN : amide:sc= 2.01 K(o=2,f=-1.4!) USER MOD Single : A 383 ASN : amide:sc= 0.466 K(o=0.47,f=-4.7!) USER MOD Single : A 391 GLN : amide:sc= 1.53 K(o=1.5,f=0.25) USER MOD Single : A 396 TYR OH : rot 180:sc= 0 USER MOD Single : A 402 LYS NZ :NH3+ 164:sc= -0.0208 (180deg=-0.238) USER MOD Single : A 406 SER OG : rot 180:sc= 0 USER MOD Single : A 407 THR OG1 : rot 72:sc= 1.11 USER MOD Single : A 408 GLN : amide:sc= 0.54 X(o=0.54,f=0.63) USER MOD Single : A 411 GLN : amide:sc= 0 X(o=0,f=-0.075) USER MOD Single : A 412 THR OG1 : rot 98:sc= 1.35 USER MOD Single : A 413 THR OG1 : rot 91:sc= 0.874 USER MOD Single : A 415 TYR OH : rot 180:sc= 0 USER MOD Single : A 418 GLN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 424 TYR OH : rot 30:sc= 1.21 USER MOD Single : A 425 LYS NZ :NH3+ -139:sc= 0.307 (180deg=0.00277) USER MOD Single : A 502 GOL O1 : rot 180:sc= 0 USER MOD Single : A 502 GOL O3 : rot 45:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 4 41.288 46.426 98.619 1.00 29.83 N ATOM 2 CA ALA A 4 40.468 45.200 98.853 1.00 28.94 C ATOM 3 C ALA A 4 41.163 44.250 99.828 1.00 27.83 C ATOM 4 O ALA A 4 42.389 44.267 99.957 1.00 28.10 O ATOM 5 CB ALA A 4 40.212 44.491 97.527 1.00 29.58 C ATOM 0 HA ALA A 4 39.623 45.468 99.246 1.00 28.94 H new ATOM 0 HB1 ALA A 4 39.679 43.695 97.683 1.00 29.58 H new ATOM 0 HB2 ALA A 4 39.735 45.087 96.928 1.00 29.58 H new ATOM 0 HB3 ALA A 4 41.058 44.239 97.126 1.00 29.58 H new ATOM 6 N LEU A 5 40.371 43.427 100.511 1.00 26.66 N ATOM 7 CA LEU A 5 40.901 42.460 101.472 1.00 24.30 C ATOM 8 C LEU A 5 41.866 41.484 100.812 1.00 22.53 C ATOM 9 O LEU A 5 41.575 40.923 99.759 1.00 22.36 O ATOM 10 CB LEU A 5 39.762 41.668 102.121 1.00 24.80 C ATOM 11 CG LEU A 5 38.845 42.410 103.095 1.00 25.01 C ATOM 12 CD1 LEU A 5 37.761 41.461 103.582 1.00 25.44 C ATOM 13 CD2 LEU A 5 39.654 42.944 104.268 1.00 25.77 C ATOM 0 H LEU A 5 39.515 43.413 100.432 1.00 26.66 H new ATOM 0 HA LEU A 5 41.380 42.964 102.148 1.00 24.30 H new ATOM 0 HB2 LEU A 5 39.211 41.302 101.412 1.00 24.80 H new ATOM 0 HB3 LEU A 5 40.153 40.916 102.593 1.00 24.80 H new ATOM 0 HG LEU A 5 38.430 43.162 102.644 1.00 25.01 H new ATOM 0 HD11 LEU A 5 37.177 41.927 104.200 1.00 25.44 H new ATOM 0 HD12 LEU A 5 37.244 41.144 102.825 1.00 25.44 H new ATOM 0 HD13 LEU A 5 38.170 40.705 104.032 1.00 25.44 H new ATOM 0 HD21 LEU A 5 39.066 43.413 104.880 1.00 25.77 H new ATOM 0 HD22 LEU A 5 40.080 42.205 104.731 1.00 25.77 H new ATOM 0 HD23 LEU A 5 40.333 43.555 103.942 1.00 25.77 H new ATOM 14 N GLN A 6 43.009 41.272 101.450 1.00 20.83 N ATOM 15 CA GLN A 6 44.014 40.365 100.917 1.00 19.34 C ATOM 16 C GLN A 6 44.168 39.095 101.742 1.00 17.40 C ATOM 17 O GLN A 6 44.630 38.073 101.230 1.00 16.14 O ATOM 18 CB GLN A 6 45.367 41.077 100.839 1.00 22.42 C ATOM 19 CG GLN A 6 45.410 42.211 99.827 1.00 26.21 C ATOM 20 CD GLN A 6 46.726 42.962 99.852 1.00 29.11 C ATOM 21 OE1 GLN A 6 47.797 42.362 99.763 1.00 31.51 O ATOM 22 NE2 GLN A 6 46.652 44.283 99.970 1.00 30.80 N ATOM 0 H GLN A 6 43.222 41.645 102.195 1.00 20.83 H new ATOM 0 HA GLN A 6 43.711 40.103 100.034 1.00 19.34 H new ATOM 0 HB2 GLN A 6 45.588 41.429 101.715 1.00 22.42 H new ATOM 0 HB3 GLN A 6 46.051 40.428 100.613 1.00 22.42 H new ATOM 0 HG2 GLN A 6 45.262 41.853 98.938 1.00 26.21 H new ATOM 0 HG3 GLN A 6 44.685 42.829 100.008 1.00 26.21 H new ATOM 0 HE21 GLN A 6 45.885 44.667 100.030 1.00 30.80 H new ATOM 0 HE22 GLN A 6 47.371 44.754 99.987 1.00 30.80 H new ATOM 23 N THR A 7 43.768 39.154 103.009 1.00 16.84 N ATOM 24 CA THR A 7 43.918 37.999 103.884 1.00 15.88 C ATOM 25 C THR A 7 42.940 37.940 105.053 1.00 14.94 C ATOM 26 O THR A 7 42.489 38.971 105.554 1.00 15.10 O ATOM 27 CB THR A 7 45.336 37.974 104.521 1.00 16.30 C ATOM 28 OG1 THR A 7 46.313 38.404 103.562 1.00 18.65 O ATOM 29 CG2 THR A 7 45.685 36.579 104.994 1.00 16.71 C ATOM 0 H THR A 7 43.412 39.845 103.377 1.00 16.84 H new ATOM 0 HA THR A 7 43.747 37.246 103.297 1.00 15.88 H new ATOM 0 HB THR A 7 45.337 38.576 105.282 1.00 16.30 H new ATOM 0 HG1 THR A 7 46.502 37.766 103.049 1.00 18.65 H new ATOM 0 HG21 THR A 7 46.571 36.583 105.388 1.00 16.71 H new ATOM 0 HG22 THR A 7 45.038 36.291 105.657 1.00 16.71 H new ATOM 0 HG23 THR A 7 45.669 35.968 104.241 1.00 16.71 H new ATOM 30 N ILE A 8 42.610 36.716 105.465 1.00 13.65 N ATOM 31 CA ILE A 8 41.791 36.484 106.655 1.00 13.64 C ATOM 32 C ILE A 8 42.830 35.839 107.577 1.00 12.66 C ATOM 33 O ILE A 8 43.424 34.824 107.219 1.00 13.21 O ATOM 34 CB ILE A 8 40.662 35.447 106.450 1.00 14.18 C ATOM 35 CG1 ILE A 8 39.787 35.822 105.249 1.00 16.30 C ATOM 36 CG2 ILE A 8 39.836 35.350 107.733 1.00 14.32 C ATOM 37 CD1 ILE A 8 39.071 37.143 105.381 1.00 16.24 C ATOM 0 H ILE A 8 42.855 35.997 105.062 1.00 13.65 H new ATOM 0 HA ILE A 8 41.350 37.294 106.954 1.00 13.64 H new ATOM 0 HB ILE A 8 41.050 34.579 106.258 1.00 14.18 H new ATOM 0 HG12 ILE A 8 40.343 35.847 104.454 1.00 16.30 H new ATOM 0 HG13 ILE A 8 39.128 35.123 105.113 1.00 16.30 H new ATOM 0 HG21 ILE A 8 39.125 34.701 107.612 1.00 14.32 H new ATOM 0 HG22 ILE A 8 40.407 35.071 108.466 1.00 14.32 H new ATOM 0 HG23 ILE A 8 39.451 36.217 107.936 1.00 14.32 H new ATOM 0 HD11 ILE A 8 38.542 37.306 104.584 1.00 16.24 H new ATOM 0 HD12 ILE A 8 38.488 37.120 106.156 1.00 16.24 H new ATOM 0 HD13 ILE A 8 39.721 37.855 105.487 1.00 16.24 H new ATOM 38 N ILE A 9 43.056 36.418 108.750 1.00 12.03 N ATOM 39 CA ILE A 9 44.052 35.874 109.673 1.00 12.21 C ATOM 40 C ILE A 9 43.464 35.378 110.989 1.00 11.88 C ATOM 41 O ILE A 9 42.329 35.709 111.342 1.00 11.63 O ATOM 42 CB ILE A 9 45.148 36.932 110.007 1.00 12.91 C ATOM 43 CG1 ILE A 9 44.523 38.127 110.741 1.00 12.77 C ATOM 44 CG2 ILE A 9 45.841 37.383 108.724 1.00 13.42 C ATOM 45 CD1 ILE A 9 45.534 39.176 111.222 1.00 13.90 C ATOM 0 H ILE A 9 42.649 37.121 109.032 1.00 12.03 H new ATOM 0 HA ILE A 9 44.433 35.115 109.205 1.00 12.21 H new ATOM 0 HB ILE A 9 45.812 36.532 110.591 1.00 12.91 H new ATOM 0 HG12 ILE A 9 43.884 38.557 110.151 1.00 12.77 H new ATOM 0 HG13 ILE A 9 44.026 37.798 111.506 1.00 12.77 H new ATOM 0 HG21 ILE A 9 46.521 38.041 108.937 1.00 13.42 H new ATOM 0 HG22 ILE A 9 46.255 36.619 108.293 1.00 13.42 H new ATOM 0 HG23 ILE A 9 45.188 37.777 108.125 1.00 13.42 H new ATOM 0 HD11 ILE A 9 45.065 39.895 111.673 1.00 13.90 H new ATOM 0 HD12 ILE A 9 46.161 38.764 111.837 1.00 13.90 H new ATOM 0 HD13 ILE A 9 46.017 39.534 110.460 1.00 13.90 H new ATOM 46 N ASN A 10 44.243 34.569 111.701 1.00 11.75 N ATOM 47 CA ASN A 10 43.843 34.040 113.002 1.00 11.41 C ATOM 48 C ASN A 10 42.508 33.304 112.956 1.00 11.65 C ATOM 49 O ASN A 10 41.669 33.469 113.842 1.00 12.40 O ATOM 50 CB ASN A 10 43.761 35.187 114.017 1.00 12.03 C ATOM 51 CG ASN A 10 45.080 35.933 114.169 1.00 12.09 C ATOM 52 OD1 ASN A 10 46.183 35.201 114.118 1.00 14.01 O flip ATOM 53 ND2 ASN A 10 45.098 37.157 114.340 1.00 10.32 N flip ATOM 0 H ASN A 10 45.021 34.310 111.442 1.00 11.75 H new ATOM 0 HA ASN A 10 44.516 33.395 113.269 1.00 11.41 H new ATOM 0 HB2 ASN A 10 43.071 35.810 113.740 1.00 12.03 H new ATOM 0 HB3 ASN A 10 43.493 34.832 114.879 1.00 12.03 H new ATOM 0 HD21 ASN A 10 44.360 37.598 114.367 1.00 10.32 H new ATOM 0 HD22 ASN A 10 45.848 37.567 114.432 1.00 10.32 H new ATOM 54 N ALA A 11 42.335 32.475 111.937 1.00 11.30 N ATOM 55 CA ALA A 11 41.101 31.726 111.770 1.00 11.36 C ATOM 56 C ALA A 11 41.179 30.304 112.288 1.00 12.17 C ATOM 57 O ALA A 11 42.189 29.623 112.117 1.00 12.17 O ATOM 58 CB ALA A 11 40.735 31.687 110.300 1.00 11.27 C ATOM 0 H ALA A 11 42.925 32.332 111.328 1.00 11.30 H new ATOM 0 HA ALA A 11 40.427 32.185 112.295 1.00 11.36 H new ATOM 0 HB1 ALA A 11 39.911 31.188 110.185 1.00 11.27 H new ATOM 0 HB2 ALA A 11 40.613 32.592 109.973 1.00 11.27 H new ATOM 0 HB3 ALA A 11 41.446 31.256 109.801 1.00 11.27 H new ATOM 59 N ARG A 12 40.108 29.865 112.942 1.00 12.15 N ATOM 60 CA ARG A 12 40.010 28.484 113.388 1.00 11.79 C ATOM 61 C ARG A 12 39.149 27.835 112.310 1.00 10.13 C ATOM 62 O ARG A 12 38.301 28.498 111.709 1.00 10.99 O ATOM 63 CB ARG A 12 39.315 28.371 114.746 1.00 12.03 C ATOM 64 CG ARG A 12 40.156 28.880 115.905 1.00 14.48 C ATOM 65 CD ARG A 12 39.459 28.653 117.233 1.00 18.19 C ATOM 66 NE ARG A 12 40.226 29.208 118.344 1.00 23.71 N ATOM 67 CZ ARG A 12 41.403 28.742 118.749 1.00 25.61 C ATOM 68 NH1 ARG A 12 42.029 29.318 119.768 1.00 27.84 N ATOM 69 NH2 ARG A 12 41.952 27.696 118.145 1.00 27.24 N ATOM 0 H ARG A 12 39.427 30.353 113.137 1.00 12.15 H new ATOM 0 HA ARG A 12 40.881 28.072 113.503 1.00 11.79 H new ATOM 0 HB2 ARG A 12 38.483 28.869 114.717 1.00 12.03 H new ATOM 0 HB3 ARG A 12 39.085 27.442 114.907 1.00 12.03 H new ATOM 0 HG2 ARG A 12 41.015 28.429 115.907 1.00 14.48 H new ATOM 0 HG3 ARG A 12 40.333 29.826 115.788 1.00 14.48 H new ATOM 0 HD2 ARG A 12 38.579 29.060 117.211 1.00 18.19 H new ATOM 0 HD3 ARG A 12 39.328 27.702 117.372 1.00 18.19 H new ATOM 0 HE ARG A 12 39.894 29.881 118.764 1.00 23.71 H new ATOM 0 HH11 ARG A 12 41.673 29.992 120.166 1.00 27.84 H new ATOM 0 HH12 ARG A 12 42.791 29.017 120.030 1.00 27.84 H new ATOM 0 HH21 ARG A 12 41.546 27.317 117.489 1.00 27.24 H new ATOM 0 HH22 ARG A 12 42.714 27.397 118.410 1.00 27.24 H new ATOM 70 N LEU A 13 39.376 26.553 112.045 1.00 10.07 N ATOM 71 CA LEU A 13 38.616 25.818 111.034 1.00 10.35 C ATOM 72 C LEU A 13 38.070 24.551 111.678 1.00 10.37 C ATOM 73 O LEU A 13 38.772 23.893 112.443 1.00 11.59 O ATOM 74 CB LEU A 13 39.517 25.422 109.859 1.00 10.39 C ATOM 75 CG LEU A 13 40.186 26.557 109.085 1.00 10.15 C ATOM 76 CD1 LEU A 13 41.223 25.984 108.128 1.00 12.01 C ATOM 77 CD2 LEU A 13 39.133 27.363 108.337 1.00 11.82 C ATOM 0 H LEU A 13 39.975 26.083 112.445 1.00 10.07 H new ATOM 0 HA LEU A 13 37.899 26.381 110.701 1.00 10.35 H new ATOM 0 HB2 LEU A 13 40.213 24.836 110.197 1.00 10.39 H new ATOM 0 HB3 LEU A 13 38.987 24.902 109.234 1.00 10.39 H new ATOM 0 HG LEU A 13 40.638 27.152 109.703 1.00 10.15 H new ATOM 0 HD11 LEU A 13 41.646 26.707 107.638 1.00 12.01 H new ATOM 0 HD12 LEU A 13 41.895 25.499 108.632 1.00 12.01 H new ATOM 0 HD13 LEU A 13 40.789 25.381 107.504 1.00 12.01 H new ATOM 0 HD21 LEU A 13 39.563 28.082 107.848 1.00 11.82 H new ATOM 0 HD22 LEU A 13 38.664 26.785 107.716 1.00 11.82 H new ATOM 0 HD23 LEU A 13 38.501 27.737 108.971 1.00 11.82 H new ATOM 78 N PRO A 14 36.813 24.184 111.375 1.00 9.54 N ATOM 79 CA PRO A 14 36.253 22.964 111.973 1.00 10.86 C ATOM 80 C PRO A 14 37.119 21.744 111.676 1.00 11.97 C ATOM 81 O PRO A 14 37.616 21.585 110.565 1.00 13.65 O ATOM 82 CB PRO A 14 34.884 22.845 111.306 1.00 10.94 C ATOM 83 CG PRO A 14 34.501 24.269 111.082 1.00 10.20 C ATOM 84 CD PRO A 14 35.799 24.884 110.566 1.00 10.51 C ATOM 0 HA PRO A 14 36.204 23.008 112.941 1.00 10.86 H new ATOM 0 HB2 PRO A 14 34.931 22.350 110.473 1.00 10.94 H new ATOM 0 HB3 PRO A 14 34.246 22.386 111.874 1.00 10.94 H new ATOM 0 HG2 PRO A 14 33.781 24.352 110.437 1.00 10.20 H new ATOM 0 HG3 PRO A 14 34.200 24.695 111.900 1.00 10.20 H new ATOM 0 HD2 PRO A 14 35.922 24.729 109.616 1.00 10.51 H new ATOM 0 HD3 PRO A 14 35.825 25.844 110.702 1.00 10.51 H new ATOM 85 N GLY A 15 37.293 20.888 112.679 1.00 14.41 N ATOM 86 CA GLY A 15 38.082 19.680 112.493 1.00 15.79 C ATOM 87 C GLY A 15 39.587 19.859 112.389 1.00 16.63 C ATOM 88 O GLY A 15 40.318 18.873 112.258 1.00 18.97 O ATOM 0 H GLY A 15 36.965 20.989 113.468 1.00 14.41 H new ATOM 0 HA2 GLY A 15 37.899 19.081 113.234 1.00 15.79 H new ATOM 0 HA3 GLY A 15 37.773 19.237 111.687 1.00 15.79 H new ATOM 89 N GLU A 16 40.059 21.100 112.442 1.00 15.69 N ATOM 90 CA GLU A 16 41.495 21.366 112.352 1.00 16.78 C ATOM 91 C GLU A 16 42.020 21.943 113.655 1.00 16.42 C ATOM 92 O GLU A 16 41.293 22.609 114.389 1.00 17.15 O ATOM 93 CB GLU A 16 41.796 22.373 111.237 1.00 17.59 C ATOM 94 CG GLU A 16 41.410 21.956 109.832 1.00 19.07 C ATOM 95 CD GLU A 16 42.154 20.728 109.341 1.00 21.65 C ATOM 96 OE1 GLU A 16 43.321 20.521 109.734 1.00 21.02 O ATOM 97 OE2 GLU A 16 41.573 19.973 108.536 1.00 22.97 O ATOM 0 H GLU A 16 39.569 21.801 112.529 1.00 15.69 H new ATOM 0 HA GLU A 16 41.930 20.520 112.162 1.00 16.78 H new ATOM 0 HB2 GLU A 16 41.338 23.203 111.445 1.00 17.59 H new ATOM 0 HB3 GLU A 16 42.747 22.563 111.247 1.00 17.59 H new ATOM 0 HG2 GLU A 16 40.456 21.780 109.805 1.00 19.07 H new ATOM 0 HG3 GLU A 16 41.580 22.693 109.225 1.00 19.07 H new ATOM 98 N GLU A 17 43.295 21.696 113.932 1.00 17.34 N ATOM 99 CA GLU A 17 43.928 22.228 115.126 1.00 18.21 C ATOM 100 C GLU A 17 44.560 23.573 114.777 1.00 16.63 C ATOM 101 O GLU A 17 44.839 23.850 113.611 1.00 16.67 O ATOM 102 CB GLU A 17 45.033 21.284 115.616 1.00 21.06 C ATOM 103 CG GLU A 17 44.558 19.888 115.979 1.00 26.99 C ATOM 104 CD GLU A 17 43.528 19.905 117.086 1.00 30.14 C ATOM 105 OE1 GLU A 17 43.813 20.496 118.150 1.00 33.22 O ATOM 106 OE2 GLU A 17 42.435 19.330 116.894 1.00 33.26 O ATOM 0 H GLU A 17 43.812 21.219 113.437 1.00 17.34 H new ATOM 0 HA GLU A 17 43.261 22.324 115.824 1.00 18.21 H new ATOM 0 HB2 GLU A 17 45.711 21.213 114.926 1.00 21.06 H new ATOM 0 HB3 GLU A 17 45.459 21.680 116.392 1.00 21.06 H new ATOM 0 HG2 GLU A 17 44.179 19.463 115.194 1.00 26.99 H new ATOM 0 HG3 GLU A 17 45.317 19.351 116.254 1.00 26.99 H new ATOM 107 N GLY A 18 44.771 24.402 115.792 1.00 16.59 N ATOM 108 CA GLY A 18 45.427 25.685 115.598 1.00 15.46 C ATOM 109 C GLY A 18 44.744 26.778 114.799 1.00 15.59 C ATOM 110 O GLY A 18 43.527 26.762 114.575 1.00 15.47 O ATOM 0 H GLY A 18 44.540 24.238 116.604 1.00 16.59 H new ATOM 0 HA2 GLY A 18 45.616 26.047 116.478 1.00 15.46 H new ATOM 0 HA3 GLY A 18 46.282 25.510 115.174 1.00 15.46 H new ATOM 111 N LEU A 19 45.556 27.743 114.378 1.00 14.56 N ATOM 112 CA LEU A 19 45.088 28.888 113.607 1.00 13.22 C ATOM 113 C LEU A 19 45.558 28.837 112.161 1.00 13.35 C ATOM 114 O LEU A 19 46.601 28.242 111.844 1.00 14.57 O ATOM 115 CB LEU A 19 45.554 30.188 114.259 1.00 12.20 C ATOM 116 CG LEU A 19 45.071 30.404 115.696 1.00 12.29 C ATOM 117 CD1 LEU A 19 45.680 31.687 116.246 1.00 14.45 C ATOM 118 CD2 LEU A 19 43.541 30.482 115.735 1.00 12.58 C ATOM 0 H LEU A 19 46.402 27.751 114.534 1.00 14.56 H new ATOM 0 HA LEU A 19 44.119 28.855 113.601 1.00 13.22 H new ATOM 0 HB2 LEU A 19 46.524 30.207 114.252 1.00 12.20 H new ATOM 0 HB3 LEU A 19 45.252 30.932 113.716 1.00 12.20 H new ATOM 0 HG LEU A 19 45.353 29.656 116.245 1.00 12.29 H new ATOM 0 HD11 LEU A 19 45.375 31.826 117.156 1.00 14.45 H new ATOM 0 HD12 LEU A 19 46.647 31.616 116.237 1.00 14.45 H new ATOM 0 HD13 LEU A 19 45.406 32.437 115.696 1.00 14.45 H new ATOM 0 HD21 LEU A 19 43.247 30.619 116.649 1.00 12.58 H new ATOM 0 HD22 LEU A 19 43.240 31.222 115.185 1.00 12.58 H new ATOM 0 HD23 LEU A 19 43.166 29.654 115.396 1.00 12.58 H new ATOM 119 N TRP A 20 44.788 29.489 111.295 1.00 12.56 N ATOM 120 CA TRP A 20 45.039 29.496 109.868 1.00 11.91 C ATOM 121 C TRP A 20 44.878 30.855 109.210 1.00 12.75 C ATOM 122 O TRP A 20 44.110 31.701 109.670 1.00 11.92 O ATOM 123 CB TRP A 20 44.090 28.500 109.192 1.00 13.34 C ATOM 124 CG TRP A 20 44.214 27.121 109.751 1.00 13.58 C ATOM 125 CD1 TRP A 20 43.734 26.671 110.948 1.00 14.22 C ATOM 126 CD2 TRP A 20 44.941 26.033 109.174 1.00 14.40 C ATOM 127 NE1 TRP A 20 44.127 25.367 111.158 1.00 14.76 N ATOM 128 CE2 TRP A 20 44.868 24.951 110.083 1.00 15.41 C ATOM 129 CE3 TRP A 20 45.652 25.866 107.978 1.00 15.88 C ATOM 130 CZ2 TRP A 20 45.480 23.719 109.832 1.00 16.43 C ATOM 131 CZ3 TRP A 20 46.263 24.636 107.728 1.00 17.60 C ATOM 132 CH2 TRP A 20 46.171 23.581 108.654 1.00 18.30 C ATOM 0 H TRP A 20 44.097 29.945 111.528 1.00 12.56 H new ATOM 0 HA TRP A 20 45.969 29.247 109.754 1.00 11.91 H new ATOM 0 HB2 TRP A 20 43.176 28.807 109.297 1.00 13.34 H new ATOM 0 HB3 TRP A 20 44.274 28.477 108.240 1.00 13.34 H new ATOM 0 HD1 TRP A 20 43.217 27.172 111.536 1.00 14.22 H new ATOM 0 HE1 TRP A 20 43.938 24.892 111.850 1.00 14.76 H new ATOM 0 HE3 TRP A 20 45.716 26.561 107.363 1.00 15.88 H new ATOM 0 HZ2 TRP A 20 45.421 23.019 110.441 1.00 16.43 H new ATOM 0 HZ3 TRP A 20 46.738 24.512 106.938 1.00 17.60 H new ATOM 0 HH2 TRP A 20 46.588 22.772 108.464 1.00 18.30 H new ATOM 133 N GLN A 21 45.610 31.042 108.117 1.00 13.60 N ATOM 134 CA GLN A 21 45.568 32.272 107.340 1.00 14.54 C ATOM 135 C GLN A 21 44.994 31.912 105.968 1.00 13.97 C ATOM 136 O GLN A 21 45.411 30.926 105.349 1.00 14.35 O ATOM 137 CB GLN A 21 46.989 32.839 107.211 1.00 17.02 C ATOM 138 CG GLN A 21 47.066 34.249 106.676 1.00 21.93 C ATOM 139 CD GLN A 21 48.467 34.833 106.780 1.00 22.50 C ATOM 140 OE1 GLN A 21 48.682 36.005 106.480 1.00 27.14 O ATOM 141 NE2 GLN A 21 49.426 34.012 107.205 1.00 25.07 N ATOM 0 H GLN A 21 46.150 30.451 107.803 1.00 13.60 H new ATOM 0 HA GLN A 21 45.017 32.948 107.765 1.00 14.54 H new ATOM 0 HB2 GLN A 21 47.413 32.814 108.083 1.00 17.02 H new ATOM 0 HB3 GLN A 21 47.503 32.258 106.629 1.00 17.02 H new ATOM 0 HG2 GLN A 21 46.783 34.256 105.748 1.00 21.93 H new ATOM 0 HG3 GLN A 21 46.446 34.812 107.166 1.00 21.93 H new ATOM 0 HE21 GLN A 21 49.237 33.197 107.406 1.00 25.07 H new ATOM 0 HE22 GLN A 21 50.234 34.297 107.279 1.00 25.07 H new ATOM 142 N ILE A 22 44.023 32.695 105.503 1.00 13.74 N ATOM 143 CA ILE A 22 43.390 32.449 104.210 1.00 13.69 C ATOM 144 C ILE A 22 43.733 33.620 103.294 1.00 13.71 C ATOM 145 O ILE A 22 43.282 34.742 103.511 1.00 14.33 O ATOM 146 CB ILE A 22 41.852 32.331 104.359 1.00 12.63 C ATOM 147 CG1 ILE A 22 41.515 31.220 105.362 1.00 13.22 C ATOM 148 CG2 ILE A 22 41.216 32.052 103.007 1.00 13.64 C ATOM 149 CD1 ILE A 22 40.050 31.206 105.791 1.00 13.50 C ATOM 0 H ILE A 22 43.715 33.378 105.924 1.00 13.74 H new ATOM 0 HA ILE A 22 43.715 31.613 103.840 1.00 13.69 H new ATOM 0 HB ILE A 22 41.495 33.169 104.693 1.00 12.63 H new ATOM 0 HG12 ILE A 22 41.737 30.362 104.969 1.00 13.22 H new ATOM 0 HG13 ILE A 22 42.073 31.325 106.148 1.00 13.22 H new ATOM 0 HG21 ILE A 22 40.254 31.980 103.110 1.00 13.64 H new ATOM 0 HG22 ILE A 22 41.422 32.777 102.397 1.00 13.64 H new ATOM 0 HG23 ILE A 22 41.566 31.221 102.650 1.00 13.64 H new ATOM 0 HD11 ILE A 22 39.904 30.484 106.422 1.00 13.50 H new ATOM 0 HD12 ILE A 22 39.827 32.052 106.211 1.00 13.50 H new ATOM 0 HD13 ILE A 22 39.486 31.074 105.013 1.00 13.50 H new ATOM 150 N HIS A 23 44.551 33.345 102.284 1.00 14.77 N ATOM 151 CA HIS A 23 44.979 34.364 101.332 1.00 16.39 C ATOM 152 C HIS A 23 43.950 34.536 100.223 1.00 16.59 C ATOM 153 O HIS A 23 43.469 33.553 99.650 1.00 17.08 O ATOM 154 CB HIS A 23 46.335 33.976 100.741 1.00 18.29 C ATOM 155 CG HIS A 23 47.399 33.781 101.775 1.00 20.19 C ATOM 156 ND1 HIS A 23 47.976 34.832 102.457 1.00 21.80 N ATOM 157 CD2 HIS A 23 47.959 32.655 102.275 1.00 21.15 C ATOM 158 CE1 HIS A 23 48.845 34.360 103.333 1.00 21.60 C ATOM 159 NE2 HIS A 23 48.854 33.042 103.243 1.00 22.52 N ATOM 0 H HIS A 23 44.874 32.563 102.131 1.00 14.77 H new ATOM 0 HA HIS A 23 45.062 35.211 101.798 1.00 16.39 H new ATOM 0 HB2 HIS A 23 46.236 33.157 100.230 1.00 18.29 H new ATOM 0 HB3 HIS A 23 46.619 34.665 100.120 1.00 18.29 H new ATOM 0 HD2 HIS A 23 47.773 31.782 102.012 1.00 21.15 H new ATOM 0 HE1 HIS A 23 49.363 34.869 103.914 1.00 21.60 H new ATOM 0 HE2 HIS A 23 49.341 32.512 103.714 1.00 22.52 H new ATOM 160 N LEU A 24 43.628 35.793 99.924 1.00 17.00 N ATOM 161 CA LEU A 24 42.639 36.126 98.906 1.00 17.75 C ATOM 162 C LEU A 24 43.250 36.865 97.720 1.00 18.62 C ATOM 163 O LEU A 24 44.109 37.734 97.890 1.00 19.72 O ATOM 164 CB LEU A 24 41.541 37.005 99.517 1.00 17.08 C ATOM 165 CG LEU A 24 40.940 36.530 100.843 1.00 17.71 C ATOM 166 CD1 LEU A 24 39.896 37.530 101.309 1.00 18.28 C ATOM 167 CD2 LEU A 24 40.328 35.145 100.670 1.00 16.99 C ATOM 0 H LEU A 24 43.979 36.478 100.308 1.00 17.00 H new ATOM 0 HA LEU A 24 42.272 35.288 98.584 1.00 17.75 H new ATOM 0 HB2 LEU A 24 41.904 37.895 99.650 1.00 17.08 H new ATOM 0 HB3 LEU A 24 40.823 37.086 98.870 1.00 17.08 H new ATOM 0 HG LEU A 24 41.636 36.470 101.516 1.00 17.71 H new ATOM 0 HD11 LEU A 24 39.514 37.231 102.149 1.00 18.28 H new ATOM 0 HD12 LEU A 24 40.312 38.398 101.434 1.00 18.28 H new ATOM 0 HD13 LEU A 24 39.195 37.601 100.642 1.00 18.28 H new ATOM 0 HD21 LEU A 24 39.950 34.851 101.513 1.00 16.99 H new ATOM 0 HD22 LEU A 24 39.630 35.181 99.998 1.00 16.99 H new ATOM 0 HD23 LEU A 24 41.015 34.520 100.389 1.00 16.99 H new ATOM 168 N GLN A 25 42.790 36.522 96.525 1.00 19.40 N ATOM 169 CA GLN A 25 43.273 37.158 95.307 1.00 21.60 C ATOM 170 C GLN A 25 42.202 37.101 94.227 1.00 21.16 C ATOM 171 O GLN A 25 41.655 36.036 93.944 1.00 19.76 O ATOM 172 CB GLN A 25 44.538 36.455 94.811 1.00 23.52 C ATOM 173 CG GLN A 25 45.127 37.052 93.543 1.00 29.39 C ATOM 174 CD GLN A 25 45.654 38.455 93.751 1.00 31.76 C ATOM 175 OE1 GLN A 25 46.534 38.682 94.584 1.00 35.12 O ATOM 176 NE2 GLN A 25 45.120 39.409 92.992 1.00 33.99 N ATOM 0 H GLN A 25 42.192 35.917 96.397 1.00 19.40 H new ATOM 0 HA GLN A 25 43.480 38.085 95.503 1.00 21.60 H new ATOM 0 HB2 GLN A 25 45.208 36.485 95.512 1.00 23.52 H new ATOM 0 HB3 GLN A 25 44.335 35.520 94.652 1.00 23.52 H new ATOM 0 HG2 GLN A 25 45.846 36.484 93.226 1.00 29.39 H new ATOM 0 HG3 GLN A 25 44.449 37.064 92.850 1.00 29.39 H new ATOM 0 HE21 GLN A 25 44.508 39.212 92.421 1.00 33.99 H new ATOM 0 HE22 GLN A 25 45.387 40.222 93.072 1.00 33.99 H new ATOM 177 N ASP A 26 41.901 38.252 93.631 1.00 21.56 N ATOM 178 CA ASP A 26 40.911 38.333 92.562 1.00 21.76 C ATOM 179 C ASP A 26 39.546 37.739 92.926 1.00 20.75 C ATOM 180 O ASP A 26 38.910 37.082 92.098 1.00 20.19 O ATOM 181 CB ASP A 26 41.454 37.638 91.309 1.00 24.50 C ATOM 182 CG ASP A 26 42.706 38.307 90.762 1.00 27.21 C ATOM 183 OD1 ASP A 26 43.425 37.664 89.969 1.00 29.31 O ATOM 184 OD2 ASP A 26 42.967 39.475 91.116 1.00 28.64 O ATOM 0 H ASP A 26 42.264 39.005 93.834 1.00 21.56 H new ATOM 0 HA ASP A 26 40.761 39.278 92.401 1.00 21.76 H new ATOM 0 HB2 ASP A 26 41.652 36.712 91.518 1.00 24.50 H new ATOM 0 HB3 ASP A 26 40.768 37.634 90.623 1.00 24.50 H new ATOM 185 N GLY A 27 39.109 37.974 94.161 1.00 19.84 N ATOM 186 CA GLY A 27 37.815 37.479 94.609 1.00 18.97 C ATOM 187 C GLY A 27 37.760 35.999 94.932 1.00 18.10 C ATOM 188 O GLY A 27 36.684 35.456 95.200 1.00 16.48 O ATOM 0 H GLY A 27 39.548 38.418 94.753 1.00 19.84 H new ATOM 0 HA2 GLY A 27 37.551 37.977 95.399 1.00 18.97 H new ATOM 0 HA3 GLY A 27 37.158 37.669 93.921 1.00 18.97 H new ATOM 189 N LYS A 28 38.914 35.344 94.908 1.00 16.98 N ATOM 190 CA LYS A 28 39.000 33.918 95.198 1.00 17.89 C ATOM 191 C LYS A 28 39.985 33.644 96.323 1.00 16.97 C ATOM 192 O LYS A 28 40.726 34.531 96.744 1.00 17.35 O ATOM 193 CB LYS A 28 39.456 33.153 93.953 1.00 19.74 C ATOM 194 CG LYS A 28 38.462 33.179 92.808 1.00 23.13 C ATOM 195 CD LYS A 28 39.000 32.441 91.593 1.00 26.55 C ATOM 196 CE LYS A 28 37.941 32.342 90.507 1.00 28.51 C ATOM 197 NZ LYS A 28 37.383 33.678 90.148 1.00 31.49 N ATOM 0 H LYS A 28 39.669 35.713 94.723 1.00 16.98 H new ATOM 0 HA LYS A 28 38.117 33.621 95.469 1.00 17.89 H new ATOM 0 HB2 LYS A 28 40.297 33.527 93.646 1.00 19.74 H new ATOM 0 HB3 LYS A 28 39.628 32.230 94.198 1.00 19.74 H new ATOM 0 HG2 LYS A 28 37.628 32.774 93.092 1.00 23.13 H new ATOM 0 HG3 LYS A 28 38.264 34.098 92.569 1.00 23.13 H new ATOM 0 HD2 LYS A 28 39.780 32.903 91.248 1.00 26.55 H new ATOM 0 HD3 LYS A 28 39.288 31.552 91.851 1.00 26.55 H new ATOM 0 HE2 LYS A 28 38.326 31.930 89.718 1.00 28.51 H new ATOM 0 HE3 LYS A 28 37.223 31.763 90.808 1.00 28.51 H new ATOM 0 HZ1 LYS A 28 36.939 33.618 89.379 1.00 31.49 H new ATOM 0 HZ2 LYS A 28 36.829 33.951 90.789 1.00 31.49 H new ATOM 0 HZ3 LYS A 28 38.047 34.264 90.061 1.00 31.49 H new ATOM 198 N ILE A 29 39.975 32.409 96.814 1.00 16.61 N ATOM 199 CA ILE A 29 40.906 31.989 97.853 1.00 16.29 C ATOM 200 C ILE A 29 42.124 31.462 97.092 1.00 17.11 C ATOM 201 O ILE A 29 42.024 30.501 96.327 1.00 17.55 O ATOM 202 CB ILE A 29 40.306 30.854 98.715 1.00 15.42 C ATOM 203 CG1 ILE A 29 39.078 31.374 99.468 1.00 15.06 C ATOM 204 CG2 ILE A 29 41.357 30.313 99.679 1.00 15.21 C ATOM 205 CD1 ILE A 29 38.291 30.286 100.185 1.00 15.47 C ATOM 0 H ILE A 29 39.431 31.795 96.556 1.00 16.61 H new ATOM 0 HA ILE A 29 41.119 32.718 98.456 1.00 16.29 H new ATOM 0 HB ILE A 29 40.027 30.124 98.140 1.00 15.42 H new ATOM 0 HG12 ILE A 29 39.363 32.036 100.117 1.00 15.06 H new ATOM 0 HG13 ILE A 29 38.492 31.826 98.841 1.00 15.06 H new ATOM 0 HG21 ILE A 29 40.970 29.602 100.214 1.00 15.21 H new ATOM 0 HG22 ILE A 29 42.110 29.965 99.176 1.00 15.21 H new ATOM 0 HG23 ILE A 29 41.660 31.027 100.261 1.00 15.21 H new ATOM 0 HD11 ILE A 29 37.531 30.682 100.639 1.00 15.47 H new ATOM 0 HD12 ILE A 29 37.978 29.634 99.539 1.00 15.47 H new ATOM 0 HD13 ILE A 29 38.863 29.848 100.835 1.00 15.47 H new ATOM 206 N SER A 30 43.270 32.101 97.285 1.00 17.82 N ATOM 207 CA SER A 30 44.477 31.677 96.584 1.00 18.63 C ATOM 208 C SER A 30 45.263 30.598 97.318 1.00 18.75 C ATOM 209 O SER A 30 45.870 29.728 96.689 1.00 20.28 O ATOM 210 CB SER A 30 45.375 32.889 96.313 1.00 18.99 C ATOM 211 OG SER A 30 45.651 33.605 97.502 1.00 21.02 O ATOM 0 H SER A 30 43.372 32.774 97.810 1.00 17.82 H new ATOM 0 HA SER A 30 44.185 31.280 95.748 1.00 18.63 H new ATOM 0 HB2 SER A 30 46.207 32.594 95.911 1.00 18.99 H new ATOM 0 HB3 SER A 30 44.944 33.476 95.673 1.00 18.99 H new ATOM 0 HG SER A 30 46.145 34.261 97.326 1.00 21.02 H new ATOM 212 N ALA A 31 45.247 30.644 98.646 1.00 17.95 N ATOM 213 CA ALA A 31 45.973 29.665 99.442 1.00 17.33 C ATOM 214 C ALA A 31 45.532 29.711 100.895 1.00 16.56 C ATOM 215 O ALA A 31 45.010 30.723 101.369 1.00 16.12 O ATOM 216 CB ALA A 31 47.475 29.931 99.352 1.00 18.23 C ATOM 0 H ALA A 31 44.822 31.234 99.104 1.00 17.95 H new ATOM 0 HA ALA A 31 45.778 28.783 99.089 1.00 17.33 H new ATOM 0 HB1 ALA A 31 47.952 29.276 99.884 1.00 18.23 H new ATOM 0 HB2 ALA A 31 47.761 29.866 98.427 1.00 18.23 H new ATOM 0 HB3 ALA A 31 47.667 30.821 99.687 1.00 18.23 H new ATOM 217 N ILE A 32 45.747 28.604 101.594 1.00 16.21 N ATOM 218 CA ILE A 32 45.402 28.484 103.004 1.00 17.20 C ATOM 219 C ILE A 32 46.649 27.943 103.699 1.00 17.69 C ATOM 220 O ILE A 32 47.143 26.872 103.348 1.00 18.94 O ATOM 221 CB ILE A 32 44.225 27.505 103.198 1.00 17.64 C ATOM 222 CG1 ILE A 32 42.990 28.038 102.462 1.00 17.83 C ATOM 223 CG2 ILE A 32 43.936 27.325 104.682 1.00 17.26 C ATOM 224 CD1 ILE A 32 41.929 26.988 102.209 1.00 19.40 C ATOM 0 H ILE A 32 46.101 27.895 101.260 1.00 16.21 H new ATOM 0 HA ILE A 32 45.127 29.340 103.369 1.00 17.20 H new ATOM 0 HB ILE A 32 44.458 26.639 102.828 1.00 17.64 H new ATOM 0 HG12 ILE A 32 42.601 28.760 102.980 1.00 17.83 H new ATOM 0 HG13 ILE A 32 43.268 28.416 101.613 1.00 17.83 H new ATOM 0 HG21 ILE A 32 43.196 26.709 104.795 1.00 17.26 H new ATOM 0 HG22 ILE A 32 44.723 26.969 105.124 1.00 17.26 H new ATOM 0 HG23 ILE A 32 43.705 28.182 105.073 1.00 17.26 H new ATOM 0 HD11 ILE A 32 41.180 27.391 101.743 1.00 19.40 H new ATOM 0 HD12 ILE A 32 42.302 26.275 101.667 1.00 19.40 H new ATOM 0 HD13 ILE A 32 41.625 26.625 103.055 1.00 19.40 H new ATOM 225 N ASP A 33 47.156 28.688 104.675 1.00 16.24 N ATOM 226 CA ASP A 33 48.367 28.291 105.385 1.00 17.99 C ATOM 227 C ASP A 33 48.200 28.294 106.896 1.00 15.81 C ATOM 228 O ASP A 33 47.588 29.193 107.461 1.00 15.80 O ATOM 229 CB ASP A 33 49.516 29.233 105.012 1.00 21.07 C ATOM 230 CG ASP A 33 49.837 29.206 103.532 1.00 23.99 C ATOM 231 OD1 ASP A 33 50.215 28.132 103.019 1.00 28.09 O ATOM 232 OD2 ASP A 33 49.712 30.262 102.880 1.00 28.17 O ATOM 0 H ASP A 33 46.813 29.430 104.942 1.00 16.24 H new ATOM 0 HA ASP A 33 48.562 27.380 105.115 1.00 17.99 H new ATOM 0 HB2 ASP A 33 49.285 30.138 105.272 1.00 21.07 H new ATOM 0 HB3 ASP A 33 50.308 28.987 105.515 1.00 21.07 H new ATOM 233 N ALA A 34 48.764 27.289 107.552 1.00 15.34 N ATOM 234 CA ALA A 34 48.682 27.207 108.998 1.00 15.12 C ATOM 235 C ALA A 34 49.595 28.245 109.641 1.00 14.74 C ATOM 236 O ALA A 34 50.633 28.616 109.081 1.00 15.37 O ATOM 237 CB ALA A 34 49.074 25.803 109.467 1.00 16.16 C ATOM 0 H ALA A 34 49.197 26.647 107.178 1.00 15.34 H new ATOM 0 HA ALA A 34 47.768 27.387 109.268 1.00 15.12 H new ATOM 0 HB1 ALA A 34 49.017 25.757 110.434 1.00 16.16 H new ATOM 0 HB2 ALA A 34 48.471 25.151 109.076 1.00 16.16 H new ATOM 0 HB3 ALA A 34 49.983 25.610 109.188 1.00 16.16 H new ATOM 238 N GLN A 35 49.182 28.733 110.805 1.00 14.71 N ATOM 239 CA GLN A 35 49.966 29.697 111.573 1.00 14.88 C ATOM 240 C GLN A 35 50.473 28.931 112.793 1.00 16.04 C ATOM 241 O GLN A 35 49.851 27.959 113.220 1.00 17.13 O ATOM 242 CB GLN A 35 49.098 30.864 112.064 1.00 13.54 C ATOM 243 CG GLN A 35 48.399 31.668 110.979 1.00 13.25 C ATOM 244 CD GLN A 35 47.471 32.745 111.535 1.00 12.24 C ATOM 245 OE1 GLN A 35 46.698 33.347 110.788 1.00 12.61 O ATOM 246 NE2 GLN A 35 47.543 32.993 112.841 1.00 12.86 N ATOM 0 H GLN A 35 48.437 28.514 111.174 1.00 14.71 H new ATOM 0 HA GLN A 35 50.676 30.067 111.026 1.00 14.88 H new ATOM 0 HB2 GLN A 35 48.425 30.513 112.668 1.00 13.54 H new ATOM 0 HB3 GLN A 35 49.656 31.466 112.581 1.00 13.54 H new ATOM 0 HG2 GLN A 35 49.067 32.085 110.412 1.00 13.25 H new ATOM 0 HG3 GLN A 35 47.887 31.066 110.417 1.00 13.25 H new ATOM 0 HE21 GLN A 35 48.095 32.553 113.332 1.00 12.86 H new ATOM 0 HE22 GLN A 35 47.038 33.593 113.193 1.00 12.86 H new ATOM 247 N SER A 36 51.597 29.357 113.356 1.00 16.70 N ATOM 248 CA SER A 36 52.123 28.696 114.546 1.00 17.14 C ATOM 249 C SER A 36 51.857 29.575 115.766 1.00 17.87 C ATOM 250 O SER A 36 52.239 29.239 116.886 1.00 19.93 O ATOM 251 CB SER A 36 53.622 28.430 114.398 1.00 18.11 C ATOM 252 OG SER A 36 54.329 29.632 114.160 1.00 18.50 O ATOM 0 H SER A 36 52.066 30.019 113.070 1.00 16.70 H new ATOM 0 HA SER A 36 51.678 27.842 114.659 1.00 17.14 H new ATOM 0 HB2 SER A 36 53.960 28.006 115.202 1.00 18.11 H new ATOM 0 HB3 SER A 36 53.773 27.811 113.666 1.00 18.11 H new ATOM 0 HG SER A 36 54.723 29.584 113.420 1.00 18.50 H new ATOM 253 N GLY A 37 51.181 30.698 115.534 1.00 16.50 N ATOM 254 CA GLY A 37 50.851 31.625 116.603 1.00 15.96 C ATOM 255 C GLY A 37 49.896 32.684 116.086 1.00 14.32 C ATOM 256 O GLY A 37 49.421 32.590 114.951 1.00 15.31 O ATOM 0 H GLY A 37 50.904 30.940 114.756 1.00 16.50 H new ATOM 0 HA2 GLY A 37 50.447 31.147 117.344 1.00 15.96 H new ATOM 0 HA3 GLY A 37 51.658 32.043 116.941 1.00 15.96 H new ATOM 257 N VAL A 38 49.610 33.686 116.910 1.00 14.57 N ATOM 258 CA VAL A 38 48.710 34.766 116.528 1.00 14.59 C ATOM 259 C VAL A 38 49.419 35.788 115.633 1.00 13.70 C ATOM 260 O VAL A 38 50.509 36.264 115.962 1.00 14.67 O ATOM 261 CB VAL A 38 48.153 35.469 117.787 1.00 14.62 C ATOM 262 CG1 VAL A 38 47.300 36.663 117.395 1.00 16.81 C ATOM 263 CG2 VAL A 38 47.321 34.485 118.598 1.00 16.00 C ATOM 0 H VAL A 38 49.932 33.758 117.704 1.00 14.57 H new ATOM 0 HA VAL A 38 47.976 34.378 116.026 1.00 14.59 H new ATOM 0 HB VAL A 38 48.897 35.782 118.324 1.00 14.62 H new ATOM 0 HG11 VAL A 38 46.958 37.093 118.194 1.00 16.81 H new ATOM 0 HG12 VAL A 38 47.839 37.295 116.893 1.00 16.81 H new ATOM 0 HG13 VAL A 38 46.558 36.365 116.846 1.00 16.81 H new ATOM 0 HG21 VAL A 38 46.973 34.929 119.387 1.00 16.00 H new ATOM 0 HG22 VAL A 38 46.583 34.162 118.057 1.00 16.00 H new ATOM 0 HG23 VAL A 38 47.876 33.736 118.867 1.00 16.00 H new ATOM 264 N MET A 39 48.805 36.102 114.495 1.00 12.93 N ATOM 265 CA MET A 39 49.360 37.053 113.530 1.00 12.95 C ATOM 266 C MET A 39 48.912 38.469 113.837 1.00 14.60 C ATOM 267 O MET A 39 47.823 38.687 114.357 1.00 14.38 O ATOM 268 CB MET A 39 48.912 36.696 112.108 1.00 12.64 C ATOM 269 CG MET A 39 49.608 35.504 111.520 1.00 14.29 C ATOM 270 SD MET A 39 51.265 35.982 111.015 1.00 16.09 S ATOM 271 CE MET A 39 51.949 34.400 110.534 1.00 17.10 C ATOM 0 H MET A 39 48.049 35.768 114.258 1.00 12.93 H new ATOM 0 HA MET A 39 50.326 37.002 113.596 1.00 12.95 H new ATOM 0 HB2 MET A 39 47.957 36.529 112.114 1.00 12.64 H new ATOM 0 HB3 MET A 39 49.062 37.462 111.532 1.00 12.64 H new ATOM 0 HG2 MET A 39 49.650 34.786 112.171 1.00 14.29 H new ATOM 0 HG3 MET A 39 49.110 35.167 110.759 1.00 14.29 H new ATOM 0 HE1 MET A 39 52.863 34.520 110.233 1.00 17.10 H new ATOM 0 HE2 MET A 39 51.936 33.797 111.294 1.00 17.10 H new ATOM 0 HE3 MET A 39 51.419 34.024 109.814 1.00 17.10 H new ATOM 272 N PRO A 40 49.761 39.460 113.525 1.00 15.84 N ATOM 273 CA PRO A 40 49.379 40.845 113.790 1.00 16.44 C ATOM 274 C PRO A 40 48.411 41.323 112.718 1.00 17.92 C ATOM 275 O PRO A 40 48.463 40.870 111.575 1.00 18.14 O ATOM 276 CB PRO A 40 50.714 41.581 113.728 1.00 16.87 C ATOM 277 CG PRO A 40 51.443 40.828 112.658 1.00 16.19 C ATOM 278 CD PRO A 40 51.145 39.379 113.024 1.00 16.34 C ATOM 0 HA PRO A 40 48.923 40.983 114.635 1.00 16.44 H new ATOM 0 HB2 PRO A 40 50.601 42.517 113.499 1.00 16.87 H new ATOM 0 HB3 PRO A 40 51.184 41.551 114.576 1.00 16.87 H new ATOM 0 HG2 PRO A 40 51.118 41.052 111.772 1.00 16.19 H new ATOM 0 HG3 PRO A 40 52.395 41.016 112.667 1.00 16.19 H new ATOM 0 HD2 PRO A 40 51.218 38.790 112.257 1.00 16.34 H new ATOM 0 HD3 PRO A 40 51.755 39.043 113.699 1.00 16.34 H new ATOM 279 N ILE A 41 47.524 42.233 113.091 1.00 20.31 N ATOM 280 CA ILE A 41 46.576 42.777 112.137 1.00 22.76 C ATOM 281 C ILE A 41 47.340 43.782 111.281 1.00 23.63 C ATOM 282 O ILE A 41 48.475 44.143 111.598 1.00 22.91 O ATOM 283 CB ILE A 41 45.411 43.490 112.861 1.00 24.35 C ATOM 284 CG1 ILE A 41 44.397 44.026 111.845 1.00 26.06 C ATOM 285 CG2 ILE A 41 45.955 44.627 113.708 1.00 26.13 C ATOM 286 CD1 ILE A 41 43.811 42.974 110.926 1.00 25.85 C ATOM 0 H ILE A 41 47.455 42.547 113.889 1.00 20.31 H new ATOM 0 HA ILE A 41 46.194 42.066 111.599 1.00 22.76 H new ATOM 0 HB ILE A 41 44.960 42.852 113.436 1.00 24.35 H new ATOM 0 HG12 ILE A 41 43.674 44.459 112.325 1.00 26.06 H new ATOM 0 HG13 ILE A 41 44.827 44.707 111.305 1.00 26.06 H new ATOM 0 HG21 ILE A 41 45.222 45.073 114.161 1.00 26.13 H new ATOM 0 HG22 ILE A 41 46.574 44.273 114.366 1.00 26.13 H new ATOM 0 HG23 ILE A 41 46.417 45.262 113.139 1.00 26.13 H new ATOM 0 HD11 ILE A 41 43.182 43.391 110.316 1.00 25.85 H new ATOM 0 HD12 ILE A 41 44.523 42.555 110.418 1.00 25.85 H new ATOM 0 HD13 ILE A 41 43.352 42.302 111.454 1.00 25.85 H new ATOM 287 N THR A 42 46.727 44.207 110.185 1.00 24.04 N ATOM 288 CA THR A 42 47.329 45.180 109.284 1.00 24.81 C ATOM 289 C THR A 42 46.266 45.536 108.257 1.00 26.14 C ATOM 290 O THR A 42 45.253 44.846 108.152 1.00 25.27 O ATOM 291 CB THR A 42 48.575 44.603 108.568 1.00 24.76 C ATOM 292 OG1 THR A 42 49.226 45.643 107.825 1.00 24.69 O ATOM 293 CG2 THR A 42 48.180 43.474 107.618 1.00 25.01 C ATOM 0 H THR A 42 45.947 43.939 109.941 1.00 24.04 H new ATOM 0 HA THR A 42 47.626 45.957 109.784 1.00 24.81 H new ATOM 0 HB THR A 42 49.179 44.248 109.239 1.00 24.76 H new ATOM 0 HG1 THR A 42 49.903 45.330 107.438 1.00 24.69 H new ATOM 0 HG21 THR A 42 48.973 43.127 107.180 1.00 25.01 H new ATOM 0 HG22 THR A 42 47.751 42.764 108.120 1.00 25.01 H new ATOM 0 HG23 THR A 42 47.565 43.814 106.949 1.00 25.01 H new ATOM 294 N GLU A 43 46.482 46.614 107.511 1.00 27.25 N ATOM 295 CA GLU A 43 45.508 47.019 106.508 1.00 29.11 C ATOM 296 C GLU A 43 45.352 45.922 105.458 1.00 28.89 C ATOM 297 O GLU A 43 46.331 45.300 105.045 1.00 29.64 O ATOM 298 CB GLU A 43 45.938 48.328 105.843 1.00 30.98 C ATOM 299 CG GLU A 43 44.870 48.938 104.949 1.00 34.11 C ATOM 300 CD GLU A 43 45.250 50.315 104.438 1.00 36.13 C ATOM 301 OE1 GLU A 43 44.446 50.914 103.689 1.00 37.39 O ATOM 302 OE2 GLU A 43 46.350 50.798 104.785 1.00 37.27 O ATOM 0 H GLU A 43 47.177 47.118 107.569 1.00 27.25 H new ATOM 0 HA GLU A 43 44.654 47.161 106.945 1.00 29.11 H new ATOM 0 HB2 GLU A 43 46.177 48.968 106.531 1.00 30.98 H new ATOM 0 HB3 GLU A 43 46.736 48.167 105.316 1.00 30.98 H new ATOM 0 HG2 GLU A 43 44.711 48.350 104.194 1.00 34.11 H new ATOM 0 HG3 GLU A 43 44.037 48.999 105.442 1.00 34.11 H new ATOM 303 N ASN A 44 44.110 45.691 105.044 1.00 29.06 N ATOM 304 CA ASN A 44 43.774 44.677 104.046 1.00 28.37 C ATOM 305 C ASN A 44 43.680 43.272 104.635 1.00 26.40 C ATOM 306 O ASN A 44 43.506 42.296 103.905 1.00 26.87 O ATOM 307 CB ASN A 44 44.783 44.690 102.895 1.00 30.27 C ATOM 308 CG ASN A 44 44.869 46.041 102.213 1.00 32.15 C ATOM 309 OD1 ASN A 44 43.848 46.645 101.876 1.00 33.27 O ATOM 310 ND2 ASN A 44 46.091 46.520 102.001 1.00 33.04 N ATOM 0 H ASN A 44 43.428 46.125 105.338 1.00 29.06 H new ATOM 0 HA ASN A 44 42.894 44.909 103.709 1.00 28.37 H new ATOM 0 HB2 ASN A 44 45.659 44.446 103.234 1.00 30.27 H new ATOM 0 HB3 ASN A 44 44.533 44.017 102.243 1.00 30.27 H new ATOM 0 HD21 ASN A 44 46.193 47.281 101.614 1.00 33.04 H new ATOM 0 HD22 ASN A 44 46.779 46.069 102.251 1.00 33.04 H new ATOM 311 N SER A 45 43.804 43.173 105.954 1.00 24.88 N ATOM 312 CA SER A 45 43.696 41.888 106.645 1.00 22.34 C ATOM 313 C SER A 45 42.463 41.913 107.537 1.00 20.52 C ATOM 314 O SER A 45 42.284 42.841 108.323 1.00 20.70 O ATOM 315 CB SER A 45 44.927 41.623 107.523 1.00 23.54 C ATOM 316 OG SER A 45 45.996 41.063 106.782 1.00 25.61 O ATOM 0 H SER A 45 43.952 43.843 106.473 1.00 24.88 H new ATOM 0 HA SER A 45 43.632 41.186 105.979 1.00 22.34 H new ATOM 0 HB2 SER A 45 45.217 42.454 107.931 1.00 23.54 H new ATOM 0 HB3 SER A 45 44.685 41.022 108.245 1.00 23.54 H new ATOM 0 HG SER A 45 46.045 41.440 106.033 1.00 25.61 H new ATOM 317 N LEU A 46 41.603 40.907 107.405 1.00 16.91 N ATOM 318 CA LEU A 46 40.416 40.825 108.245 1.00 15.16 C ATOM 319 C LEU A 46 40.802 39.847 109.350 1.00 13.70 C ATOM 320 O LEU A 46 41.147 38.697 109.080 1.00 14.93 O ATOM 321 CB LEU A 46 39.219 40.300 107.445 1.00 15.21 C ATOM 322 CG LEU A 46 37.867 40.352 108.165 1.00 15.46 C ATOM 323 CD1 LEU A 46 37.541 41.780 108.570 1.00 16.83 C ATOM 324 CD2 LEU A 46 36.780 39.811 107.244 1.00 15.11 C ATOM 0 H LEU A 46 41.689 40.266 106.838 1.00 16.91 H new ATOM 0 HA LEU A 46 40.148 41.690 108.594 1.00 15.16 H new ATOM 0 HB2 LEU A 46 39.150 40.812 106.624 1.00 15.21 H new ATOM 0 HB3 LEU A 46 39.398 39.381 107.192 1.00 15.21 H new ATOM 0 HG LEU A 46 37.912 39.806 108.966 1.00 15.46 H new ATOM 0 HD11 LEU A 46 36.684 41.800 109.024 1.00 16.83 H new ATOM 0 HD12 LEU A 46 38.230 42.113 109.166 1.00 16.83 H new ATOM 0 HD13 LEU A 46 37.500 42.340 107.779 1.00 16.83 H new ATOM 0 HD21 LEU A 46 35.924 39.844 107.699 1.00 15.11 H new ATOM 0 HD22 LEU A 46 36.739 40.351 106.440 1.00 15.11 H new ATOM 0 HD23 LEU A 46 36.984 38.893 107.006 1.00 15.11 H new ATOM 325 N ASP A 47 40.755 40.318 110.589 1.00 13.14 N ATOM 326 CA ASP A 47 41.139 39.502 111.733 1.00 13.32 C ATOM 327 C ASP A 47 39.967 38.701 112.277 1.00 12.88 C ATOM 328 O ASP A 47 39.015 39.272 112.803 1.00 14.13 O ATOM 329 CB ASP A 47 41.704 40.410 112.833 1.00 14.22 C ATOM 330 CG ASP A 47 42.444 39.641 113.916 1.00 15.14 C ATOM 331 OD1 ASP A 47 42.989 40.295 114.833 1.00 16.65 O ATOM 332 OD2 ASP A 47 42.498 38.392 113.859 1.00 13.59 O ATOM 0 H ASP A 47 40.501 41.115 110.790 1.00 13.14 H new ATOM 0 HA ASP A 47 41.813 38.869 111.440 1.00 13.32 H new ATOM 0 HB2 ASP A 47 42.306 41.057 112.434 1.00 14.22 H new ATOM 0 HB3 ASP A 47 40.978 40.910 113.237 1.00 14.22 H new ATOM 333 N ALA A 48 40.042 37.380 112.136 1.00 12.73 N ATOM 334 CA ALA A 48 38.990 36.498 112.643 1.00 12.10 C ATOM 335 C ALA A 48 39.086 36.408 114.170 1.00 12.52 C ATOM 336 O ALA A 48 38.200 35.863 114.827 1.00 12.89 O ATOM 337 CB ALA A 48 39.114 35.109 112.013 1.00 12.28 C ATOM 0 H ALA A 48 40.694 36.973 111.750 1.00 12.73 H new ATOM 0 HA ALA A 48 38.124 36.863 112.404 1.00 12.10 H new ATOM 0 HB1 ALA A 48 38.412 34.534 112.356 1.00 12.28 H new ATOM 0 HB2 ALA A 48 39.029 35.182 111.049 1.00 12.28 H new ATOM 0 HB3 ALA A 48 39.979 34.730 112.233 1.00 12.28 H new ATOM 338 N GLU A 49 40.181 36.931 114.727 1.00 12.96 N ATOM 339 CA GLU A 49 40.401 36.958 116.174 1.00 13.90 C ATOM 340 C GLU A 49 40.202 35.616 116.866 1.00 12.65 C ATOM 341 O GLU A 49 39.626 35.535 117.951 1.00 13.72 O ATOM 342 CB GLU A 49 39.498 38.015 116.820 1.00 15.38 C ATOM 343 CG GLU A 49 39.686 39.417 116.245 1.00 19.18 C ATOM 344 CD GLU A 49 38.869 40.467 116.977 1.00 22.33 C ATOM 345 OE1 GLU A 49 37.686 40.202 117.279 1.00 25.90 O ATOM 346 OE2 GLU A 49 39.405 41.562 117.242 1.00 25.90 O ATOM 0 H GLU A 49 40.821 37.282 114.272 1.00 12.96 H new ATOM 0 HA GLU A 49 41.337 37.184 116.295 1.00 13.90 H new ATOM 0 HB2 GLU A 49 38.572 37.750 116.708 1.00 15.38 H new ATOM 0 HB3 GLU A 49 39.673 38.039 117.774 1.00 15.38 H new ATOM 0 HG2 GLU A 49 40.625 39.656 116.287 1.00 19.18 H new ATOM 0 HG3 GLU A 49 39.436 39.414 115.308 1.00 19.18 H new ATOM 347 N GLN A 50 40.705 34.569 116.228 1.00 12.48 N ATOM 348 CA GLN A 50 40.627 33.208 116.739 1.00 12.81 C ATOM 349 C GLN A 50 39.202 32.677 116.780 1.00 13.21 C ATOM 350 O GLN A 50 38.882 31.763 117.543 1.00 14.09 O ATOM 351 CB GLN A 50 41.299 33.117 118.114 1.00 14.01 C ATOM 352 CG GLN A 50 42.750 33.584 118.069 1.00 16.30 C ATOM 353 CD GLN A 50 43.484 33.356 119.370 1.00 18.17 C ATOM 354 OE1 GLN A 50 43.652 32.218 119.812 1.00 20.79 O ATOM 355 NE2 GLN A 50 43.931 34.440 119.991 1.00 19.77 N ATOM 0 H GLN A 50 41.109 34.630 115.471 1.00 12.48 H new ATOM 0 HA GLN A 50 41.108 32.638 116.119 1.00 12.81 H new ATOM 0 HB2 GLN A 50 40.805 33.657 118.751 1.00 14.01 H new ATOM 0 HB3 GLN A 50 41.264 32.201 118.431 1.00 14.01 H new ATOM 0 HG2 GLN A 50 43.213 33.117 117.356 1.00 16.30 H new ATOM 0 HG3 GLN A 50 42.774 34.529 117.851 1.00 16.30 H new ATOM 0 HE21 GLN A 50 43.794 35.218 119.651 1.00 19.77 H new ATOM 0 HE22 GLN A 50 44.358 34.365 120.734 1.00 19.77 H new ATOM 356 N GLY A 51 38.359 33.283 115.946 1.00 12.72 N ATOM 357 CA GLY A 51 36.978 32.860 115.807 1.00 11.93 C ATOM 358 C GLY A 51 36.970 31.798 114.723 1.00 11.66 C ATOM 359 O GLY A 51 37.991 31.515 114.099 1.00 12.43 O ATOM 0 H GLY A 51 38.576 33.949 115.448 1.00 12.72 H new ATOM 0 HA2 GLY A 51 36.638 32.505 116.643 1.00 11.93 H new ATOM 0 HA3 GLY A 51 36.409 33.607 115.565 1.00 11.93 H new ATOM 360 N LEU A 52 35.801 31.229 114.467 1.00 10.52 N ATOM 361 CA LEU A 52 35.654 30.162 113.496 1.00 9.99 C ATOM 362 C LEU A 52 35.296 30.677 112.105 1.00 9.50 C ATOM 363 O LEU A 52 34.369 31.475 111.953 1.00 11.40 O ATOM 364 CB LEU A 52 34.566 29.216 114.005 1.00 11.42 C ATOM 365 CG LEU A 52 34.471 27.802 113.450 1.00 10.64 C ATOM 366 CD1 LEU A 52 35.662 26.964 113.897 1.00 11.53 C ATOM 367 CD2 LEU A 52 33.169 27.186 113.949 1.00 11.05 C ATOM 0 H LEU A 52 35.067 31.454 114.855 1.00 10.52 H new ATOM 0 HA LEU A 52 36.504 29.704 113.405 1.00 9.99 H new ATOM 0 HB2 LEU A 52 34.673 29.143 114.966 1.00 11.42 H new ATOM 0 HB3 LEU A 52 33.711 29.647 113.847 1.00 11.42 H new ATOM 0 HG LEU A 52 34.481 27.827 112.480 1.00 10.64 H new ATOM 0 HD11 LEU A 52 35.582 26.068 113.533 1.00 11.53 H new ATOM 0 HD12 LEU A 52 36.482 27.371 113.577 1.00 11.53 H new ATOM 0 HD13 LEU A 52 35.681 26.919 114.866 1.00 11.53 H new ATOM 0 HD21 LEU A 52 33.086 26.282 113.607 1.00 11.05 H new ATOM 0 HD22 LEU A 52 33.171 27.165 114.919 1.00 11.05 H new ATOM 0 HD23 LEU A 52 32.419 27.718 113.639 1.00 11.05 H new ATOM 368 N VAL A 53 36.031 30.223 111.096 1.00 8.81 N ATOM 369 CA VAL A 53 35.765 30.614 109.718 1.00 9.61 C ATOM 370 C VAL A 53 35.218 29.406 108.989 1.00 8.75 C ATOM 371 O VAL A 53 35.820 28.332 108.986 1.00 10.02 O ATOM 372 CB VAL A 53 37.040 31.115 108.998 1.00 9.97 C ATOM 373 CG1 VAL A 53 36.733 31.397 107.522 1.00 12.71 C ATOM 374 CG2 VAL A 53 37.540 32.383 109.667 1.00 12.97 C ATOM 0 H VAL A 53 36.694 29.683 111.190 1.00 8.81 H new ATOM 0 HA VAL A 53 35.129 31.346 109.719 1.00 9.61 H new ATOM 0 HB VAL A 53 37.725 30.430 109.054 1.00 9.97 H new ATOM 0 HG11 VAL A 53 37.537 31.710 107.078 1.00 12.71 H new ATOM 0 HG12 VAL A 53 36.424 30.583 107.094 1.00 12.71 H new ATOM 0 HG13 VAL A 53 36.044 32.076 107.459 1.00 12.71 H new ATOM 0 HG21 VAL A 53 38.339 32.695 109.214 1.00 12.97 H new ATOM 0 HG22 VAL A 53 36.854 33.067 109.619 1.00 12.97 H new ATOM 0 HG23 VAL A 53 37.747 32.199 110.597 1.00 12.97 H new ATOM 375 N ILE A 54 34.058 29.596 108.369 1.00 8.59 N ATOM 376 CA ILE A 54 33.381 28.538 107.640 1.00 8.18 C ATOM 377 C ILE A 54 32.783 29.070 106.347 1.00 7.61 C ATOM 378 O ILE A 54 32.650 30.289 106.163 1.00 8.32 O ATOM 379 CB ILE A 54 32.210 27.955 108.489 1.00 7.55 C ATOM 380 CG1 ILE A 54 31.294 29.084 108.992 1.00 8.36 C ATOM 381 CG2 ILE A 54 32.768 27.148 109.649 1.00 9.12 C ATOM 382 CD1 ILE A 54 30.005 28.595 109.674 1.00 10.24 C ATOM 0 H ILE A 54 33.641 30.348 108.361 1.00 8.59 H new ATOM 0 HA ILE A 54 34.040 27.853 107.449 1.00 8.18 H new ATOM 0 HB ILE A 54 31.677 27.367 107.932 1.00 7.55 H new ATOM 0 HG12 ILE A 54 31.790 29.634 109.618 1.00 8.36 H new ATOM 0 HG13 ILE A 54 31.056 29.652 108.242 1.00 8.36 H new ATOM 0 HG21 ILE A 54 32.036 26.787 110.174 1.00 9.12 H new ATOM 0 HG22 ILE A 54 33.309 26.420 109.306 1.00 9.12 H new ATOM 0 HG23 ILE A 54 33.315 27.721 110.208 1.00 9.12 H new ATOM 0 HD11 ILE A 54 29.482 29.359 109.963 1.00 10.24 H new ATOM 0 HD12 ILE A 54 29.487 28.067 109.046 1.00 10.24 H new ATOM 0 HD13 ILE A 54 30.233 28.050 110.443 1.00 10.24 H new ATOM 383 N PRO A 55 32.466 28.167 105.408 1.00 7.94 N ATOM 384 CA PRO A 55 31.848 28.658 104.173 1.00 8.03 C ATOM 385 C PRO A 55 30.467 29.183 104.647 1.00 8.11 C ATOM 386 O PRO A 55 30.021 28.882 105.759 1.00 7.71 O ATOM 387 CB PRO A 55 31.788 27.416 103.282 1.00 8.55 C ATOM 388 CG PRO A 55 31.760 26.278 104.258 1.00 8.41 C ATOM 389 CD PRO A 55 32.682 26.710 105.372 1.00 7.98 C ATOM 0 HA PRO A 55 32.292 29.365 103.679 1.00 8.03 H new ATOM 0 HB2 PRO A 55 30.999 27.420 102.717 1.00 8.55 H new ATOM 0 HB3 PRO A 55 32.558 27.362 102.694 1.00 8.55 H new ATOM 0 HG2 PRO A 55 30.862 26.117 104.586 1.00 8.41 H new ATOM 0 HG3 PRO A 55 32.065 25.454 103.848 1.00 8.41 H new ATOM 0 HD2 PRO A 55 32.453 26.289 106.215 1.00 7.98 H new ATOM 0 HD3 PRO A 55 33.607 26.485 105.184 1.00 7.98 H new ATOM 390 N PRO A 56 29.763 29.945 103.810 1.00 7.82 N ATOM 391 CA PRO A 56 28.468 30.499 104.223 1.00 7.35 C ATOM 392 C PRO A 56 27.376 29.550 104.674 1.00 7.09 C ATOM 393 O PRO A 56 27.302 28.409 104.228 1.00 6.76 O ATOM 394 CB PRO A 56 28.011 31.288 102.993 1.00 7.85 C ATOM 395 CG PRO A 56 29.288 31.528 102.211 1.00 7.51 C ATOM 396 CD PRO A 56 30.041 30.246 102.396 1.00 7.92 C ATOM 0 HA PRO A 56 28.610 31.005 105.038 1.00 7.35 H new ATOM 0 HB2 PRO A 56 27.364 30.788 102.471 1.00 7.85 H new ATOM 0 HB3 PRO A 56 27.587 32.123 103.245 1.00 7.85 H new ATOM 0 HG2 PRO A 56 29.108 31.707 101.275 1.00 7.51 H new ATOM 0 HG3 PRO A 56 29.783 32.288 102.555 1.00 7.51 H new ATOM 0 HD2 PRO A 56 29.722 29.547 101.804 1.00 7.92 H new ATOM 0 HD3 PRO A 56 30.990 30.352 102.225 1.00 7.92 H new ATOM 397 N PHE A 57 26.521 30.035 105.569 1.00 6.60 N ATOM 398 CA PHE A 57 25.370 29.229 105.952 1.00 5.68 C ATOM 399 C PHE A 57 24.505 29.102 104.692 1.00 6.01 C ATOM 400 O PHE A 57 24.543 29.937 103.776 1.00 6.55 O ATOM 401 CB PHE A 57 24.570 29.907 107.065 1.00 6.01 C ATOM 402 CG PHE A 57 25.210 29.803 108.430 1.00 5.60 C ATOM 403 CD1 PHE A 57 25.274 30.922 109.255 1.00 6.95 C ATOM 404 CD2 PHE A 57 25.711 28.591 108.907 1.00 6.02 C ATOM 405 CE1 PHE A 57 25.822 30.840 110.540 1.00 6.42 C ATOM 406 CE2 PHE A 57 26.263 28.502 110.192 1.00 5.90 C ATOM 407 CZ PHE A 57 26.315 29.623 111.006 1.00 6.92 C ATOM 0 H PHE A 57 26.585 30.801 105.954 1.00 6.60 H new ATOM 0 HA PHE A 57 25.651 28.364 106.290 1.00 5.68 H new ATOM 0 HB2 PHE A 57 24.454 30.844 106.843 1.00 6.01 H new ATOM 0 HB3 PHE A 57 23.685 29.512 107.102 1.00 6.01 H new ATOM 0 HD1 PHE A 57 24.948 31.737 108.948 1.00 6.95 H new ATOM 0 HD2 PHE A 57 25.678 27.835 108.367 1.00 6.02 H new ATOM 0 HE1 PHE A 57 25.857 31.595 111.081 1.00 6.42 H new ATOM 0 HE2 PHE A 57 26.595 27.689 110.499 1.00 5.90 H new ATOM 0 HZ PHE A 57 26.678 29.563 111.860 1.00 6.92 H new ATOM 408 N VAL A 58 23.723 28.035 104.663 1.00 6.66 N ATOM 409 CA VAL A 58 22.851 27.733 103.542 1.00 6.25 C ATOM 410 C VAL A 58 21.436 27.506 104.054 1.00 5.91 C ATOM 411 O VAL A 58 21.246 26.945 105.134 1.00 6.27 O ATOM 412 CB VAL A 58 23.324 26.429 102.836 1.00 6.32 C ATOM 413 CG1 VAL A 58 22.382 26.059 101.687 1.00 6.70 C ATOM 414 CG2 VAL A 58 24.766 26.582 102.347 1.00 7.76 C ATOM 0 H VAL A 58 23.683 27.459 105.301 1.00 6.66 H new ATOM 0 HA VAL A 58 22.875 28.475 102.918 1.00 6.25 H new ATOM 0 HB VAL A 58 23.300 25.703 103.479 1.00 6.32 H new ATOM 0 HG11 VAL A 58 22.694 25.245 101.261 1.00 6.70 H new ATOM 0 HG12 VAL A 58 21.487 25.919 102.034 1.00 6.70 H new ATOM 0 HG13 VAL A 58 22.367 26.778 101.036 1.00 6.70 H new ATOM 0 HG21 VAL A 58 25.048 25.764 101.910 1.00 7.76 H new ATOM 0 HG22 VAL A 58 24.818 27.319 101.718 1.00 7.76 H new ATOM 0 HG23 VAL A 58 25.347 26.761 103.103 1.00 7.76 H new ATOM 415 N GLU A 59 20.447 27.979 103.299 1.00 5.77 N ATOM 416 CA GLU A 59 19.034 27.729 103.628 1.00 5.11 C ATOM 417 C GLU A 59 18.547 26.817 102.491 1.00 5.54 C ATOM 418 O GLU A 59 18.198 27.286 101.404 1.00 5.95 O ATOM 419 CB GLU A 59 18.209 29.028 103.644 1.00 5.17 C ATOM 420 CG GLU A 59 16.698 28.749 103.724 1.00 6.09 C ATOM 421 CD GLU A 59 16.367 27.809 104.878 1.00 5.65 C ATOM 422 OE1 GLU A 59 16.100 28.292 105.994 1.00 7.42 O ATOM 423 OE2 GLU A 59 16.405 26.579 104.671 1.00 6.80 O ATOM 0 H GLU A 59 20.568 28.449 102.589 1.00 5.77 H new ATOM 0 HA GLU A 59 18.935 27.339 104.511 1.00 5.11 H new ATOM 0 HB2 GLU A 59 18.477 29.572 104.401 1.00 5.17 H new ATOM 0 HB3 GLU A 59 18.400 29.542 102.844 1.00 5.17 H new ATOM 0 HG2 GLU A 59 16.219 29.585 103.837 1.00 6.09 H new ATOM 0 HG3 GLU A 59 16.395 28.359 102.889 1.00 6.09 H new ATOM 424 N PRO A 60 18.524 25.497 102.714 1.00 5.15 N ATOM 425 CA PRO A 60 18.088 24.560 101.676 1.00 5.34 C ATOM 426 C PRO A 60 16.586 24.464 101.440 1.00 4.61 C ATOM 427 O PRO A 60 16.169 23.860 100.453 1.00 6.15 O ATOM 428 CB PRO A 60 18.667 23.229 102.156 1.00 6.59 C ATOM 429 CG PRO A 60 18.521 23.344 103.658 1.00 6.79 C ATOM 430 CD PRO A 60 18.982 24.783 103.924 1.00 5.60 C ATOM 0 HA PRO A 60 18.398 24.855 100.806 1.00 5.34 H new ATOM 0 HB2 PRO A 60 18.177 22.471 101.801 1.00 6.59 H new ATOM 0 HB3 PRO A 60 19.593 23.119 101.889 1.00 6.59 H new ATOM 0 HG2 PRO A 60 17.606 23.199 103.945 1.00 6.79 H new ATOM 0 HG3 PRO A 60 19.071 22.696 104.125 1.00 6.79 H new ATOM 0 HD2 PRO A 60 18.583 25.146 104.730 1.00 5.60 H new ATOM 0 HD3 PRO A 60 19.944 24.839 104.034 1.00 5.60 H new ATOM 431 N HIS A 61 15.779 25.053 102.320 1.00 4.85 N ATOM 432 CA HIS A 61 14.328 24.942 102.172 1.00 5.11 C ATOM 433 C HIS A 61 13.567 26.069 102.854 1.00 5.59 C ATOM 434 O HIS A 61 13.427 26.084 104.081 1.00 5.89 O ATOM 435 CB HIS A 61 13.884 23.582 102.758 1.00 5.80 C ATOM 436 CG HIS A 61 12.443 23.232 102.527 1.00 5.62 C ATOM 437 ND1 HIS A 61 12.055 22.004 102.034 1.00 6.49 N ATOM 438 CD2 HIS A 61 11.300 23.915 102.778 1.00 6.02 C ATOM 439 CE1 HIS A 61 10.734 21.945 101.993 1.00 6.36 C ATOM 440 NE2 HIS A 61 10.250 23.092 102.439 1.00 6.18 N ATOM 0 H HIS A 61 16.044 25.513 102.997 1.00 4.85 H new ATOM 0 HA HIS A 61 14.120 25.006 101.227 1.00 5.11 H new ATOM 0 HB2 HIS A 61 14.438 22.884 102.375 1.00 5.80 H new ATOM 0 HB3 HIS A 61 14.053 23.586 103.713 1.00 5.80 H new ATOM 0 HD1 HIS A 61 12.588 21.375 101.791 1.00 6.49 H new ATOM 0 HD2 HIS A 61 11.237 24.779 103.116 1.00 6.02 H new ATOM 0 HE1 HIS A 61 10.231 21.220 101.700 1.00 6.36 H new ATOM 441 N ILE A 62 13.064 27.013 102.065 1.00 5.76 N ATOM 442 CA ILE A 62 12.261 28.097 102.616 1.00 6.45 C ATOM 443 C ILE A 62 11.180 28.467 101.607 1.00 6.20 C ATOM 444 O ILE A 62 11.282 28.127 100.430 1.00 7.44 O ATOM 445 CB ILE A 62 13.142 29.341 102.980 1.00 5.65 C ATOM 446 CG1 ILE A 62 12.346 30.326 103.845 1.00 7.11 C ATOM 447 CG2 ILE A 62 13.648 30.043 101.722 1.00 7.70 C ATOM 448 CD1 ILE A 62 13.229 31.356 104.550 1.00 8.21 C ATOM 0 H ILE A 62 13.175 27.044 101.213 1.00 5.76 H new ATOM 0 HA ILE A 62 11.848 27.798 103.441 1.00 6.45 H new ATOM 0 HB ILE A 62 13.909 29.026 103.483 1.00 5.65 H new ATOM 0 HG12 ILE A 62 11.701 30.789 103.288 1.00 7.11 H new ATOM 0 HG13 ILE A 62 11.843 29.830 104.510 1.00 7.11 H new ATOM 0 HG21 ILE A 62 14.189 30.808 101.973 1.00 7.70 H new ATOM 0 HG22 ILE A 62 14.184 29.426 101.200 1.00 7.70 H new ATOM 0 HG23 ILE A 62 12.893 30.342 101.192 1.00 7.70 H new ATOM 0 HD11 ILE A 62 12.674 31.950 105.080 1.00 8.21 H new ATOM 0 HD12 ILE A 62 13.859 30.900 105.129 1.00 8.21 H new ATOM 0 HD13 ILE A 62 13.715 31.873 103.888 1.00 8.21 H new ATOM 449 N HIS A 63 10.118 29.096 102.093 1.00 5.71 N ATOM 450 CA HIS A 63 9.042 29.550 101.208 1.00 6.41 C ATOM 451 C HIS A 63 9.009 31.084 101.227 1.00 6.10 C ATOM 452 O HIS A 63 8.370 31.706 102.078 1.00 7.95 O ATOM 453 CB HIS A 63 7.697 28.972 101.661 1.00 8.48 C ATOM 454 CG HIS A 63 7.619 27.478 101.558 1.00 7.43 C ATOM 455 ND1 HIS A 63 6.976 26.829 100.525 1.00 8.46 N ATOM 456 CD2 HIS A 63 8.130 26.504 102.349 1.00 8.56 C ATOM 457 CE1 HIS A 63 7.092 25.522 100.685 1.00 8.70 C ATOM 458 NE2 HIS A 63 7.790 25.296 101.786 1.00 8.32 N ATOM 0 H HIS A 63 9.997 29.271 102.926 1.00 5.71 H new ATOM 0 HA HIS A 63 9.206 29.240 100.304 1.00 6.41 H new ATOM 0 HB2 HIS A 63 7.534 29.234 102.581 1.00 8.48 H new ATOM 0 HB3 HIS A 63 6.989 29.363 101.125 1.00 8.48 H new ATOM 0 HD1 HIS A 63 6.563 27.215 99.877 1.00 8.46 H new ATOM 0 HD2 HIS A 63 8.620 26.629 103.129 1.00 8.56 H new ATOM 0 HE1 HIS A 63 6.742 24.872 100.120 1.00 8.70 H new ATOM 459 N LEU A 64 9.722 31.696 100.284 1.00 6.52 N ATOM 460 CA LEU A 64 9.761 33.157 100.224 1.00 6.83 C ATOM 461 C LEU A 64 8.490 33.778 99.645 1.00 7.81 C ATOM 462 O LEU A 64 8.281 34.981 99.801 1.00 8.61 O ATOM 463 CB LEU A 64 10.991 33.639 99.440 1.00 6.85 C ATOM 464 CG LEU A 64 12.367 33.359 100.068 1.00 7.40 C ATOM 465 CD1 LEU A 64 13.462 33.865 99.129 1.00 8.89 C ATOM 466 CD2 LEU A 64 12.489 34.013 101.447 1.00 7.17 C ATOM 0 H LEU A 64 10.183 31.293 99.680 1.00 6.52 H new ATOM 0 HA LEU A 64 9.823 33.459 101.144 1.00 6.83 H new ATOM 0 HB2 LEU A 64 10.970 33.228 98.562 1.00 6.85 H new ATOM 0 HB3 LEU A 64 10.909 34.596 99.307 1.00 6.85 H new ATOM 0 HG LEU A 64 12.467 32.402 100.192 1.00 7.40 H new ATOM 0 HD11 LEU A 64 14.332 33.690 99.522 1.00 8.89 H new ATOM 0 HD12 LEU A 64 13.395 33.407 98.277 1.00 8.89 H new ATOM 0 HD13 LEU A 64 13.356 34.819 98.992 1.00 8.89 H new ATOM 0 HD21 LEU A 64 13.364 33.821 101.820 1.00 7.17 H new ATOM 0 HD22 LEU A 64 12.378 34.973 101.361 1.00 7.17 H new ATOM 0 HD23 LEU A 64 11.803 33.660 102.035 1.00 7.17 H new ATOM 467 N ASP A 65 7.641 32.986 98.989 1.00 8.12 N ATOM 468 CA ASP A 65 6.410 33.559 98.451 1.00 8.28 C ATOM 469 C ASP A 65 5.348 33.689 99.531 1.00 8.70 C ATOM 470 O ASP A 65 4.438 34.518 99.428 1.00 8.77 O ATOM 471 CB ASP A 65 5.889 32.770 97.219 1.00 9.61 C ATOM 472 CG ASP A 65 5.573 31.298 97.503 1.00 10.66 C ATOM 473 OD1 ASP A 65 6.178 30.693 98.416 1.00 11.36 O ATOM 474 OD2 ASP A 65 4.721 30.735 96.767 1.00 10.03 O ATOM 0 H ASP A 65 7.753 32.145 98.849 1.00 8.12 H new ATOM 0 HA ASP A 65 6.620 34.453 98.138 1.00 8.28 H new ATOM 0 HB2 ASP A 65 5.088 33.204 96.885 1.00 9.61 H new ATOM 0 HB3 ASP A 65 6.553 32.817 96.513 1.00 9.61 H new ATOM 475 N THR A 66 5.497 32.912 100.604 1.00 9.57 N ATOM 476 CA THR A 66 4.538 32.932 101.700 1.00 10.56 C ATOM 477 C THR A 66 5.050 33.680 102.938 1.00 9.41 C ATOM 478 O THR A 66 4.284 33.988 103.848 1.00 10.32 O ATOM 479 CB THR A 66 4.178 31.480 102.125 1.00 11.78 C ATOM 480 OG1 THR A 66 5.324 30.870 102.728 1.00 11.62 O ATOM 481 CG2 THR A 66 3.771 30.637 100.915 1.00 12.27 C ATOM 0 H THR A 66 6.151 32.365 100.714 1.00 9.57 H new ATOM 0 HA THR A 66 3.759 33.403 101.365 1.00 10.56 H new ATOM 0 HB THR A 66 3.436 31.522 102.748 1.00 11.78 H new ATOM 0 HG1 THR A 66 5.148 30.668 103.524 1.00 11.62 H new ATOM 0 HG21 THR A 66 3.552 29.738 101.206 1.00 12.27 H new ATOM 0 HG22 THR A 66 2.997 31.036 100.488 1.00 12.27 H new ATOM 0 HG23 THR A 66 4.506 30.602 100.283 1.00 12.27 H new ATOM 482 N THR A 67 6.348 33.984 102.974 1.00 8.87 N ATOM 483 CA THR A 67 6.930 34.630 104.147 1.00 9.63 C ATOM 484 C THR A 67 6.295 35.968 104.516 1.00 10.80 C ATOM 485 O THR A 67 5.895 36.750 103.646 1.00 10.66 O ATOM 486 CB THR A 67 8.481 34.773 103.989 1.00 7.64 C ATOM 487 OG1 THR A 67 9.074 35.131 105.245 1.00 7.77 O ATOM 488 CG2 THR A 67 8.829 35.844 102.950 1.00 8.04 C ATOM 0 H THR A 67 6.902 33.826 102.336 1.00 8.87 H new ATOM 0 HA THR A 67 6.732 34.040 104.891 1.00 9.63 H new ATOM 0 HB THR A 67 8.830 33.918 103.691 1.00 7.64 H new ATOM 0 HG1 THR A 67 8.634 34.785 105.871 1.00 7.77 H new ATOM 0 HG21 THR A 67 9.793 35.915 102.869 1.00 8.04 H new ATOM 0 HG22 THR A 67 8.450 35.598 102.092 1.00 8.04 H new ATOM 0 HG23 THR A 67 8.465 36.698 103.231 1.00 8.04 H new ATOM 489 N GLN A 68 6.168 36.197 105.819 1.00 12.36 N ATOM 490 CA GLN A 68 5.589 37.415 106.371 1.00 13.71 C ATOM 491 C GLN A 68 4.060 37.525 106.189 1.00 12.34 C ATOM 492 O GLN A 68 3.509 38.622 106.297 1.00 18.35 O ATOM 493 CB GLN A 68 6.282 38.651 105.763 1.00 13.64 C ATOM 494 CG GLN A 68 7.823 38.648 105.804 1.00 14.94 C ATOM 495 CD GLN A 68 8.407 38.650 107.213 1.00 15.33 C ATOM 496 OE1 GLN A 68 7.718 38.953 108.186 1.00 16.54 O ATOM 497 NE2 GLN A 68 9.696 38.328 107.319 1.00 16.03 N ATOM 0 H GLN A 68 6.422 35.636 106.419 1.00 12.36 H new ATOM 0 HA GLN A 68 5.743 37.375 107.328 1.00 13.71 H new ATOM 0 HB2 GLN A 68 6.001 38.736 104.839 1.00 13.64 H new ATOM 0 HB3 GLN A 68 5.965 39.440 106.230 1.00 13.64 H new ATOM 0 HG2 GLN A 68 8.148 37.866 105.330 1.00 14.94 H new ATOM 0 HG3 GLN A 68 8.151 39.426 105.327 1.00 14.94 H new ATOM 0 HE21 GLN A 68 10.147 38.121 106.616 1.00 16.03 H new ATOM 0 HE22 GLN A 68 10.077 38.327 108.090 1.00 16.03 H new ATOM 498 N THR A 69 3.367 36.414 105.923 1.00 13.22 N ATOM 499 CA THR A 69 1.904 36.468 105.734 1.00 12.83 C ATOM 500 C THR A 69 1.056 35.799 106.815 1.00 13.85 C ATOM 501 O THR A 69 -0.162 35.700 106.660 1.00 14.71 O ATOM 502 CB THR A 69 1.440 35.838 104.395 1.00 13.70 C ATOM 503 OG1 THR A 69 1.657 34.419 104.426 1.00 13.37 O ATOM 504 CG2 THR A 69 2.176 36.463 103.222 1.00 13.70 C ATOM 0 H THR A 69 3.713 35.630 105.848 1.00 13.22 H new ATOM 0 HA THR A 69 1.755 37.426 105.764 1.00 12.83 H new ATOM 0 HB THR A 69 0.492 36.011 104.281 1.00 13.70 H new ATOM 0 HG1 THR A 69 2.465 34.255 104.263 1.00 13.37 H new ATOM 0 HG21 THR A 69 1.872 36.056 102.395 1.00 13.70 H new ATOM 0 HG22 THR A 69 1.997 37.416 103.198 1.00 13.70 H new ATOM 0 HG23 THR A 69 3.130 36.316 103.323 1.00 13.70 H new ATOM 505 N ALA A 70 1.671 35.336 107.899 1.00 13.11 N ATOM 506 CA ALA A 70 0.902 34.681 108.955 1.00 13.13 C ATOM 507 C ALA A 70 -0.270 35.544 109.422 1.00 14.53 C ATOM 508 O ALA A 70 -0.110 36.740 109.683 1.00 15.29 O ATOM 509 CB ALA A 70 1.806 34.343 110.129 1.00 13.56 C ATOM 0 H ALA A 70 2.517 35.389 108.042 1.00 13.11 H new ATOM 0 HA ALA A 70 0.535 33.862 108.587 1.00 13.13 H new ATOM 0 HB1 ALA A 70 1.286 33.909 110.824 1.00 13.56 H new ATOM 0 HB2 ALA A 70 2.511 33.746 109.833 1.00 13.56 H new ATOM 0 HB3 ALA A 70 2.198 35.157 110.481 1.00 13.56 H new ATOM 510 N GLY A 71 -1.446 34.925 109.514 1.00 14.27 N ATOM 511 CA GLY A 71 -2.639 35.620 109.950 1.00 15.07 C ATOM 512 C GLY A 71 -3.396 36.355 108.855 1.00 15.96 C ATOM 513 O GLY A 71 -4.425 36.974 109.135 1.00 16.78 O ATOM 0 H GLY A 71 -1.568 34.095 109.325 1.00 14.27 H new ATOM 0 HA2 GLY A 71 -3.238 34.978 110.362 1.00 15.07 H new ATOM 0 HA3 GLY A 71 -2.391 36.259 110.637 1.00 15.07 H new ATOM 514 N GLN A 72 -2.910 36.286 107.617 1.00 17.41 N ATOM 515 CA GLN A 72 -3.565 36.978 106.504 1.00 18.61 C ATOM 516 C GLN A 72 -4.178 36.032 105.469 1.00 18.55 C ATOM 517 O GLN A 72 -3.459 35.295 104.792 1.00 17.90 O ATOM 518 CB GLN A 72 -2.560 37.885 105.789 1.00 20.73 C ATOM 519 CG GLN A 72 -1.742 38.775 106.712 1.00 24.54 C ATOM 520 CD GLN A 72 -0.657 39.535 105.968 1.00 27.46 C ATOM 521 OE1 GLN A 72 -0.316 39.200 104.831 1.00 26.73 O ATOM 522 NE2 GLN A 72 -0.102 40.557 106.611 1.00 30.20 N ATOM 0 H GLN A 72 -2.204 35.846 107.399 1.00 17.41 H new ATOM 0 HA GLN A 72 -4.288 37.490 106.899 1.00 18.61 H new ATOM 0 HB2 GLN A 72 -1.954 37.332 105.272 1.00 20.73 H new ATOM 0 HB3 GLN A 72 -3.039 38.446 105.159 1.00 20.73 H new ATOM 0 HG2 GLN A 72 -2.331 39.406 107.154 1.00 24.54 H new ATOM 0 HG3 GLN A 72 -1.336 38.232 107.405 1.00 24.54 H new ATOM 0 HE21 GLN A 72 -0.366 40.761 107.404 1.00 30.20 H new ATOM 0 HE22 GLN A 72 0.521 41.014 106.235 1.00 30.20 H new ATOM 523 N PRO A 73 -5.517 36.024 105.338 1.00 18.35 N ATOM 524 CA PRO A 73 -6.493 36.824 106.087 1.00 17.58 C ATOM 525 C PRO A 73 -6.919 36.142 107.390 1.00 17.97 C ATOM 526 O PRO A 73 -7.613 36.742 108.212 1.00 18.46 O ATOM 527 CB PRO A 73 -7.653 36.959 105.101 1.00 17.70 C ATOM 528 CG PRO A 73 -7.611 35.652 104.359 1.00 17.64 C ATOM 529 CD PRO A 73 -6.130 35.465 104.116 1.00 18.08 C ATOM 0 HA PRO A 73 -6.140 37.680 106.376 1.00 17.58 H new ATOM 0 HB2 PRO A 73 -8.500 37.088 105.556 1.00 17.70 H new ATOM 0 HB3 PRO A 73 -7.533 37.715 104.506 1.00 17.70 H new ATOM 0 HG2 PRO A 73 -7.986 34.927 104.883 1.00 17.64 H new ATOM 0 HG3 PRO A 73 -8.112 35.691 103.529 1.00 17.64 H new ATOM 0 HD2 PRO A 73 -5.901 34.530 103.995 1.00 18.08 H new ATOM 0 HD3 PRO A 73 -5.835 35.934 103.320 1.00 18.08 H new ATOM 530 N ASN A 74 -6.502 34.889 107.572 1.00 15.61 N ATOM 531 CA ASN A 74 -6.849 34.132 108.773 1.00 16.04 C ATOM 532 C ASN A 74 -5.655 33.341 109.303 1.00 15.77 C ATOM 533 O ASN A 74 -4.700 33.088 108.573 1.00 14.81 O ATOM 534 CB ASN A 74 -7.998 33.162 108.474 1.00 16.83 C ATOM 535 CG ASN A 74 -9.252 33.869 107.988 1.00 18.32 C ATOM 536 OD1 ASN A 74 -9.828 34.694 108.699 1.00 20.84 O ATOM 537 ND2 ASN A 74 -9.678 33.550 106.772 1.00 19.89 N ATOM 0 H ASN A 74 -6.015 34.458 107.009 1.00 15.61 H new ATOM 0 HA ASN A 74 -7.122 34.771 109.450 1.00 16.04 H new ATOM 0 HB2 ASN A 74 -7.711 32.524 107.803 1.00 16.83 H new ATOM 0 HB3 ASN A 74 -8.206 32.657 109.275 1.00 16.83 H new ATOM 0 HD21 ASN A 74 -10.383 33.924 106.451 1.00 19.89 H new ATOM 0 HD22 ASN A 74 -9.249 32.969 106.305 1.00 19.89 H new ATOM 538 N TRP A 75 -5.721 32.958 110.575 1.00 14.99 N ATOM 539 CA TRP A 75 -4.661 32.178 111.213 1.00 15.60 C ATOM 540 C TRP A 75 -4.918 30.678 111.112 1.00 15.48 C ATOM 541 O TRP A 75 -6.068 30.228 111.079 1.00 15.33 O ATOM 542 CB TRP A 75 -4.533 32.527 112.704 1.00 16.73 C ATOM 543 CG TRP A 75 -3.913 33.857 112.998 1.00 17.85 C ATOM 544 CD1 TRP A 75 -4.557 35.057 113.121 1.00 19.32 C ATOM 545 CD2 TRP A 75 -2.522 34.126 113.194 1.00 18.07 C ATOM 546 NE1 TRP A 75 -3.650 36.057 113.382 1.00 17.51 N ATOM 547 CE2 TRP A 75 -2.393 35.513 113.431 1.00 19.62 C ATOM 548 CE3 TRP A 75 -1.368 33.329 113.191 1.00 19.51 C ATOM 549 CZ2 TRP A 75 -1.156 36.124 113.664 1.00 19.00 C ATOM 550 CZ3 TRP A 75 -0.135 33.938 113.423 1.00 19.97 C ATOM 551 CH2 TRP A 75 -0.042 35.324 113.656 1.00 19.46 C ATOM 0 H TRP A 75 -6.382 33.143 111.094 1.00 14.99 H new ATOM 0 HA TRP A 75 -3.844 32.403 110.741 1.00 15.60 H new ATOM 0 HB2 TRP A 75 -5.416 32.503 113.104 1.00 16.73 H new ATOM 0 HB3 TRP A 75 -4.006 31.838 113.138 1.00 16.73 H new ATOM 0 HD1 TRP A 75 -5.475 35.179 113.040 1.00 19.32 H new ATOM 0 HE1 TRP A 75 -3.840 36.888 113.496 1.00 17.51 H new ATOM 0 HE3 TRP A 75 -1.424 32.413 113.037 1.00 19.51 H new ATOM 0 HZ2 TRP A 75 -1.092 37.039 113.819 1.00 19.00 H new ATOM 0 HZ3 TRP A 75 0.638 33.421 113.424 1.00 19.97 H new ATOM 0 HH2 TRP A 75 0.793 35.705 113.808 1.00 19.46 H new ATOM 552 N ASN A 76 -3.829 29.913 111.076 1.00 14.43 N ATOM 553 CA ASN A 76 -3.870 28.451 111.031 1.00 15.74 C ATOM 554 C ASN A 76 -4.124 28.053 112.490 1.00 16.53 C ATOM 555 O ASN A 76 -3.193 27.959 113.290 1.00 17.52 O ATOM 556 CB ASN A 76 -2.509 27.931 110.533 1.00 13.84 C ATOM 557 CG ASN A 76 -2.409 26.415 110.513 1.00 14.98 C ATOM 558 OD1 ASN A 76 -3.386 25.735 111.096 1.00 15.38 O flip ATOM 559 ND2 ASN A 76 -1.442 25.863 109.981 1.00 12.28 N flip ATOM 0 H ASN A 76 -3.031 30.234 111.077 1.00 14.43 H new ATOM 0 HA ASN A 76 -4.544 28.088 110.436 1.00 15.74 H new ATOM 0 HB2 ASN A 76 -2.349 28.270 109.638 1.00 13.84 H new ATOM 0 HB3 ASN A 76 -1.808 28.287 111.101 1.00 13.84 H new ATOM 0 HD21 ASN A 76 -0.826 26.336 109.612 1.00 12.28 H new ATOM 0 HD22 ASN A 76 -1.384 25.005 109.979 1.00 12.28 H new ATOM 560 N GLN A 77 -5.391 27.831 112.831 1.00 16.70 N ATOM 561 CA GLN A 77 -5.772 27.495 114.201 1.00 17.62 C ATOM 562 C GLN A 77 -5.313 26.137 114.702 1.00 16.42 C ATOM 563 O GLN A 77 -4.871 26.010 115.850 1.00 18.64 O ATOM 564 CB GLN A 77 -7.291 27.584 114.357 1.00 19.95 C ATOM 565 CG GLN A 77 -7.869 28.944 114.027 1.00 24.54 C ATOM 566 CD GLN A 77 -7.130 30.063 114.723 1.00 25.84 C ATOM 567 OE1 GLN A 77 -6.823 31.124 113.981 1.00 29.82 O flip ATOM 568 NE2 GLN A 77 -6.845 29.983 115.917 1.00 27.37 N flip ATOM 0 H GLN A 77 -6.050 27.870 112.279 1.00 16.70 H new ATOM 0 HA GLN A 77 -5.308 28.149 114.747 1.00 17.62 H new ATOM 0 HB2 GLN A 77 -7.705 26.920 113.784 1.00 19.95 H new ATOM 0 HB3 GLN A 77 -7.526 27.356 115.270 1.00 19.95 H new ATOM 0 HG2 GLN A 77 -7.835 29.084 113.068 1.00 24.54 H new ATOM 0 HG3 GLN A 77 -8.804 28.967 114.284 1.00 24.54 H new ATOM 0 HE21 GLN A 77 -7.060 29.281 116.364 1.00 27.37 H new ATOM 0 HE22 GLN A 77 -6.431 30.629 116.304 1.00 27.37 H new ATOM 569 N SER A 78 -5.410 25.121 113.851 1.00 14.47 N ATOM 570 CA SER A 78 -5.035 23.767 114.258 1.00 14.38 C ATOM 571 C SER A 78 -3.537 23.500 114.286 1.00 13.68 C ATOM 572 O SER A 78 -3.089 22.524 114.898 1.00 13.68 O ATOM 573 CB SER A 78 -5.707 22.743 113.341 1.00 14.05 C ATOM 574 OG SER A 78 -5.219 22.861 112.016 1.00 14.36 O ATOM 0 H SER A 78 -5.688 25.191 113.040 1.00 14.47 H new ATOM 0 HA SER A 78 -5.343 23.681 115.174 1.00 14.38 H new ATOM 0 HB2 SER A 78 -5.541 21.847 113.673 1.00 14.05 H new ATOM 0 HB3 SER A 78 -6.668 22.876 113.350 1.00 14.05 H new ATOM 0 HG SER A 78 -5.698 23.402 111.588 1.00 14.36 H new ATOM 575 N GLY A 79 -2.765 24.363 113.632 1.00 11.72 N ATOM 576 CA GLY A 79 -1.327 24.167 113.580 1.00 11.73 C ATOM 577 C GLY A 79 -0.946 22.928 112.786 1.00 11.82 C ATOM 578 O GLY A 79 0.021 22.238 113.124 1.00 12.23 O ATOM 0 H GLY A 79 -3.053 25.059 113.217 1.00 11.72 H new ATOM 0 HA2 GLY A 79 -0.910 24.946 113.180 1.00 11.73 H new ATOM 0 HA3 GLY A 79 -0.980 24.091 114.482 1.00 11.73 H new ATOM 579 N THR A 80 -1.701 22.642 111.726 1.00 11.77 N ATOM 580 CA THR A 80 -1.431 21.473 110.891 1.00 10.99 C ATOM 581 C THR A 80 -1.032 21.868 109.473 1.00 10.78 C ATOM 582 O THR A 80 -1.292 22.989 109.027 1.00 11.05 O ATOM 583 CB THR A 80 -2.663 20.533 110.775 1.00 11.74 C ATOM 584 OG1 THR A 80 -3.744 21.232 110.138 1.00 14.70 O ATOM 585 CG2 THR A 80 -3.119 20.056 112.142 1.00 12.04 C ATOM 0 H THR A 80 -2.375 23.113 111.473 1.00 11.77 H new ATOM 0 HA THR A 80 -0.701 21.011 111.332 1.00 10.99 H new ATOM 0 HB THR A 80 -2.405 19.761 110.247 1.00 11.74 H new ATOM 0 HG1 THR A 80 -4.145 21.705 110.705 1.00 14.70 H new ATOM 0 HG21 THR A 80 -3.887 19.472 112.042 1.00 12.04 H new ATOM 0 HG22 THR A 80 -2.398 19.570 112.572 1.00 12.04 H new ATOM 0 HG23 THR A 80 -3.363 20.820 112.687 1.00 12.04 H new ATOM 586 N LEU A 81 -0.399 20.934 108.767 1.00 10.72 N ATOM 587 CA LEU A 81 0.015 21.154 107.380 1.00 10.40 C ATOM 588 C LEU A 81 -1.214 21.422 106.516 1.00 10.72 C ATOM 589 O LEU A 81 -1.231 22.341 105.683 1.00 10.69 O ATOM 590 CB LEU A 81 0.734 19.907 106.835 1.00 11.36 C ATOM 591 CG LEU A 81 0.942 19.852 105.312 1.00 10.41 C ATOM 592 CD1 LEU A 81 1.948 20.922 104.900 1.00 12.21 C ATOM 593 CD2 LEU A 81 1.430 18.478 104.891 1.00 11.33 C ATOM 0 H LEU A 81 -0.197 20.157 109.076 1.00 10.72 H new ATOM 0 HA LEU A 81 0.617 21.914 107.354 1.00 10.40 H new ATOM 0 HB2 LEU A 81 1.602 19.844 107.263 1.00 11.36 H new ATOM 0 HB3 LEU A 81 0.229 19.123 107.102 1.00 11.36 H new ATOM 0 HG LEU A 81 0.096 20.020 104.869 1.00 10.41 H new ATOM 0 HD11 LEU A 81 2.081 20.889 103.940 1.00 12.21 H new ATOM 0 HD12 LEU A 81 1.611 21.797 105.150 1.00 12.21 H new ATOM 0 HD13 LEU A 81 2.793 20.762 105.348 1.00 12.21 H new ATOM 0 HD21 LEU A 81 1.556 18.460 103.929 1.00 11.33 H new ATOM 0 HD22 LEU A 81 2.273 18.285 105.331 1.00 11.33 H new ATOM 0 HD23 LEU A 81 0.774 17.810 105.143 1.00 11.33 H new ATOM 594 N PHE A 82 -2.249 20.617 106.736 1.00 11.23 N ATOM 595 CA PHE A 82 -3.478 20.693 105.963 1.00 11.51 C ATOM 596 C PHE A 82 -4.221 22.013 106.117 1.00 11.80 C ATOM 597 O PHE A 82 -4.637 22.608 105.116 1.00 12.24 O ATOM 598 CB PHE A 82 -4.349 19.486 106.320 1.00 12.96 C ATOM 599 CG PHE A 82 -3.587 18.185 106.289 1.00 13.74 C ATOM 600 CD1 PHE A 82 -3.253 17.528 107.474 1.00 14.72 C ATOM 601 CD2 PHE A 82 -3.126 17.658 105.079 1.00 14.21 C ATOM 602 CE1 PHE A 82 -2.471 16.374 107.458 1.00 15.63 C ATOM 603 CE2 PHE A 82 -2.339 16.500 105.051 1.00 14.91 C ATOM 604 CZ PHE A 82 -2.010 15.857 106.247 1.00 15.35 C ATOM 0 H PHE A 82 -2.255 20.008 107.343 1.00 11.23 H new ATOM 0 HA PHE A 82 -3.248 20.665 105.021 1.00 11.51 H new ATOM 0 HB2 PHE A 82 -4.725 19.614 107.205 1.00 12.96 H new ATOM 0 HB3 PHE A 82 -5.093 19.435 105.700 1.00 12.96 H new ATOM 0 HD1 PHE A 82 -3.556 17.865 108.286 1.00 14.72 H new ATOM 0 HD2 PHE A 82 -3.345 18.083 104.281 1.00 14.21 H new ATOM 0 HE1 PHE A 82 -2.256 15.948 108.256 1.00 15.63 H new ATOM 0 HE2 PHE A 82 -2.037 16.160 104.240 1.00 14.91 H new ATOM 0 HZ PHE A 82 -1.486 15.088 106.236 1.00 15.35 H new ATOM 605 N GLU A 83 -4.384 22.502 107.342 1.00 11.52 N ATOM 606 CA GLU A 83 -5.062 23.785 107.482 1.00 12.04 C ATOM 607 C GLU A 83 -4.137 24.875 106.941 1.00 11.77 C ATOM 608 O GLU A 83 -4.600 25.876 106.402 1.00 12.85 O ATOM 609 CB GLU A 83 -5.440 24.099 108.938 1.00 12.74 C ATOM 610 CG GLU A 83 -6.113 25.473 109.046 1.00 11.86 C ATOM 611 CD GLU A 83 -6.623 25.817 110.426 1.00 13.38 C ATOM 612 OE1 GLU A 83 -7.002 26.989 110.620 1.00 15.08 O ATOM 613 OE2 GLU A 83 -6.661 24.930 111.313 1.00 13.36 O ATOM 0 H GLU A 83 -4.124 22.129 108.072 1.00 11.52 H new ATOM 0 HA GLU A 83 -5.892 23.747 106.981 1.00 12.04 H new ATOM 0 HB2 GLU A 83 -6.039 23.414 109.275 1.00 12.74 H new ATOM 0 HB3 GLU A 83 -4.645 24.080 109.494 1.00 12.74 H new ATOM 0 HG2 GLU A 83 -5.479 26.153 108.770 1.00 11.86 H new ATOM 0 HG3 GLU A 83 -6.855 25.506 108.422 1.00 11.86 H new ATOM 614 N GLY A 84 -2.827 24.676 107.076 1.00 11.86 N ATOM 615 CA GLY A 84 -1.881 25.660 106.567 1.00 12.19 C ATOM 616 C GLY A 84 -2.060 25.889 105.073 1.00 12.27 C ATOM 617 O GLY A 84 -2.025 27.029 104.592 1.00 11.83 O ATOM 0 H GLY A 84 -2.472 23.989 107.453 1.00 11.86 H new ATOM 0 HA2 GLY A 84 -1.999 26.499 107.040 1.00 12.19 H new ATOM 0 HA3 GLY A 84 -0.975 25.360 106.743 1.00 12.19 H new ATOM 618 N ILE A 85 -2.255 24.802 104.330 1.00 11.66 N ATOM 619 CA ILE A 85 -2.452 24.893 102.884 1.00 12.52 C ATOM 620 C ILE A 85 -3.766 25.612 102.564 1.00 13.87 C ATOM 621 O ILE A 85 -3.839 26.373 101.597 1.00 12.87 O ATOM 622 CB ILE A 85 -2.413 23.479 102.245 1.00 11.86 C ATOM 623 CG1 ILE A 85 -0.992 22.915 102.364 1.00 11.92 C ATOM 624 CG2 ILE A 85 -2.824 23.539 100.771 1.00 12.58 C ATOM 625 CD1 ILE A 85 -0.861 21.441 102.006 1.00 12.47 C ATOM 0 H ILE A 85 -2.277 24.002 104.644 1.00 11.66 H new ATOM 0 HA ILE A 85 -1.729 25.415 102.502 1.00 12.52 H new ATOM 0 HB ILE A 85 -3.039 22.904 102.713 1.00 11.86 H new ATOM 0 HG12 ILE A 85 -0.404 23.429 101.788 1.00 11.92 H new ATOM 0 HG13 ILE A 85 -0.681 23.043 103.274 1.00 11.92 H new ATOM 0 HG21 ILE A 85 -2.793 22.648 100.390 1.00 12.58 H new ATOM 0 HG22 ILE A 85 -3.726 23.890 100.700 1.00 12.58 H new ATOM 0 HG23 ILE A 85 -2.214 24.118 100.288 1.00 12.58 H new ATOM 0 HD11 ILE A 85 0.063 21.164 102.107 1.00 12.47 H new ATOM 0 HD12 ILE A 85 -1.422 20.913 102.596 1.00 12.47 H new ATOM 0 HD13 ILE A 85 -1.140 21.305 101.087 1.00 12.47 H new ATOM 626 N GLU A 86 -4.797 25.388 103.378 1.00 13.28 N ATOM 627 CA GLU A 86 -6.080 26.060 103.167 1.00 14.90 C ATOM 628 C GLU A 86 -5.957 27.567 103.428 1.00 13.83 C ATOM 629 O GLU A 86 -6.492 28.384 102.671 1.00 12.79 O ATOM 630 CB GLU A 86 -7.159 25.463 104.080 1.00 18.09 C ATOM 631 CG GLU A 86 -8.523 26.121 103.893 1.00 24.10 C ATOM 632 CD GLU A 86 -8.954 26.147 102.437 1.00 28.45 C ATOM 633 OE1 GLU A 86 -9.508 27.179 101.996 1.00 31.41 O ATOM 634 OE2 GLU A 86 -8.742 25.134 101.732 1.00 30.80 O ATOM 0 H GLU A 86 -4.776 24.855 104.053 1.00 13.28 H new ATOM 0 HA GLU A 86 -6.338 25.924 102.242 1.00 14.90 H new ATOM 0 HB2 GLU A 86 -7.236 24.512 103.903 1.00 18.09 H new ATOM 0 HB3 GLU A 86 -6.883 25.558 105.005 1.00 18.09 H new ATOM 0 HG2 GLU A 86 -9.185 25.643 104.416 1.00 24.10 H new ATOM 0 HG3 GLU A 86 -8.492 27.028 104.236 1.00 24.10 H new ATOM 635 N ARG A 87 -5.254 27.935 104.497 1.00 13.30 N ATOM 636 CA ARG A 87 -5.049 29.340 104.838 1.00 13.71 C ATOM 637 C ARG A 87 -4.191 30.006 103.760 1.00 12.66 C ATOM 638 O ARG A 87 -4.423 31.164 103.393 1.00 13.68 O ATOM 639 CB ARG A 87 -4.355 29.456 106.199 1.00 14.13 C ATOM 640 CG ARG A 87 -5.197 28.983 107.390 1.00 14.90 C ATOM 641 CD ARG A 87 -6.363 29.933 107.683 1.00 16.98 C ATOM 642 NE ARG A 87 -7.523 29.717 106.817 1.00 18.73 N ATOM 643 CZ ARG A 87 -8.392 28.718 106.965 1.00 20.26 C ATOM 644 NH1 ARG A 87 -9.417 28.598 106.133 1.00 22.26 N ATOM 645 NH2 ARG A 87 -8.241 27.835 107.947 1.00 20.82 N ATOM 0 H ARG A 87 -4.885 27.381 105.041 1.00 13.30 H new ATOM 0 HA ARG A 87 -5.910 29.785 104.887 1.00 13.71 H new ATOM 0 HB2 ARG A 87 -3.534 28.941 106.174 1.00 14.13 H new ATOM 0 HB3 ARG A 87 -4.105 30.382 106.343 1.00 14.13 H new ATOM 0 HG2 ARG A 87 -5.542 28.095 107.208 1.00 14.90 H new ATOM 0 HG3 ARG A 87 -4.633 28.913 108.176 1.00 14.90 H new ATOM 0 HD2 ARG A 87 -6.634 29.825 108.608 1.00 16.98 H new ATOM 0 HD3 ARG A 87 -6.059 30.848 107.582 1.00 16.98 H new ATOM 0 HE ARG A 87 -7.652 30.270 106.171 1.00 18.73 H new ATOM 0 HH11 ARG A 87 -9.522 29.166 105.496 1.00 22.26 H new ATOM 0 HH12 ARG A 87 -9.977 27.952 106.230 1.00 22.26 H new ATOM 0 HH21 ARG A 87 -7.579 27.907 108.492 1.00 20.82 H new ATOM 0 HH22 ARG A 87 -8.805 27.192 108.038 1.00 20.82 H new ATOM 646 N TRP A 88 -3.192 29.281 103.257 1.00 12.07 N ATOM 647 CA TRP A 88 -2.340 29.815 102.198 1.00 12.38 C ATOM 648 C TRP A 88 -3.166 30.037 100.926 1.00 13.37 C ATOM 649 O TRP A 88 -2.979 31.036 100.231 1.00 13.47 O ATOM 650 CB TRP A 88 -1.163 28.872 101.899 1.00 11.46 C ATOM 651 CG TRP A 88 -0.433 29.223 100.613 1.00 11.47 C ATOM 652 CD1 TRP A 88 -0.276 28.422 99.523 1.00 11.81 C ATOM 653 CD2 TRP A 88 0.179 30.481 100.276 1.00 10.89 C ATOM 654 NE1 TRP A 88 0.391 29.098 98.522 1.00 10.82 N ATOM 655 CE2 TRP A 88 0.681 30.363 98.957 1.00 11.43 C ATOM 656 CE3 TRP A 88 0.350 31.694 100.957 1.00 12.67 C ATOM 657 CZ2 TRP A 88 1.340 31.413 98.305 1.00 13.85 C ATOM 658 CZ3 TRP A 88 1.009 32.743 100.306 1.00 13.08 C ATOM 659 CH2 TRP A 88 1.494 32.589 98.992 1.00 12.45 C ATOM 0 H TRP A 88 -2.993 28.485 103.513 1.00 12.07 H new ATOM 0 HA TRP A 88 -1.978 30.662 102.502 1.00 12.38 H new ATOM 0 HB2 TRP A 88 -0.536 28.900 102.639 1.00 11.46 H new ATOM 0 HB3 TRP A 88 -1.492 27.961 101.840 1.00 11.46 H new ATOM 0 HD1 TRP A 88 -0.576 27.544 99.462 1.00 11.81 H new ATOM 0 HE1 TRP A 88 0.592 28.777 97.750 1.00 10.82 H new ATOM 0 HE3 TRP A 88 0.032 31.800 101.824 1.00 12.67 H new ATOM 0 HZ2 TRP A 88 1.661 31.316 97.438 1.00 13.85 H new ATOM 0 HZ3 TRP A 88 1.129 33.553 100.747 1.00 13.08 H new ATOM 0 HH2 TRP A 88 1.928 33.302 98.582 1.00 12.45 H new ATOM 660 N ALA A 89 -4.078 29.115 100.616 1.00 12.95 N ATOM 661 CA ALA A 89 -4.917 29.262 99.428 1.00 13.60 C ATOM 662 C ALA A 89 -5.671 30.590 99.472 1.00 13.86 C ATOM 663 O ALA A 89 -5.814 31.272 98.453 1.00 15.03 O ATOM 664 CB ALA A 89 -5.901 28.096 99.327 1.00 14.12 C ATOM 0 H ALA A 89 -4.225 28.404 101.076 1.00 12.95 H new ATOM 0 HA ALA A 89 -4.347 29.256 98.643 1.00 13.60 H new ATOM 0 HB1 ALA A 89 -6.452 28.205 98.536 1.00 14.12 H new ATOM 0 HB2 ALA A 89 -5.410 27.262 99.266 1.00 14.12 H new ATOM 0 HB3 ALA A 89 -6.467 28.081 100.115 1.00 14.12 H new ATOM 665 N GLU A 90 -6.151 30.960 100.656 1.00 13.83 N ATOM 666 CA GLU A 90 -6.869 32.221 100.824 1.00 14.09 C ATOM 667 C GLU A 90 -5.951 33.412 100.550 1.00 14.64 C ATOM 668 O GLU A 90 -6.370 34.399 99.942 1.00 15.50 O ATOM 669 CB GLU A 90 -7.451 32.306 102.242 1.00 14.63 C ATOM 670 CG GLU A 90 -8.537 31.272 102.485 1.00 15.60 C ATOM 671 CD GLU A 90 -8.957 31.146 103.941 1.00 17.81 C ATOM 672 OE1 GLU A 90 -10.006 30.511 104.194 1.00 20.40 O ATOM 673 OE2 GLU A 90 -8.247 31.660 104.831 1.00 17.67 O ATOM 0 H GLU A 90 -6.072 30.495 101.375 1.00 13.83 H new ATOM 0 HA GLU A 90 -7.596 32.250 100.182 1.00 14.09 H new ATOM 0 HB2 GLU A 90 -6.739 32.182 102.889 1.00 14.63 H new ATOM 0 HB3 GLU A 90 -7.815 33.194 102.387 1.00 14.63 H new ATOM 0 HG2 GLU A 90 -9.315 31.502 101.953 1.00 15.60 H new ATOM 0 HG3 GLU A 90 -8.224 30.409 102.172 1.00 15.60 H new ATOM 674 N ARG A 91 -4.700 33.316 100.993 1.00 13.83 N ATOM 675 CA ARG A 91 -3.725 34.388 100.782 1.00 13.35 C ATOM 676 C ARG A 91 -3.225 34.420 99.339 1.00 13.39 C ATOM 677 O ARG A 91 -2.977 35.495 98.780 1.00 13.89 O ATOM 678 CB ARG A 91 -2.532 34.215 101.733 1.00 13.69 C ATOM 679 CG ARG A 91 -1.512 35.362 101.710 1.00 13.90 C ATOM 680 CD ARG A 91 -2.169 36.686 102.099 1.00 14.72 C ATOM 681 NE ARG A 91 -1.219 37.778 102.320 1.00 15.07 N ATOM 682 CZ ARG A 91 -0.563 38.421 101.359 1.00 13.79 C ATOM 683 NH1 ARG A 91 0.273 39.405 101.671 1.00 12.24 N ATOM 684 NH2 ARG A 91 -0.740 38.080 100.090 1.00 14.87 N ATOM 0 H ARG A 91 -4.393 32.636 101.420 1.00 13.83 H new ATOM 0 HA ARG A 91 -4.172 35.229 100.967 1.00 13.35 H new ATOM 0 HB2 ARG A 91 -2.868 34.117 102.638 1.00 13.69 H new ATOM 0 HB3 ARG A 91 -2.075 33.389 101.510 1.00 13.69 H new ATOM 0 HG2 ARG A 91 -0.785 35.166 102.322 1.00 13.90 H new ATOM 0 HG3 ARG A 91 -1.125 35.437 100.824 1.00 13.90 H new ATOM 0 HD2 ARG A 91 -2.790 36.946 101.401 1.00 14.72 H new ATOM 0 HD3 ARG A 91 -2.689 36.554 102.907 1.00 14.72 H new ATOM 0 HE ARG A 91 -1.075 38.022 103.132 1.00 15.07 H new ATOM 0 HH11 ARG A 91 0.389 39.626 102.494 1.00 12.24 H new ATOM 0 HH12 ARG A 91 0.698 39.821 101.050 1.00 12.24 H new ATOM 0 HH21 ARG A 91 -1.280 37.442 99.887 1.00 14.87 H new ATOM 0 HH22 ARG A 91 -0.315 38.497 99.469 1.00 14.87 H new ATOM 685 N LYS A 92 -3.081 33.245 98.733 1.00 13.84 N ATOM 686 CA LYS A 92 -2.603 33.148 97.356 1.00 13.51 C ATOM 687 C LYS A 92 -3.537 33.884 96.392 1.00 14.08 C ATOM 688 O LYS A 92 -3.091 34.461 95.393 1.00 13.35 O ATOM 689 CB LYS A 92 -2.455 31.670 96.962 1.00 12.85 C ATOM 690 CG LYS A 92 -2.081 31.436 95.501 1.00 13.09 C ATOM 691 CD LYS A 92 -1.565 30.016 95.257 1.00 11.99 C ATOM 692 CE LYS A 92 -2.564 28.944 95.689 1.00 12.59 C ATOM 693 NZ LYS A 92 -2.121 27.565 95.299 1.00 10.87 N ATOM 0 H LYS A 92 -3.255 32.489 99.103 1.00 13.84 H new ATOM 0 HA LYS A 92 -1.735 33.576 97.298 1.00 13.51 H new ATOM 0 HB2 LYS A 92 -1.778 31.263 97.526 1.00 12.85 H new ATOM 0 HB3 LYS A 92 -3.290 31.213 97.147 1.00 12.85 H new ATOM 0 HG2 LYS A 92 -2.856 31.598 94.941 1.00 13.09 H new ATOM 0 HG3 LYS A 92 -1.401 32.075 95.236 1.00 13.09 H new ATOM 0 HD2 LYS A 92 -1.366 29.906 94.314 1.00 11.99 H new ATOM 0 HD3 LYS A 92 -0.733 29.891 95.740 1.00 11.99 H new ATOM 0 HE2 LYS A 92 -2.682 28.984 96.651 1.00 12.59 H new ATOM 0 HE3 LYS A 92 -3.428 29.129 95.289 1.00 12.59 H new ATOM 0 HZ1 LYS A 92 -2.698 26.967 95.618 1.00 10.87 H new ATOM 0 HZ2 LYS A 92 -2.089 27.503 94.412 1.00 10.87 H new ATOM 0 HZ3 LYS A 92 -1.313 27.406 95.636 1.00 10.87 H new ATOM 694 N ALA A 93 -4.829 33.887 96.702 1.00 15.17 N ATOM 695 CA ALA A 93 -5.804 34.568 95.853 1.00 16.14 C ATOM 696 C ALA A 93 -5.651 36.089 95.908 1.00 16.81 C ATOM 697 O ALA A 93 -6.200 36.796 95.064 1.00 18.84 O ATOM 698 CB ALA A 93 -7.224 34.170 96.268 1.00 16.82 C ATOM 0 H ALA A 93 -5.162 33.503 97.396 1.00 15.17 H new ATOM 0 HA ALA A 93 -5.639 34.291 94.938 1.00 16.14 H new ATOM 0 HB1 ALA A 93 -7.866 34.625 95.701 1.00 16.82 H new ATOM 0 HB2 ALA A 93 -7.332 33.211 96.173 1.00 16.82 H new ATOM 0 HB3 ALA A 93 -7.374 34.422 97.193 1.00 16.82 H new ATOM 699 N LEU A 94 -4.898 36.588 96.886 1.00 16.02 N ATOM 700 CA LEU A 94 -4.695 38.032 97.066 1.00 15.87 C ATOM 701 C LEU A 94 -3.307 38.513 96.655 1.00 16.28 C ATOM 702 O LEU A 94 -2.970 39.682 96.846 1.00 17.33 O ATOM 703 CB LEU A 94 -4.908 38.406 98.533 1.00 17.21 C ATOM 704 CG LEU A 94 -6.189 37.942 99.221 1.00 18.11 C ATOM 705 CD1 LEU A 94 -6.073 38.173 100.722 1.00 17.85 C ATOM 706 CD2 LEU A 94 -7.375 38.684 98.637 1.00 20.33 C ATOM 0 H LEU A 94 -4.489 36.102 97.466 1.00 16.02 H new ATOM 0 HA LEU A 94 -5.341 38.464 96.486 1.00 15.87 H new ATOM 0 HB2 LEU A 94 -4.158 38.057 99.039 1.00 17.21 H new ATOM 0 HB3 LEU A 94 -4.870 39.373 98.600 1.00 17.21 H new ATOM 0 HG LEU A 94 -6.323 36.993 99.071 1.00 18.11 H new ATOM 0 HD11 LEU A 94 -6.887 37.878 101.159 1.00 17.85 H new ATOM 0 HD12 LEU A 94 -5.320 37.670 101.070 1.00 17.85 H new ATOM 0 HD13 LEU A 94 -5.938 39.118 100.895 1.00 17.85 H new ATOM 0 HD21 LEU A 94 -8.189 38.389 99.074 1.00 20.33 H new ATOM 0 HD22 LEU A 94 -7.261 39.637 98.776 1.00 20.33 H new ATOM 0 HD23 LEU A 94 -7.435 38.501 97.686 1.00 20.33 H new ATOM 707 N LEU A 95 -2.497 37.624 96.098 1.00 15.00 N ATOM 708 CA LEU A 95 -1.145 37.998 95.709 1.00 15.65 C ATOM 709 C LEU A 95 -1.030 39.055 94.630 1.00 14.10 C ATOM 710 O LEU A 95 -1.859 39.134 93.721 1.00 16.52 O ATOM 711 CB LEU A 95 -0.373 36.769 95.222 1.00 14.49 C ATOM 712 CG LEU A 95 -0.092 35.659 96.229 1.00 13.84 C ATOM 713 CD1 LEU A 95 0.576 34.487 95.516 1.00 16.59 C ATOM 714 CD2 LEU A 95 0.812 36.196 97.339 1.00 13.67 C ATOM 0 H LEU A 95 -2.708 36.806 95.937 1.00 15.00 H new ATOM 0 HA LEU A 95 -0.775 38.382 96.519 1.00 15.65 H new ATOM 0 HB2 LEU A 95 -0.866 36.382 94.482 1.00 14.49 H new ATOM 0 HB3 LEU A 95 0.478 37.073 94.868 1.00 14.49 H new ATOM 0 HG LEU A 95 -0.923 35.353 96.624 1.00 13.84 H new ATOM 0 HD11 LEU A 95 0.756 33.779 96.155 1.00 16.59 H new ATOM 0 HD12 LEU A 95 -0.012 34.153 94.821 1.00 16.59 H new ATOM 0 HD13 LEU A 95 1.410 34.783 95.118 1.00 16.59 H new ATOM 0 HD21 LEU A 95 0.991 35.491 97.980 1.00 13.67 H new ATOM 0 HD22 LEU A 95 1.648 36.504 96.955 1.00 13.67 H new ATOM 0 HD23 LEU A 95 0.371 36.935 97.787 1.00 13.67 H new ATOM 715 N THR A 96 0.005 39.881 94.758 1.00 14.84 N ATOM 716 CA THR A 96 0.340 40.862 93.737 1.00 12.65 C ATOM 717 C THR A 96 1.851 40.773 93.601 1.00 12.28 C ATOM 718 O THR A 96 2.566 40.361 94.523 1.00 12.58 O ATOM 719 CB THR A 96 -0.017 42.343 94.071 1.00 12.92 C ATOM 720 OG1 THR A 96 0.905 42.870 95.029 1.00 13.75 O ATOM 721 CG2 THR A 96 -1.450 42.458 94.570 1.00 15.75 C ATOM 0 H THR A 96 0.530 39.887 95.439 1.00 14.84 H new ATOM 0 HA THR A 96 -0.175 40.653 92.942 1.00 12.65 H new ATOM 0 HB THR A 96 0.054 42.867 93.258 1.00 12.92 H new ATOM 0 HG1 THR A 96 0.501 43.391 95.550 1.00 13.75 H new ATOM 0 HG21 THR A 96 -1.649 43.386 94.771 1.00 15.75 H new ATOM 0 HG22 THR A 96 -2.058 42.138 93.885 1.00 15.75 H new ATOM 0 HG23 THR A 96 -1.557 41.923 95.372 1.00 15.75 H new ATOM 722 N HIS A 97 2.325 41.157 92.430 1.00 10.75 N ATOM 723 CA HIS A 97 3.740 41.150 92.097 1.00 9.87 C ATOM 724 C HIS A 97 4.592 41.862 93.146 1.00 9.95 C ATOM 725 O HIS A 97 5.535 41.286 93.703 1.00 9.76 O ATOM 726 CB HIS A 97 3.906 41.845 90.751 1.00 10.14 C ATOM 727 CG HIS A 97 5.276 41.739 90.174 1.00 9.53 C ATOM 728 ND1 HIS A 97 5.722 40.613 89.518 1.00 10.10 N ATOM 729 CD2 HIS A 97 6.287 42.635 90.121 1.00 10.14 C ATOM 730 CE1 HIS A 97 6.950 40.822 89.082 1.00 9.94 C ATOM 731 NE2 HIS A 97 7.316 42.040 89.434 1.00 9.21 N ATOM 0 H HIS A 97 1.823 41.436 91.790 1.00 10.75 H new ATOM 0 HA HIS A 97 4.045 40.230 92.065 1.00 9.87 H new ATOM 0 HB2 HIS A 97 3.271 41.467 90.123 1.00 10.14 H new ATOM 0 HB3 HIS A 97 3.680 42.783 90.853 1.00 10.14 H new ATOM 0 HD2 HIS A 97 6.286 43.492 90.482 1.00 10.14 H new ATOM 0 HE1 HIS A 97 7.469 40.214 88.607 1.00 9.94 H new ATOM 0 HE2 HIS A 97 8.076 42.403 89.261 1.00 9.21 H new ATOM 732 N ASP A 98 4.260 43.118 93.422 1.00 10.00 N ATOM 733 CA ASP A 98 5.020 43.911 94.382 1.00 11.88 C ATOM 734 C ASP A 98 4.939 43.360 95.804 1.00 10.90 C ATOM 735 O ASP A 98 5.902 43.470 96.561 1.00 10.84 O ATOM 736 CB ASP A 98 4.551 45.371 94.370 1.00 14.36 C ATOM 737 CG ASP A 98 4.954 46.114 93.102 1.00 19.31 C ATOM 738 OD1 ASP A 98 4.497 47.265 92.927 1.00 22.46 O ATOM 739 OD2 ASP A 98 5.726 45.565 92.288 1.00 21.56 O ATOM 0 H ASP A 98 3.596 43.531 93.063 1.00 10.00 H new ATOM 0 HA ASP A 98 5.947 43.861 94.102 1.00 11.88 H new ATOM 0 HB2 ASP A 98 3.586 45.396 94.461 1.00 14.36 H new ATOM 0 HB3 ASP A 98 4.921 45.831 95.140 1.00 14.36 H new ATOM 740 N ASP A 99 3.785 42.795 96.156 1.00 11.04 N ATOM 741 CA ASP A 99 3.550 42.187 97.476 1.00 11.61 C ATOM 742 C ASP A 99 4.589 41.079 97.708 1.00 10.41 C ATOM 743 O ASP A 99 5.289 41.047 98.733 1.00 10.34 O ATOM 744 CB ASP A 99 2.116 41.610 97.505 1.00 13.39 C ATOM 745 CG ASP A 99 1.884 40.577 98.617 1.00 13.61 C ATOM 746 OD1 ASP A 99 1.430 39.457 98.295 1.00 16.46 O ATOM 747 OD2 ASP A 99 2.116 40.891 99.788 1.00 13.54 O ATOM 0 H ASP A 99 3.105 42.751 95.631 1.00 11.04 H new ATOM 0 HA ASP A 99 3.639 42.848 98.181 1.00 11.61 H new ATOM 0 HB2 ASP A 99 1.486 42.339 97.616 1.00 13.39 H new ATOM 0 HB3 ASP A 99 1.925 41.198 96.648 1.00 13.39 H new ATOM 748 N VAL A 100 4.698 40.187 96.734 1.00 9.35 N ATOM 749 CA VAL A 100 5.642 39.081 96.827 1.00 8.86 C ATOM 750 C VAL A 100 7.097 39.563 96.886 1.00 8.46 C ATOM 751 O VAL A 100 7.878 39.103 97.719 1.00 8.50 O ATOM 752 CB VAL A 100 5.452 38.096 95.645 1.00 8.83 C ATOM 753 CG1 VAL A 100 6.549 37.032 95.667 1.00 8.50 C ATOM 754 CG2 VAL A 100 4.069 37.443 95.729 1.00 9.43 C ATOM 0 H VAL A 100 4.235 40.203 96.010 1.00 9.35 H new ATOM 0 HA VAL A 100 5.454 38.619 97.659 1.00 8.86 H new ATOM 0 HB VAL A 100 5.515 38.585 94.810 1.00 8.83 H new ATOM 0 HG11 VAL A 100 6.422 36.421 94.925 1.00 8.50 H new ATOM 0 HG12 VAL A 100 7.416 37.459 95.589 1.00 8.50 H new ATOM 0 HG13 VAL A 100 6.506 36.540 96.502 1.00 8.50 H new ATOM 0 HG21 VAL A 100 3.956 36.828 94.987 1.00 9.43 H new ATOM 0 HG22 VAL A 100 3.990 36.958 96.565 1.00 9.43 H new ATOM 0 HG23 VAL A 100 3.384 38.129 95.687 1.00 9.43 H new ATOM 755 N LYS A 101 7.469 40.502 96.020 1.00 8.26 N ATOM 756 CA LYS A 101 8.845 40.979 96.017 1.00 8.19 C ATOM 757 C LYS A 101 9.236 41.647 97.328 1.00 8.48 C ATOM 758 O LYS A 101 10.335 41.419 97.841 1.00 8.87 O ATOM 759 CB LYS A 101 9.085 41.942 94.843 1.00 9.19 C ATOM 760 CG LYS A 101 8.916 41.283 93.483 1.00 9.23 C ATOM 761 CD LYS A 101 9.258 42.228 92.330 1.00 11.40 C ATOM 762 CE LYS A 101 10.742 42.553 92.279 1.00 11.62 C ATOM 763 NZ LYS A 101 11.039 43.509 91.150 1.00 10.72 N ATOM 0 H LYS A 101 6.952 40.868 95.439 1.00 8.26 H new ATOM 0 HA LYS A 101 9.409 40.197 95.912 1.00 8.19 H new ATOM 0 HB2 LYS A 101 8.469 42.688 94.913 1.00 9.19 H new ATOM 0 HB3 LYS A 101 9.981 42.307 94.910 1.00 9.19 H new ATOM 0 HG2 LYS A 101 9.484 40.498 93.434 1.00 9.23 H new ATOM 0 HG3 LYS A 101 8.001 40.977 93.386 1.00 9.23 H new ATOM 0 HD2 LYS A 101 8.988 41.824 91.491 1.00 11.40 H new ATOM 0 HD3 LYS A 101 8.751 43.050 92.425 1.00 11.40 H new ATOM 0 HE2 LYS A 101 11.022 42.943 93.122 1.00 11.62 H new ATOM 0 HE3 LYS A 101 11.253 41.737 92.161 1.00 11.62 H new ATOM 0 HZ1 LYS A 101 11.920 43.598 91.060 1.00 10.72 H new ATOM 0 HZ2 LYS A 101 10.695 43.191 90.393 1.00 10.72 H new ATOM 0 HZ3 LYS A 101 10.678 44.302 91.330 1.00 10.72 H new ATOM 764 N GLN A 102 8.338 42.455 97.881 1.00 9.55 N ATOM 765 CA GLN A 102 8.638 43.149 99.124 1.00 10.87 C ATOM 766 C GLN A 102 8.842 42.197 100.299 1.00 9.17 C ATOM 767 O GLN A 102 9.807 42.343 101.049 1.00 9.57 O ATOM 768 CB GLN A 102 7.527 44.152 99.446 1.00 12.75 C ATOM 769 CG GLN A 102 7.362 45.220 98.367 1.00 20.32 C ATOM 770 CD GLN A 102 6.249 46.207 98.663 1.00 23.60 C ATOM 771 OE1 GLN A 102 5.145 45.823 99.050 1.00 26.42 O ATOM 772 NE2 GLN A 102 6.531 47.489 98.464 1.00 27.62 N ATOM 0 H GLN A 102 7.558 42.613 97.556 1.00 9.55 H new ATOM 0 HA GLN A 102 9.477 43.618 98.992 1.00 10.87 H new ATOM 0 HB2 GLN A 102 6.689 43.676 99.555 1.00 12.75 H new ATOM 0 HB3 GLN A 102 7.721 44.582 100.294 1.00 12.75 H new ATOM 0 HG2 GLN A 102 8.197 45.704 98.270 1.00 20.32 H new ATOM 0 HG3 GLN A 102 7.184 44.787 97.517 1.00 20.32 H new ATOM 0 HE21 GLN A 102 7.314 47.720 98.193 1.00 27.62 H new ATOM 0 HE22 GLN A 102 5.931 48.088 98.606 1.00 27.62 H new ATOM 773 N ARG A 103 7.942 41.228 100.453 1.00 8.81 N ATOM 774 CA ARG A 103 8.059 40.266 101.555 1.00 8.58 C ATOM 775 C ARG A 103 9.277 39.351 101.377 1.00 8.13 C ATOM 776 O ARG A 103 9.995 39.096 102.341 1.00 8.96 O ATOM 777 CB ARG A 103 6.777 39.441 101.687 1.00 9.01 C ATOM 778 CG ARG A 103 5.574 40.257 102.173 1.00 9.50 C ATOM 779 CD ARG A 103 4.317 39.415 102.354 1.00 10.45 C ATOM 780 NE ARG A 103 3.737 38.950 101.096 1.00 9.98 N ATOM 781 CZ ARG A 103 3.948 37.758 100.541 1.00 10.19 C ATOM 782 NH1 ARG A 103 4.746 36.863 101.133 1.00 10.24 N ATOM 783 NH2 ARG A 103 3.351 37.449 99.399 1.00 11.09 N ATOM 0 H ARG A 103 7.263 41.108 99.939 1.00 8.81 H new ATOM 0 HA ARG A 103 8.188 40.770 102.374 1.00 8.58 H new ATOM 0 HB2 ARG A 103 6.565 39.046 100.827 1.00 9.01 H new ATOM 0 HB3 ARG A 103 6.934 38.709 102.304 1.00 9.01 H new ATOM 0 HG2 ARG A 103 5.797 40.682 103.016 1.00 9.50 H new ATOM 0 HG3 ARG A 103 5.393 40.967 101.537 1.00 9.50 H new ATOM 0 HD2 ARG A 103 4.529 38.647 102.907 1.00 10.45 H new ATOM 0 HD3 ARG A 103 3.654 39.936 102.834 1.00 10.45 H new ATOM 0 HE ARG A 103 3.215 39.492 100.679 1.00 9.98 H new ATOM 0 HH11 ARG A 103 5.128 37.055 101.879 1.00 10.24 H new ATOM 0 HH12 ARG A 103 4.877 36.096 100.768 1.00 10.24 H new ATOM 0 HH21 ARG A 103 2.829 38.017 99.019 1.00 11.09 H new ATOM 0 HH22 ARG A 103 3.485 36.680 99.038 1.00 11.09 H new ATOM 784 N ALA A 104 9.527 38.879 100.156 1.00 7.24 N ATOM 785 CA ALA A 104 10.686 38.019 99.903 1.00 7.17 C ATOM 786 C ALA A 104 11.968 38.781 100.251 1.00 7.23 C ATOM 787 O ALA A 104 12.859 38.244 100.925 1.00 7.72 O ATOM 788 CB ALA A 104 10.717 37.575 98.436 1.00 7.21 C ATOM 0 H ALA A 104 9.043 39.043 99.465 1.00 7.24 H new ATOM 0 HA ALA A 104 10.620 37.226 100.458 1.00 7.17 H new ATOM 0 HB1 ALA A 104 11.489 37.007 98.286 1.00 7.21 H new ATOM 0 HB2 ALA A 104 9.908 37.081 98.230 1.00 7.21 H new ATOM 0 HB3 ALA A 104 10.774 38.355 97.863 1.00 7.21 H new ATOM 789 N TRP A 105 12.068 40.035 99.802 1.00 7.60 N ATOM 790 CA TRP A 105 13.250 40.840 100.088 1.00 7.75 C ATOM 791 C TRP A 105 13.439 41.098 101.590 1.00 7.53 C ATOM 792 O TRP A 105 14.574 41.164 102.061 1.00 8.49 O ATOM 793 CB TRP A 105 13.191 42.171 99.320 1.00 7.89 C ATOM 794 CG TRP A 105 14.100 42.206 98.120 1.00 8.74 C ATOM 795 CD1 TRP A 105 13.730 42.267 96.799 1.00 9.27 C ATOM 796 CD2 TRP A 105 15.532 42.233 98.135 1.00 8.47 C ATOM 797 NE1 TRP A 105 14.849 42.336 95.996 1.00 9.53 N ATOM 798 CE2 TRP A 105 15.967 42.317 96.789 1.00 9.46 C ATOM 799 CE3 TRP A 105 16.496 42.200 99.156 1.00 9.54 C ATOM 800 CZ2 TRP A 105 17.323 42.372 96.444 1.00 9.72 C ATOM 801 CZ3 TRP A 105 17.841 42.256 98.811 1.00 8.76 C ATOM 802 CH2 TRP A 105 18.243 42.342 97.466 1.00 9.34 C ATOM 0 H TRP A 105 11.466 40.432 99.334 1.00 7.60 H new ATOM 0 HA TRP A 105 14.019 40.330 99.789 1.00 7.75 H new ATOM 0 HB2 TRP A 105 12.279 42.331 99.032 1.00 7.89 H new ATOM 0 HB3 TRP A 105 13.430 42.895 99.920 1.00 7.89 H new ATOM 0 HD1 TRP A 105 12.853 42.262 96.491 1.00 9.27 H new ATOM 0 HE1 TRP A 105 14.846 42.383 95.137 1.00 9.53 H new ATOM 0 HE3 TRP A 105 16.239 42.142 100.048 1.00 9.54 H new ATOM 0 HZ2 TRP A 105 17.592 42.427 95.555 1.00 9.72 H new ATOM 0 HZ3 TRP A 105 18.486 42.236 99.481 1.00 8.76 H new ATOM 0 HH2 TRP A 105 19.150 42.379 97.263 1.00 9.34 H new ATOM 803 N GLN A 106 12.346 41.240 102.339 1.00 8.44 N ATOM 804 CA GLN A 106 12.460 41.468 103.785 1.00 9.31 C ATOM 805 C GLN A 106 13.167 40.281 104.460 1.00 8.80 C ATOM 806 O GLN A 106 14.100 40.457 105.254 1.00 9.71 O ATOM 807 CB GLN A 106 11.071 41.686 104.395 1.00 11.33 C ATOM 808 CG GLN A 106 11.066 41.797 105.920 1.00 13.78 C ATOM 809 CD GLN A 106 9.715 42.213 106.479 1.00 17.51 C ATOM 810 OE1 GLN A 106 8.667 41.863 105.938 1.00 19.09 O ATOM 811 NE2 GLN A 106 9.738 42.949 107.585 1.00 20.57 N ATOM 0 H GLN A 106 11.541 41.209 102.038 1.00 8.44 H new ATOM 0 HA GLN A 106 12.992 42.265 103.935 1.00 9.31 H new ATOM 0 HB2 GLN A 106 10.688 42.495 104.021 1.00 11.33 H new ATOM 0 HB3 GLN A 106 10.495 40.951 104.132 1.00 11.33 H new ATOM 0 HG2 GLN A 106 11.320 40.943 106.303 1.00 13.78 H new ATOM 0 HG3 GLN A 106 11.737 42.441 106.195 1.00 13.78 H new ATOM 0 HE21 GLN A 106 10.490 43.175 107.936 1.00 20.57 H new ATOM 0 HE22 GLN A 106 9.001 43.199 107.950 1.00 20.57 H new ATOM 812 N THR A 107 12.725 39.072 104.129 1.00 7.76 N ATOM 813 CA THR A 107 13.343 37.878 104.693 1.00 7.25 C ATOM 814 C THR A 107 14.752 37.661 104.140 1.00 6.71 C ATOM 815 O THR A 107 15.645 37.257 104.881 1.00 7.34 O ATOM 816 CB THR A 107 12.441 36.656 104.457 1.00 7.55 C ATOM 817 OG1 THR A 107 11.248 36.830 105.228 1.00 8.47 O ATOM 818 CG2 THR A 107 13.129 35.353 104.883 1.00 7.68 C ATOM 0 H THR A 107 12.076 38.922 103.586 1.00 7.76 H new ATOM 0 HA THR A 107 13.438 38.003 105.650 1.00 7.25 H new ATOM 0 HB THR A 107 12.244 36.590 103.509 1.00 7.55 H new ATOM 0 HG1 THR A 107 10.732 36.180 105.097 1.00 8.47 H new ATOM 0 HG21 THR A 107 12.534 34.605 104.721 1.00 7.68 H new ATOM 0 HG22 THR A 107 13.944 35.234 104.370 1.00 7.68 H new ATOM 0 HG23 THR A 107 13.345 35.395 105.828 1.00 7.68 H new ATOM 819 N LEU A 108 14.975 37.959 102.860 1.00 7.03 N ATOM 820 CA LEU A 108 16.311 37.802 102.287 1.00 7.30 C ATOM 821 C LEU A 108 17.320 38.702 103.006 1.00 7.23 C ATOM 822 O LEU A 108 18.471 38.310 103.213 1.00 7.65 O ATOM 823 CB LEU A 108 16.299 38.109 100.779 1.00 7.93 C ATOM 824 CG LEU A 108 15.704 37.001 99.890 1.00 6.85 C ATOM 825 CD1 LEU A 108 15.288 37.559 98.527 1.00 8.33 C ATOM 826 CD2 LEU A 108 16.719 35.889 99.716 1.00 7.75 C ATOM 0 H LEU A 108 14.377 38.249 102.314 1.00 7.03 H new ATOM 0 HA LEU A 108 16.582 36.879 102.409 1.00 7.30 H new ATOM 0 HB2 LEU A 108 15.796 38.926 100.634 1.00 7.93 H new ATOM 0 HB3 LEU A 108 17.209 38.281 100.491 1.00 7.93 H new ATOM 0 HG LEU A 108 14.911 36.647 100.323 1.00 6.85 H new ATOM 0 HD11 LEU A 108 14.917 36.846 97.985 1.00 8.33 H new ATOM 0 HD12 LEU A 108 14.620 38.251 98.651 1.00 8.33 H new ATOM 0 HD13 LEU A 108 16.063 37.934 98.080 1.00 8.33 H new ATOM 0 HD21 LEU A 108 16.343 35.192 99.156 1.00 7.75 H new ATOM 0 HD22 LEU A 108 17.519 36.243 99.297 1.00 7.75 H new ATOM 0 HD23 LEU A 108 16.946 35.519 100.583 1.00 7.75 H new ATOM 827 N LYS A 109 16.906 39.906 103.391 1.00 7.72 N ATOM 828 CA LYS A 109 17.831 40.786 104.103 1.00 8.88 C ATOM 829 C LYS A 109 18.207 40.194 105.461 1.00 7.51 C ATOM 830 O LYS A 109 19.360 40.316 105.890 1.00 7.93 O ATOM 831 CB LYS A 109 17.242 42.190 104.267 1.00 9.23 C ATOM 832 CG LYS A 109 17.213 42.965 102.955 1.00 10.20 C ATOM 833 CD LYS A 109 16.651 44.365 103.133 1.00 12.47 C ATOM 834 CE LYS A 109 16.518 45.045 101.778 1.00 14.16 C ATOM 835 NZ LYS A 109 16.026 46.448 101.914 1.00 17.40 N ATOM 0 H LYS A 109 16.119 40.226 103.256 1.00 7.72 H new ATOM 0 HA LYS A 109 18.638 40.862 103.571 1.00 8.88 H new ATOM 0 HB2 LYS A 109 16.341 42.121 104.619 1.00 9.23 H new ATOM 0 HB3 LYS A 109 17.764 42.683 104.919 1.00 9.23 H new ATOM 0 HG2 LYS A 109 18.111 43.022 102.594 1.00 10.20 H new ATOM 0 HG3 LYS A 109 16.677 42.482 102.307 1.00 10.20 H new ATOM 0 HD2 LYS A 109 15.785 44.322 103.569 1.00 12.47 H new ATOM 0 HD3 LYS A 109 17.233 44.885 103.709 1.00 12.47 H new ATOM 0 HE2 LYS A 109 17.378 45.045 101.329 1.00 14.16 H new ATOM 0 HE3 LYS A 109 15.907 44.539 101.220 1.00 14.16 H new ATOM 0 HZ1 LYS A 109 15.959 46.819 101.108 1.00 17.40 H new ATOM 0 HZ2 LYS A 109 15.227 46.446 102.307 1.00 17.40 H new ATOM 0 HZ3 LYS A 109 16.598 46.917 102.409 1.00 17.40 H new ATOM 836 N TRP A 110 17.251 39.556 106.138 1.00 7.80 N ATOM 837 CA TRP A 110 17.549 38.907 107.419 1.00 7.31 C ATOM 838 C TRP A 110 18.552 37.781 107.152 1.00 7.12 C ATOM 839 O TRP A 110 19.480 37.558 107.936 1.00 7.67 O ATOM 840 CB TRP A 110 16.281 38.313 108.038 1.00 8.12 C ATOM 841 CG TRP A 110 15.246 39.314 108.475 1.00 7.39 C ATOM 842 CD1 TRP A 110 15.296 40.680 108.336 1.00 9.13 C ATOM 843 CD2 TRP A 110 13.981 39.021 109.084 1.00 7.70 C ATOM 844 NE1 TRP A 110 14.138 41.245 108.820 1.00 9.59 N ATOM 845 CE2 TRP A 110 13.314 40.253 109.283 1.00 9.77 C ATOM 846 CE3 TRP A 110 13.345 37.832 109.483 1.00 8.21 C ATOM 847 CZ2 TRP A 110 12.038 40.333 109.860 1.00 9.01 C ATOM 848 CZ3 TRP A 110 12.074 37.910 110.061 1.00 8.26 C ATOM 849 CH2 TRP A 110 11.435 39.155 110.243 1.00 8.99 C ATOM 0 H TRP A 110 16.434 39.487 105.879 1.00 7.80 H new ATOM 0 HA TRP A 110 17.911 39.561 108.037 1.00 7.31 H new ATOM 0 HB2 TRP A 110 15.876 37.712 107.393 1.00 8.12 H new ATOM 0 HB3 TRP A 110 16.535 37.777 108.805 1.00 8.12 H new ATOM 0 HD1 TRP A 110 16.008 41.153 107.969 1.00 9.13 H new ATOM 0 HE1 TRP A 110 13.960 42.086 108.830 1.00 9.59 H new ATOM 0 HE3 TRP A 110 13.762 37.009 109.365 1.00 8.21 H new ATOM 0 HZ2 TRP A 110 11.614 41.152 109.980 1.00 9.01 H new ATOM 0 HZ3 TRP A 110 11.644 37.130 110.329 1.00 8.26 H new ATOM 0 HH2 TRP A 110 10.589 39.181 110.629 1.00 8.99 H new ATOM 850 N GLN A 111 18.371 37.070 106.043 1.00 6.16 N ATOM 851 CA GLN A 111 19.282 35.983 105.700 1.00 6.60 C ATOM 852 C GLN A 111 20.700 36.499 105.422 1.00 6.79 C ATOM 853 O GLN A 111 21.679 35.902 105.870 1.00 7.63 O ATOM 854 CB GLN A 111 18.733 35.199 104.505 1.00 6.96 C ATOM 855 CG GLN A 111 17.459 34.431 104.859 1.00 5.95 C ATOM 856 CD GLN A 111 16.885 33.660 103.688 1.00 6.66 C ATOM 857 OE1 GLN A 111 16.632 34.225 102.620 1.00 7.54 O ATOM 858 NE2 GLN A 111 16.666 32.359 103.880 1.00 6.71 N ATOM 0 H GLN A 111 17.733 37.199 105.481 1.00 6.16 H new ATOM 0 HA GLN A 111 19.344 35.386 106.462 1.00 6.60 H new ATOM 0 HB2 GLN A 111 18.548 35.811 103.775 1.00 6.96 H new ATOM 0 HB3 GLN A 111 19.407 34.577 104.190 1.00 6.96 H new ATOM 0 HG2 GLN A 111 17.650 33.814 105.583 1.00 5.95 H new ATOM 0 HG3 GLN A 111 16.792 35.055 105.187 1.00 5.95 H new ATOM 0 HE21 GLN A 111 16.854 31.998 104.638 1.00 6.71 H new ATOM 0 HE22 GLN A 111 16.336 31.880 103.246 1.00 6.71 H new ATOM 859 N ILE A 112 20.820 37.606 104.684 1.00 7.37 N ATOM 860 CA ILE A 112 22.142 38.182 104.408 1.00 7.79 C ATOM 861 C ILE A 112 22.822 38.543 105.742 1.00 6.70 C ATOM 862 O ILE A 112 24.003 38.251 105.956 1.00 7.46 O ATOM 863 CB ILE A 112 22.022 39.459 103.521 1.00 7.24 C ATOM 864 CG1 ILE A 112 21.418 39.088 102.162 1.00 9.11 C ATOM 865 CG2 ILE A 112 23.402 40.109 103.336 1.00 8.62 C ATOM 866 CD1 ILE A 112 21.062 40.297 101.281 1.00 9.69 C ATOM 0 H ILE A 112 20.159 38.034 104.338 1.00 7.37 H new ATOM 0 HA ILE A 112 22.673 37.528 103.927 1.00 7.79 H new ATOM 0 HB ILE A 112 21.440 40.098 103.960 1.00 7.24 H new ATOM 0 HG12 ILE A 112 22.046 38.525 101.683 1.00 9.11 H new ATOM 0 HG13 ILE A 112 20.618 38.560 102.308 1.00 9.11 H new ATOM 0 HG21 ILE A 112 23.315 40.901 102.783 1.00 8.62 H new ATOM 0 HG22 ILE A 112 23.762 40.357 104.202 1.00 8.62 H new ATOM 0 HG23 ILE A 112 24.001 39.479 102.906 1.00 8.62 H new ATOM 0 HD11 ILE A 112 20.687 39.987 100.442 1.00 9.69 H new ATOM 0 HD12 ILE A 112 20.412 40.852 101.740 1.00 9.69 H new ATOM 0 HD13 ILE A 112 21.862 40.816 101.105 1.00 9.69 H new ATOM 867 N ALA A 113 22.053 39.154 106.635 1.00 7.05 N ATOM 868 CA ALA A 113 22.542 39.550 107.954 1.00 7.42 C ATOM 869 C ALA A 113 22.999 38.335 108.761 1.00 8.19 C ATOM 870 O ALA A 113 23.890 38.441 109.611 1.00 9.13 O ATOM 871 CB ALA A 113 21.440 40.283 108.714 1.00 8.84 C ATOM 0 H ALA A 113 21.228 39.352 106.494 1.00 7.05 H new ATOM 0 HA ALA A 113 23.303 40.138 107.830 1.00 7.42 H new ATOM 0 HB1 ALA A 113 21.768 40.544 109.589 1.00 8.84 H new ATOM 0 HB2 ALA A 113 21.176 41.074 108.219 1.00 8.84 H new ATOM 0 HB3 ALA A 113 20.674 39.697 108.818 1.00 8.84 H new ATOM 872 N ASN A 114 22.381 37.185 108.489 1.00 7.48 N ATOM 873 CA ASN A 114 22.689 35.935 109.180 1.00 7.50 C ATOM 874 C ASN A 114 23.700 35.049 108.456 1.00 7.28 C ATOM 875 O ASN A 114 23.773 33.839 108.702 1.00 7.70 O ATOM 876 CB ASN A 114 21.393 35.160 109.448 1.00 8.24 C ATOM 877 CG ASN A 114 20.489 35.871 110.426 1.00 8.93 C ATOM 878 OD1 ASN A 114 20.949 36.695 111.221 1.00 11.23 O ATOM 879 ND2 ASN A 114 19.201 35.539 110.399 1.00 10.67 N ATOM 0 H ASN A 114 21.766 37.109 107.893 1.00 7.48 H new ATOM 0 HA ASN A 114 23.115 36.184 110.015 1.00 7.50 H new ATOM 0 HB2 ASN A 114 20.920 35.027 108.612 1.00 8.24 H new ATOM 0 HB3 ASN A 114 21.611 34.280 109.794 1.00 8.24 H new ATOM 0 HD21 ASN A 114 18.651 35.903 110.951 1.00 10.67 H new ATOM 0 HD22 ASN A 114 18.918 34.960 109.830 1.00 10.67 H new ATOM 880 N GLY A 115 24.469 35.652 107.551 1.00 6.85 N ATOM 881 CA GLY A 115 25.516 34.935 106.847 1.00 7.35 C ATOM 882 C GLY A 115 25.107 33.852 105.874 1.00 6.24 C ATOM 883 O GLY A 115 25.901 32.968 105.557 1.00 6.70 O ATOM 0 H GLY A 115 24.396 36.481 107.333 1.00 6.85 H new ATOM 0 HA2 GLY A 115 26.046 35.586 106.361 1.00 7.35 H new ATOM 0 HA3 GLY A 115 26.098 34.533 107.511 1.00 7.35 H new ATOM 884 N ILE A 116 23.871 33.932 105.384 1.00 6.77 N ATOM 885 CA ILE A 116 23.351 32.949 104.439 1.00 6.55 C ATOM 886 C ILE A 116 23.554 33.491 103.023 1.00 6.24 C ATOM 887 O ILE A 116 22.985 34.525 102.674 1.00 7.21 O ATOM 888 CB ILE A 116 21.838 32.700 104.699 1.00 6.17 C ATOM 889 CG1 ILE A 116 21.629 32.122 106.105 1.00 7.01 C ATOM 890 CG2 ILE A 116 21.277 31.758 103.643 1.00 7.01 C ATOM 891 CD1 ILE A 116 20.165 32.149 106.555 1.00 7.01 C ATOM 0 H ILE A 116 23.314 34.554 105.589 1.00 6.77 H new ATOM 0 HA ILE A 116 23.820 32.107 104.547 1.00 6.55 H new ATOM 0 HB ILE A 116 21.365 33.545 104.643 1.00 6.17 H new ATOM 0 HG12 ILE A 116 21.950 31.207 106.124 1.00 7.01 H new ATOM 0 HG13 ILE A 116 22.166 32.624 106.738 1.00 7.01 H new ATOM 0 HG21 ILE A 116 20.334 31.608 103.812 1.00 7.01 H new ATOM 0 HG22 ILE A 116 21.389 32.153 102.764 1.00 7.01 H new ATOM 0 HG23 ILE A 116 21.750 30.912 103.679 1.00 7.01 H new ATOM 0 HD11 ILE A 116 20.093 31.773 107.446 1.00 7.01 H new ATOM 0 HD12 ILE A 116 19.846 33.065 106.564 1.00 7.01 H new ATOM 0 HD13 ILE A 116 19.628 31.626 105.940 1.00 7.01 H new ATOM 892 N GLN A 117 24.356 32.790 102.223 1.00 6.15 N ATOM 893 CA GLN A 117 24.647 33.216 100.846 1.00 6.38 C ATOM 894 C GLN A 117 24.059 32.308 99.765 1.00 7.36 C ATOM 895 O GLN A 117 24.195 32.583 98.570 1.00 7.51 O ATOM 896 CB GLN A 117 26.170 33.358 100.633 1.00 7.60 C ATOM 897 CG GLN A 117 26.799 34.479 101.477 1.00 7.60 C ATOM 898 CD GLN A 117 28.296 34.687 101.226 1.00 8.46 C ATOM 899 OE1 GLN A 117 28.752 34.371 100.029 1.00 11.01 O flip ATOM 900 NE2 GLN A 117 29.027 35.150 102.120 1.00 6.68 N flip ATOM 0 H GLN A 117 24.746 32.060 102.457 1.00 6.15 H new ATOM 0 HA GLN A 117 24.209 34.075 100.746 1.00 6.38 H new ATOM 0 HB2 GLN A 117 26.601 32.517 100.851 1.00 7.60 H new ATOM 0 HB3 GLN A 117 26.344 33.531 99.695 1.00 7.60 H new ATOM 0 HG2 GLN A 117 26.332 35.309 101.294 1.00 7.60 H new ATOM 0 HG3 GLN A 117 26.663 34.278 102.416 1.00 7.60 H new ATOM 0 HE21 GLN A 117 28.695 35.345 102.889 1.00 6.68 H new ATOM 0 HE22 GLN A 117 29.864 35.275 101.969 1.00 6.68 H new ATOM 901 N HIS A 118 23.388 31.238 100.191 1.00 6.35 N ATOM 902 CA HIS A 118 22.766 30.270 99.282 1.00 6.89 C ATOM 903 C HIS A 118 21.392 29.943 99.845 1.00 5.73 C ATOM 904 O HIS A 118 21.271 29.538 101.003 1.00 6.72 O ATOM 905 CB HIS A 118 23.617 28.997 99.198 1.00 7.96 C ATOM 906 CG HIS A 118 24.969 29.222 98.603 1.00 9.29 C ATOM 907 ND1 HIS A 118 25.168 29.346 97.244 1.00 10.82 N ATOM 908 CD2 HIS A 118 26.179 29.411 99.181 1.00 11.15 C ATOM 909 CE1 HIS A 118 26.442 29.606 97.011 1.00 12.51 C ATOM 910 NE2 HIS A 118 27.077 29.652 98.167 1.00 10.71 N ATOM 0 H HIS A 118 23.279 31.051 101.023 1.00 6.35 H new ATOM 0 HA HIS A 118 22.694 30.638 98.387 1.00 6.89 H new ATOM 0 HB2 HIS A 118 23.721 28.627 100.089 1.00 7.96 H new ATOM 0 HB3 HIS A 118 23.145 28.335 98.669 1.00 7.96 H new ATOM 0 HD1 HIS A 118 24.558 29.267 96.643 1.00 10.82 H new ATOM 0 HD2 HIS A 118 26.367 29.383 100.091 1.00 11.15 H new ATOM 0 HE1 HIS A 118 26.826 29.735 96.174 1.00 12.51 H new ATOM 911 N VAL A 119 20.358 30.116 99.025 1.00 5.87 N ATOM 912 CA VAL A 119 18.984 29.883 99.461 1.00 5.88 C ATOM 913 C VAL A 119 18.186 29.164 98.384 1.00 6.01 C ATOM 914 O VAL A 119 18.278 29.524 97.206 1.00 6.55 O ATOM 915 CB VAL A 119 18.262 31.236 99.752 1.00 5.75 C ATOM 916 CG1 VAL A 119 16.797 30.991 100.110 1.00 6.01 C ATOM 917 CG2 VAL A 119 18.978 31.995 100.866 1.00 6.01 C ATOM 0 H VAL A 119 20.432 30.370 98.207 1.00 5.87 H new ATOM 0 HA VAL A 119 19.029 29.341 100.264 1.00 5.88 H new ATOM 0 HB VAL A 119 18.290 31.782 98.951 1.00 5.75 H new ATOM 0 HG11 VAL A 119 16.361 31.839 100.288 1.00 6.01 H new ATOM 0 HG12 VAL A 119 16.352 30.549 99.370 1.00 6.01 H new ATOM 0 HG13 VAL A 119 16.746 30.430 100.899 1.00 6.01 H new ATOM 0 HG21 VAL A 119 18.518 32.832 101.035 1.00 6.01 H new ATOM 0 HG22 VAL A 119 18.979 31.459 101.674 1.00 6.01 H new ATOM 0 HG23 VAL A 119 19.892 32.177 100.598 1.00 6.01 H new ATOM 918 N ARG A 120 17.429 28.136 98.781 1.00 5.91 N ATOM 919 CA ARG A 120 16.544 27.429 97.856 1.00 5.39 C ATOM 920 C ARG A 120 15.132 27.728 98.346 1.00 5.47 C ATOM 921 O ARG A 120 14.747 27.316 99.450 1.00 6.34 O ATOM 922 CB ARG A 120 16.789 25.918 97.869 1.00 5.68 C ATOM 923 CG ARG A 120 15.731 25.139 97.076 1.00 5.49 C ATOM 924 CD ARG A 120 16.031 23.644 97.038 1.00 6.01 C ATOM 925 NE ARG A 120 17.102 23.324 96.095 1.00 6.05 N ATOM 926 CZ ARG A 120 17.605 22.105 95.908 1.00 6.19 C ATOM 927 NH1 ARG A 120 17.139 21.073 96.608 1.00 7.39 N ATOM 928 NH2 ARG A 120 18.571 21.908 95.011 1.00 7.67 N ATOM 0 H ARG A 120 17.415 27.833 99.586 1.00 5.91 H new ATOM 0 HA ARG A 120 16.697 27.720 96.944 1.00 5.39 H new ATOM 0 HB2 ARG A 120 17.666 25.733 97.499 1.00 5.68 H new ATOM 0 HB3 ARG A 120 16.797 25.603 98.787 1.00 5.68 H new ATOM 0 HG2 ARG A 120 14.858 25.283 97.475 1.00 5.49 H new ATOM 0 HG3 ARG A 120 15.689 25.483 96.170 1.00 5.49 H new ATOM 0 HD2 ARG A 120 16.282 23.343 97.925 1.00 6.01 H new ATOM 0 HD3 ARG A 120 15.228 23.160 96.790 1.00 6.01 H new ATOM 0 HE ARG A 120 17.430 23.968 95.629 1.00 6.05 H new ATOM 0 HH11 ARG A 120 16.511 21.192 97.183 1.00 7.39 H new ATOM 0 HH12 ARG A 120 17.466 20.287 96.485 1.00 7.39 H new ATOM 0 HH21 ARG A 120 18.872 22.569 94.551 1.00 7.67 H new ATOM 0 HH22 ARG A 120 18.894 21.120 94.893 1.00 7.67 H new ATOM 929 N THR A 121 14.373 28.472 97.548 1.00 6.19 N ATOM 930 CA THR A 121 13.003 28.785 97.912 1.00 5.71 C ATOM 931 C THR A 121 12.028 28.008 97.044 1.00 6.03 C ATOM 932 O THR A 121 12.227 27.864 95.835 1.00 6.74 O ATOM 933 CB THR A 121 12.672 30.305 97.758 1.00 5.61 C ATOM 934 OG1 THR A 121 11.327 30.537 98.197 1.00 6.65 O ATOM 935 CG2 THR A 121 12.809 30.789 96.305 1.00 7.07 C ATOM 0 H THR A 121 14.633 28.802 96.797 1.00 6.19 H new ATOM 0 HA THR A 121 12.912 28.536 98.845 1.00 5.71 H new ATOM 0 HB THR A 121 13.308 30.800 98.297 1.00 5.61 H new ATOM 0 HG1 THR A 121 10.956 31.089 97.684 1.00 6.65 H new ATOM 0 HG21 THR A 121 12.595 31.734 96.257 1.00 7.07 H new ATOM 0 HG22 THR A 121 13.719 30.648 96.001 1.00 7.07 H new ATOM 0 HG23 THR A 121 12.199 30.291 95.739 1.00 7.07 H new ATOM 936 N HIS A 122 11.006 27.452 97.681 1.00 6.66 N ATOM 937 CA HIS A 122 9.948 26.781 96.945 1.00 6.65 C ATOM 938 C HIS A 122 8.987 27.926 96.620 1.00 7.24 C ATOM 939 O HIS A 122 8.934 28.920 97.353 1.00 9.43 O ATOM 940 CB HIS A 122 9.277 25.711 97.825 1.00 7.24 C ATOM 941 CG HIS A 122 10.184 24.566 98.156 1.00 6.04 C ATOM 942 ND1 HIS A 122 10.147 23.359 97.490 1.00 7.03 N ATOM 943 CD2 HIS A 122 11.216 24.483 99.026 1.00 6.86 C ATOM 944 CE1 HIS A 122 11.122 22.584 97.935 1.00 5.80 C ATOM 945 NE2 HIS A 122 11.787 23.245 98.866 1.00 6.19 N ATOM 0 H HIS A 122 10.907 27.453 98.535 1.00 6.66 H new ATOM 0 HA HIS A 122 10.255 26.310 96.154 1.00 6.65 H new ATOM 0 HB2 HIS A 122 8.972 26.123 98.649 1.00 7.24 H new ATOM 0 HB3 HIS A 122 8.491 25.372 97.369 1.00 7.24 H new ATOM 0 HD2 HIS A 122 11.488 25.143 99.622 1.00 6.86 H new ATOM 0 HE1 HIS A 122 11.308 21.721 97.643 1.00 5.80 H new ATOM 0 HE2 HIS A 122 12.467 22.948 99.301 1.00 6.19 H new ATOM 946 N VAL A 123 8.297 27.830 95.485 1.00 5.41 N ATOM 947 CA VAL A 123 7.315 28.840 95.074 1.00 5.54 C ATOM 948 C VAL A 123 6.116 28.057 94.567 1.00 5.15 C ATOM 949 O VAL A 123 6.259 27.194 93.706 1.00 5.44 O ATOM 950 CB VAL A 123 7.846 29.755 93.940 1.00 5.72 C ATOM 951 CG1 VAL A 123 6.743 30.707 93.488 1.00 7.70 C ATOM 952 CG2 VAL A 123 9.056 30.555 94.428 1.00 7.33 C ATOM 0 H VAL A 123 8.383 27.179 94.930 1.00 5.41 H new ATOM 0 HA VAL A 123 7.104 29.423 95.820 1.00 5.54 H new ATOM 0 HB VAL A 123 8.119 29.202 93.191 1.00 5.72 H new ATOM 0 HG11 VAL A 123 7.078 31.278 92.779 1.00 7.70 H new ATOM 0 HG12 VAL A 123 5.987 30.195 93.160 1.00 7.70 H new ATOM 0 HG13 VAL A 123 6.461 31.255 94.237 1.00 7.70 H new ATOM 0 HG21 VAL A 123 9.379 31.123 93.711 1.00 7.33 H new ATOM 0 HG22 VAL A 123 8.797 31.105 95.184 1.00 7.33 H new ATOM 0 HG23 VAL A 123 9.760 29.945 94.699 1.00 7.33 H new ATOM 953 N ASP A 124 4.946 28.348 95.127 1.00 5.74 N ATOM 954 CA ASP A 124 3.725 27.638 94.751 1.00 6.06 C ATOM 955 C ASP A 124 3.338 27.948 93.299 1.00 5.67 C ATOM 956 O ASP A 124 3.092 29.106 92.958 1.00 7.82 O ATOM 957 CB ASP A 124 2.616 28.046 95.738 1.00 8.23 C ATOM 958 CG ASP A 124 1.307 27.304 95.526 1.00 9.21 C ATOM 959 OD1 ASP A 124 0.393 27.519 96.347 1.00 10.57 O ATOM 960 OD2 ASP A 124 1.180 26.531 94.566 1.00 8.65 O ATOM 0 H ASP A 124 4.836 28.954 95.728 1.00 5.74 H new ATOM 0 HA ASP A 124 3.863 26.679 94.799 1.00 6.06 H new ATOM 0 HB2 ASP A 124 2.926 27.887 96.644 1.00 8.23 H new ATOM 0 HB3 ASP A 124 2.455 28.999 95.656 1.00 8.23 H new ATOM 961 N VAL A 125 3.311 26.914 92.453 1.00 5.60 N ATOM 962 CA VAL A 125 2.935 27.063 91.050 1.00 6.61 C ATOM 963 C VAL A 125 1.574 26.428 90.733 1.00 6.77 C ATOM 964 O VAL A 125 1.263 26.138 89.576 1.00 6.76 O ATOM 965 CB VAL A 125 4.050 26.539 90.085 1.00 6.76 C ATOM 966 CG1 VAL A 125 5.315 27.379 90.277 1.00 7.65 C ATOM 967 CG2 VAL A 125 4.352 25.063 90.328 1.00 7.20 C ATOM 0 H VAL A 125 3.510 26.109 92.679 1.00 5.60 H new ATOM 0 HA VAL A 125 2.842 28.016 90.896 1.00 6.61 H new ATOM 0 HB VAL A 125 3.734 26.624 89.172 1.00 6.76 H new ATOM 0 HG11 VAL A 125 6.010 27.059 89.681 1.00 7.65 H new ATOM 0 HG12 VAL A 125 5.120 28.308 90.076 1.00 7.65 H new ATOM 0 HG13 VAL A 125 5.617 27.304 91.196 1.00 7.65 H new ATOM 0 HG21 VAL A 125 5.045 24.769 89.716 1.00 7.20 H new ATOM 0 HG22 VAL A 125 4.655 24.941 91.241 1.00 7.20 H new ATOM 0 HG23 VAL A 125 3.549 24.540 90.181 1.00 7.20 H new ATOM 968 N SER A 126 0.768 26.205 91.777 1.00 7.75 N ATOM 969 CA SER A 126 -0.604 25.706 91.602 1.00 8.00 C ATOM 970 C SER A 126 -1.377 27.017 91.527 1.00 9.44 C ATOM 971 O SER A 126 -2.142 27.372 92.427 1.00 9.35 O ATOM 972 CB SER A 126 -1.074 24.899 92.822 1.00 8.69 C ATOM 973 OG SER A 126 -0.393 23.661 92.947 1.00 8.62 O ATOM 0 H SER A 126 0.996 26.336 92.596 1.00 7.75 H new ATOM 0 HA SER A 126 -0.709 25.113 90.842 1.00 8.00 H new ATOM 0 HB2 SER A 126 -0.936 25.424 93.626 1.00 8.69 H new ATOM 0 HB3 SER A 126 -2.027 24.735 92.750 1.00 8.69 H new ATOM 0 HG SER A 126 -0.347 23.289 92.195 1.00 8.62 H new ATOM 974 N ASP A 127 -1.163 27.744 90.439 1.00 9.50 N ATOM 975 CA ASP A 127 -1.762 29.059 90.252 1.00 10.35 C ATOM 976 C ASP A 127 -1.590 29.415 88.782 1.00 10.46 C ATOM 977 O ASP A 127 -0.471 29.639 88.322 1.00 10.10 O ATOM 978 CB ASP A 127 -1.015 30.056 91.147 1.00 11.94 C ATOM 979 CG ASP A 127 -1.470 31.490 90.966 1.00 11.28 C ATOM 980 OD1 ASP A 127 -0.957 32.355 91.702 1.00 13.22 O ATOM 981 OD2 ASP A 127 -2.324 31.767 90.096 1.00 11.83 O ATOM 0 H ASP A 127 -0.665 27.489 89.786 1.00 9.50 H new ATOM 0 HA ASP A 127 -2.703 29.076 90.488 1.00 10.35 H new ATOM 0 HB2 ASP A 127 -1.136 29.800 92.075 1.00 11.94 H new ATOM 0 HB3 ASP A 127 -0.065 30.000 90.959 1.00 11.94 H new ATOM 982 N ALA A 128 -2.695 29.462 88.047 1.00 10.57 N ATOM 983 CA ALA A 128 -2.639 29.760 86.623 1.00 11.01 C ATOM 984 C ALA A 128 -1.958 31.087 86.291 1.00 10.32 C ATOM 985 O ALA A 128 -1.385 31.233 85.209 1.00 11.82 O ATOM 986 CB ALA A 128 -4.042 29.729 86.039 1.00 12.11 C ATOM 0 H ALA A 128 -3.486 29.324 88.354 1.00 10.57 H new ATOM 0 HA ALA A 128 -2.087 29.072 86.220 1.00 11.01 H new ATOM 0 HB1 ALA A 128 -4.002 29.928 85.090 1.00 12.11 H new ATOM 0 HB2 ALA A 128 -4.427 28.848 86.169 1.00 12.11 H new ATOM 0 HB3 ALA A 128 -4.593 30.391 86.485 1.00 12.11 H new ATOM 987 N THR A 129 -1.999 32.046 87.212 1.00 9.21 N ATOM 988 CA THR A 129 -1.377 33.345 86.973 1.00 9.86 C ATOM 989 C THR A 129 0.125 33.352 87.232 1.00 9.59 C ATOM 990 O THR A 129 0.818 34.267 86.792 1.00 9.63 O ATOM 991 CB THR A 129 -1.990 34.456 87.861 1.00 10.70 C ATOM 992 OG1 THR A 129 -1.589 34.252 89.225 1.00 11.54 O ATOM 993 CG2 THR A 129 -3.509 34.449 87.765 1.00 12.52 C ATOM 0 H THR A 129 -2.380 31.965 87.979 1.00 9.21 H new ATOM 0 HA THR A 129 -1.546 33.519 86.034 1.00 9.86 H new ATOM 0 HB THR A 129 -1.668 35.316 87.549 1.00 10.70 H new ATOM 0 HG1 THR A 129 -1.883 33.513 89.496 1.00 11.54 H new ATOM 0 HG21 THR A 129 -3.872 35.151 88.327 1.00 12.52 H new ATOM 0 HG22 THR A 129 -3.776 34.602 86.845 1.00 12.52 H new ATOM 0 HG23 THR A 129 -3.848 33.590 88.061 1.00 12.52 H new ATOM 994 N LEU A 130 0.613 32.343 87.959 1.00 8.45 N ATOM 995 CA LEU A 130 2.029 32.231 88.331 1.00 7.94 C ATOM 996 C LEU A 130 2.565 33.562 88.856 1.00 7.25 C ATOM 997 O LEU A 130 3.715 33.931 88.619 1.00 8.04 O ATOM 998 CB LEU A 130 2.862 31.725 87.144 1.00 8.32 C ATOM 999 CG LEU A 130 2.529 30.298 86.678 1.00 8.28 C ATOM 1000 CD1 LEU A 130 3.319 29.976 85.418 1.00 9.32 C ATOM 1001 CD2 LEU A 130 2.867 29.277 87.781 1.00 8.72 C ATOM 0 H LEU A 130 0.127 31.698 88.253 1.00 8.45 H new ATOM 0 HA LEU A 130 2.104 31.582 89.048 1.00 7.94 H new ATOM 0 HB2 LEU A 130 2.738 32.332 86.397 1.00 8.32 H new ATOM 0 HB3 LEU A 130 3.801 31.761 87.386 1.00 8.32 H new ATOM 0 HG LEU A 130 1.579 30.245 86.488 1.00 8.28 H new ATOM 0 HD11 LEU A 130 3.108 29.076 85.125 1.00 9.32 H new ATOM 0 HD12 LEU A 130 3.085 30.606 84.719 1.00 9.32 H new ATOM 0 HD13 LEU A 130 4.268 30.040 85.606 1.00 9.32 H new ATOM 0 HD21 LEU A 130 2.651 28.383 87.472 1.00 8.72 H new ATOM 0 HD22 LEU A 130 3.813 29.327 87.990 1.00 8.72 H new ATOM 0 HD23 LEU A 130 2.350 29.477 88.577 1.00 8.72 H new ATOM 1002 N THR A 131 1.734 34.255 89.629 1.00 7.91 N ATOM 1003 CA THR A 131 2.105 35.565 90.149 1.00 7.82 C ATOM 1004 C THR A 131 3.384 35.568 90.988 1.00 8.46 C ATOM 1005 O THR A 131 4.302 36.348 90.730 1.00 9.11 O ATOM 1006 CB THR A 131 0.951 36.185 90.965 1.00 9.22 C ATOM 1007 OG1 THR A 131 -0.175 36.410 90.099 1.00 10.91 O ATOM 1008 CG2 THR A 131 1.382 37.509 91.580 1.00 10.07 C ATOM 0 H THR A 131 0.952 33.984 89.863 1.00 7.91 H new ATOM 0 HA THR A 131 2.286 36.105 89.364 1.00 7.82 H new ATOM 0 HB THR A 131 0.708 35.573 91.677 1.00 9.22 H new ATOM 0 HG1 THR A 131 -0.526 35.674 89.898 1.00 10.91 H new ATOM 0 HG21 THR A 131 0.646 37.885 92.089 1.00 10.07 H new ATOM 0 HG22 THR A 131 2.139 37.362 92.168 1.00 10.07 H new ATOM 0 HG23 THR A 131 1.636 38.126 90.876 1.00 10.07 H new ATOM 1009 N ALA A 132 3.451 34.696 91.991 1.00 8.79 N ATOM 1010 CA ALA A 132 4.628 34.642 92.847 1.00 7.04 C ATOM 1011 C ALA A 132 5.877 34.211 92.097 1.00 6.60 C ATOM 1012 O ALA A 132 6.959 34.726 92.361 1.00 7.27 O ATOM 1013 CB ALA A 132 4.379 33.708 94.030 1.00 7.82 C ATOM 0 H ALA A 132 2.832 34.133 92.190 1.00 8.79 H new ATOM 0 HA ALA A 132 4.785 35.543 93.170 1.00 7.04 H new ATOM 0 HB1 ALA A 132 5.169 33.680 94.592 1.00 7.82 H new ATOM 0 HB2 ALA A 132 3.626 34.034 94.547 1.00 7.82 H new ATOM 0 HB3 ALA A 132 4.184 32.816 93.703 1.00 7.82 H new ATOM 1014 N LEU A 133 5.744 33.267 91.172 1.00 6.73 N ATOM 1015 CA LEU A 133 6.906 32.825 90.416 1.00 7.57 C ATOM 1016 C LEU A 133 7.519 33.971 89.599 1.00 6.59 C ATOM 1017 O LEU A 133 8.742 34.154 89.584 1.00 7.27 O ATOM 1018 CB LEU A 133 6.540 31.663 89.484 1.00 7.04 C ATOM 1019 CG LEU A 133 7.712 31.224 88.599 1.00 7.48 C ATOM 1020 CD1 LEU A 133 8.822 30.615 89.457 1.00 10.52 C ATOM 1021 CD2 LEU A 133 7.221 30.235 87.545 1.00 8.98 C ATOM 0 H LEU A 133 5.005 32.877 90.970 1.00 6.73 H new ATOM 0 HA LEU A 133 7.567 32.522 91.058 1.00 7.57 H new ATOM 0 HB2 LEU A 133 6.241 30.909 90.015 1.00 7.04 H new ATOM 0 HB3 LEU A 133 5.795 31.927 88.921 1.00 7.04 H new ATOM 0 HG LEU A 133 8.079 31.997 88.143 1.00 7.48 H new ATOM 0 HD11 LEU A 133 9.558 30.341 88.888 1.00 10.52 H new ATOM 0 HD12 LEU A 133 9.136 31.274 90.096 1.00 10.52 H new ATOM 0 HD13 LEU A 133 8.477 29.843 89.933 1.00 10.52 H new ATOM 0 HD21 LEU A 133 7.965 29.960 86.987 1.00 8.98 H new ATOM 0 HD22 LEU A 133 6.841 29.457 87.983 1.00 8.98 H new ATOM 0 HD23 LEU A 133 6.544 30.658 86.994 1.00 8.98 H new ATOM 1022 N LYS A 134 6.677 34.742 88.910 1.00 7.96 N ATOM 1023 CA LYS A 134 7.189 35.855 88.106 1.00 7.91 C ATOM 1024 C LYS A 134 7.908 36.872 88.989 1.00 8.07 C ATOM 1025 O LYS A 134 8.962 37.399 88.616 1.00 8.27 O ATOM 1026 CB LYS A 134 6.042 36.511 87.316 1.00 8.40 C ATOM 1027 CG LYS A 134 5.511 35.604 86.199 1.00 8.36 C ATOM 1028 CD LYS A 134 4.373 36.230 85.390 1.00 9.26 C ATOM 1029 CE LYS A 134 3.145 36.469 86.239 1.00 9.37 C ATOM 1030 NZ LYS A 134 1.981 36.942 85.428 1.00 12.16 N ATOM 0 H LYS A 134 5.823 34.642 88.893 1.00 7.96 H new ATOM 0 HA LYS A 134 7.835 35.510 87.470 1.00 7.91 H new ATOM 0 HB2 LYS A 134 5.318 36.730 87.923 1.00 8.40 H new ATOM 0 HB3 LYS A 134 6.353 37.346 86.932 1.00 8.40 H new ATOM 0 HG2 LYS A 134 6.240 35.382 85.599 1.00 8.36 H new ATOM 0 HG3 LYS A 134 5.201 34.772 86.589 1.00 8.36 H new ATOM 0 HD2 LYS A 134 4.671 37.071 85.009 1.00 9.26 H new ATOM 0 HD3 LYS A 134 4.145 35.648 84.648 1.00 9.26 H new ATOM 0 HE2 LYS A 134 2.906 35.648 86.697 1.00 9.37 H new ATOM 0 HE3 LYS A 134 3.349 37.126 86.923 1.00 9.37 H new ATOM 0 HZ1 LYS A 134 1.265 37.015 85.951 1.00 12.16 H new ATOM 0 HZ2 LYS A 134 2.170 37.735 85.071 1.00 12.16 H new ATOM 0 HZ3 LYS A 134 1.815 36.357 84.778 1.00 12.16 H new ATOM 1031 N ALA A 135 7.352 37.137 90.165 1.00 8.03 N ATOM 1032 CA ALA A 135 7.977 38.063 91.096 1.00 7.67 C ATOM 1033 C ALA A 135 9.313 37.502 91.600 1.00 7.93 C ATOM 1034 O ALA A 135 10.321 38.216 91.632 1.00 7.94 O ATOM 1035 CB ALA A 135 7.044 38.323 92.269 1.00 8.45 C ATOM 0 H ALA A 135 6.615 36.791 90.441 1.00 8.03 H new ATOM 0 HA ALA A 135 8.150 38.898 90.634 1.00 7.67 H new ATOM 0 HB1 ALA A 135 7.465 38.941 92.887 1.00 8.45 H new ATOM 0 HB2 ALA A 135 6.214 38.706 91.944 1.00 8.45 H new ATOM 0 HB3 ALA A 135 6.857 37.488 92.725 1.00 8.45 H new ATOM 1036 N MET A 136 9.327 36.217 91.965 1.00 7.45 N ATOM 1037 CA MET A 136 10.546 35.601 92.492 1.00 6.37 C ATOM 1038 C MET A 136 11.683 35.532 91.479 1.00 6.23 C ATOM 1039 O MET A 136 12.856 35.610 91.847 1.00 7.18 O ATOM 1040 CB MET A 136 10.250 34.195 93.030 1.00 7.46 C ATOM 1041 CG MET A 136 11.221 33.761 94.134 1.00 7.95 C ATOM 1042 SD MET A 136 11.135 34.805 95.630 1.00 8.43 S ATOM 1043 CE MET A 136 9.471 34.443 96.192 1.00 10.68 C ATOM 0 H MET A 136 8.649 35.691 91.916 1.00 7.45 H new ATOM 0 HA MET A 136 10.845 36.179 93.212 1.00 6.37 H new ATOM 0 HB2 MET A 136 9.344 34.170 93.375 1.00 7.46 H new ATOM 0 HB3 MET A 136 10.293 33.559 92.299 1.00 7.46 H new ATOM 0 HG2 MET A 136 11.032 32.842 94.378 1.00 7.95 H new ATOM 0 HG3 MET A 136 12.126 33.781 93.785 1.00 7.95 H new ATOM 0 HE1 MET A 136 9.356 34.774 97.097 1.00 10.68 H new ATOM 0 HE2 MET A 136 8.830 34.875 95.606 1.00 10.68 H new ATOM 0 HE3 MET A 136 9.326 33.484 96.178 1.00 10.68 H new ATOM 1044 N LEU A 137 11.351 35.382 90.200 1.00 6.99 N ATOM 1045 CA LEU A 137 12.386 35.337 89.168 1.00 6.95 C ATOM 1046 C LEU A 137 13.099 36.694 89.094 1.00 7.44 C ATOM 1047 O LEU A 137 14.301 36.757 88.807 1.00 8.75 O ATOM 1048 CB LEU A 137 11.771 34.943 87.816 1.00 7.72 C ATOM 1049 CG LEU A 137 11.435 33.443 87.721 1.00 7.07 C ATOM 1050 CD1 LEU A 137 10.443 33.186 86.595 1.00 8.63 C ATOM 1051 CD2 LEU A 137 12.718 32.643 87.505 1.00 9.37 C ATOM 0 H LEU A 137 10.545 35.305 89.910 1.00 6.99 H new ATOM 0 HA LEU A 137 13.045 34.663 89.396 1.00 6.95 H new ATOM 0 HB2 LEU A 137 10.963 35.460 87.671 1.00 7.72 H new ATOM 0 HB3 LEU A 137 12.388 35.177 87.105 1.00 7.72 H new ATOM 0 HG LEU A 137 11.023 33.158 88.551 1.00 7.07 H new ATOM 0 HD11 LEU A 137 10.243 32.238 86.550 1.00 8.63 H new ATOM 0 HD12 LEU A 137 9.626 33.681 86.764 1.00 8.63 H new ATOM 0 HD13 LEU A 137 10.827 33.476 85.753 1.00 8.63 H new ATOM 0 HD21 LEU A 137 12.505 31.699 87.445 1.00 9.37 H new ATOM 0 HD22 LEU A 137 13.144 32.930 86.682 1.00 9.37 H new ATOM 0 HD23 LEU A 137 13.321 32.791 88.250 1.00 9.37 H new ATOM 1052 N GLU A 138 12.368 37.775 89.364 1.00 7.59 N ATOM 1053 CA GLU A 138 12.994 39.099 89.379 1.00 8.17 C ATOM 1054 C GLU A 138 13.837 39.239 90.656 1.00 8.13 C ATOM 1055 O GLU A 138 14.958 39.747 90.613 1.00 8.29 O ATOM 1056 CB GLU A 138 11.938 40.210 89.307 1.00 8.12 C ATOM 1057 CG GLU A 138 11.238 40.292 87.948 1.00 8.30 C ATOM 1058 CD GLU A 138 10.224 41.422 87.845 1.00 9.47 C ATOM 1059 OE1 GLU A 138 10.090 42.218 88.797 1.00 9.82 O ATOM 1060 OE2 GLU A 138 9.554 41.505 86.791 1.00 11.21 O ATOM 0 H GLU A 138 11.526 37.767 89.538 1.00 7.59 H new ATOM 0 HA GLU A 138 13.565 39.188 88.600 1.00 8.17 H new ATOM 0 HB2 GLU A 138 11.273 40.061 89.998 1.00 8.12 H new ATOM 0 HB3 GLU A 138 12.360 41.062 89.498 1.00 8.12 H new ATOM 0 HG2 GLU A 138 11.908 40.406 87.255 1.00 8.30 H new ATOM 0 HG3 GLU A 138 10.790 39.450 87.774 1.00 8.30 H new ATOM 1061 N VAL A 139 13.296 38.789 91.793 1.00 7.33 N ATOM 1062 CA VAL A 139 14.031 38.847 93.057 1.00 7.54 C ATOM 1063 C VAL A 139 15.362 38.090 92.933 1.00 6.96 C ATOM 1064 O VAL A 139 16.400 38.560 93.411 1.00 7.88 O ATOM 1065 CB VAL A 139 13.185 38.255 94.212 1.00 7.00 C ATOM 1066 CG1 VAL A 139 14.024 38.144 95.473 1.00 8.39 C ATOM 1067 CG2 VAL A 139 11.980 39.149 94.480 1.00 8.33 C ATOM 0 H VAL A 139 12.508 38.448 91.852 1.00 7.33 H new ATOM 0 HA VAL A 139 14.216 39.777 93.259 1.00 7.54 H new ATOM 0 HB VAL A 139 12.881 37.371 93.955 1.00 7.00 H new ATOM 0 HG11 VAL A 139 13.485 37.773 96.189 1.00 8.39 H new ATOM 0 HG12 VAL A 139 14.784 37.564 95.307 1.00 8.39 H new ATOM 0 HG13 VAL A 139 14.340 39.024 95.730 1.00 8.39 H new ATOM 0 HG21 VAL A 139 11.454 38.775 95.204 1.00 8.33 H new ATOM 0 HG22 VAL A 139 12.284 40.036 94.727 1.00 8.33 H new ATOM 0 HG23 VAL A 139 11.435 39.206 93.680 1.00 8.33 H new ATOM 1068 N LYS A 140 15.339 36.932 92.273 1.00 6.87 N ATOM 1069 CA LYS A 140 16.553 36.144 92.083 1.00 7.11 C ATOM 1070 C LYS A 140 17.665 36.979 91.430 1.00 7.86 C ATOM 1071 O LYS A 140 18.825 36.935 91.847 1.00 7.71 O ATOM 1072 CB LYS A 140 16.248 34.911 91.218 1.00 7.49 C ATOM 1073 CG LYS A 140 17.469 34.090 90.842 1.00 7.09 C ATOM 1074 CD LYS A 140 17.095 32.842 90.056 1.00 8.06 C ATOM 1075 CE LYS A 140 18.339 32.111 89.589 1.00 10.12 C ATOM 1076 NZ LYS A 140 18.017 30.853 88.866 1.00 12.95 N ATOM 0 H LYS A 140 14.631 36.587 91.928 1.00 6.87 H new ATOM 0 HA LYS A 140 16.865 35.858 92.956 1.00 7.11 H new ATOM 0 HB2 LYS A 140 15.623 34.342 91.694 1.00 7.49 H new ATOM 0 HB3 LYS A 140 15.804 35.201 90.406 1.00 7.49 H new ATOM 0 HG2 LYS A 140 18.074 34.634 90.315 1.00 7.09 H new ATOM 0 HG3 LYS A 140 17.946 33.834 91.647 1.00 7.09 H new ATOM 0 HD2 LYS A 140 16.557 32.254 90.610 1.00 8.06 H new ATOM 0 HD3 LYS A 140 16.551 33.087 89.291 1.00 8.06 H new ATOM 0 HE2 LYS A 140 18.854 32.692 89.008 1.00 10.12 H new ATOM 0 HE3 LYS A 140 18.898 31.907 90.355 1.00 10.12 H new ATOM 0 HZ1 LYS A 140 18.770 30.471 88.585 1.00 12.95 H new ATOM 0 HZ2 LYS A 140 17.589 30.297 89.414 1.00 12.95 H new ATOM 0 HZ3 LYS A 140 17.499 31.037 88.166 1.00 12.95 H new ATOM 1077 N GLN A 141 17.303 37.741 90.401 1.00 8.98 N ATOM 1078 CA GLN A 141 18.283 38.571 89.704 1.00 9.75 C ATOM 1079 C GLN A 141 18.734 39.730 90.576 1.00 8.80 C ATOM 1080 O GLN A 141 19.922 40.062 90.623 1.00 10.30 O ATOM 1081 CB GLN A 141 17.674 39.123 88.410 1.00 12.57 C ATOM 1082 CG GLN A 141 17.258 38.061 87.409 1.00 18.31 C ATOM 1083 CD GLN A 141 16.467 38.645 86.250 1.00 23.04 C ATOM 1084 OE1 GLN A 141 17.011 39.367 85.414 1.00 26.54 O ATOM 1085 NE2 GLN A 141 15.171 38.344 86.204 1.00 25.42 N ATOM 0 H GLN A 141 16.502 37.792 90.092 1.00 8.98 H new ATOM 0 HA GLN A 141 19.052 38.017 89.498 1.00 9.75 H new ATOM 0 HB2 GLN A 141 16.899 39.661 88.634 1.00 12.57 H new ATOM 0 HB3 GLN A 141 18.318 39.714 87.989 1.00 12.57 H new ATOM 0 HG2 GLN A 141 18.048 37.614 87.067 1.00 18.31 H new ATOM 0 HG3 GLN A 141 16.723 37.388 87.857 1.00 18.31 H new ATOM 0 HE21 GLN A 141 14.826 37.836 86.806 1.00 25.42 H new ATOM 0 HE22 GLN A 141 14.679 38.658 85.572 1.00 25.42 H new ATOM 1086 N GLU A 142 17.788 40.337 91.280 1.00 7.91 N ATOM 1087 CA GLU A 142 18.098 41.478 92.133 1.00 8.82 C ATOM 1088 C GLU A 142 19.000 41.147 93.322 1.00 8.81 C ATOM 1089 O GLU A 142 19.865 41.938 93.694 1.00 9.06 O ATOM 1090 CB GLU A 142 16.794 42.106 92.633 1.00 8.76 C ATOM 1091 CG GLU A 142 15.929 42.695 91.515 1.00 10.14 C ATOM 1092 CD GLU A 142 14.543 43.099 91.979 1.00 11.28 C ATOM 1093 OE1 GLU A 142 13.761 43.602 91.138 1.00 13.02 O ATOM 1094 OE2 GLU A 142 14.214 42.922 93.166 1.00 11.71 O ATOM 0 H GLU A 142 16.960 40.105 91.279 1.00 7.91 H new ATOM 0 HA GLU A 142 18.599 42.101 91.584 1.00 8.82 H new ATOM 0 HB2 GLU A 142 16.281 41.433 93.108 1.00 8.76 H new ATOM 0 HB3 GLU A 142 17.005 42.805 93.271 1.00 8.76 H new ATOM 0 HG2 GLU A 142 16.377 43.470 91.142 1.00 10.14 H new ATOM 0 HG3 GLU A 142 15.847 42.044 90.801 1.00 10.14 H new ATOM 1095 N VAL A 143 18.808 39.973 93.918 1.00 8.22 N ATOM 1096 CA VAL A 143 19.586 39.608 95.097 1.00 8.40 C ATOM 1097 C VAL A 143 20.904 38.906 94.784 1.00 7.41 C ATOM 1098 O VAL A 143 21.717 38.689 95.684 1.00 7.91 O ATOM 1099 CB VAL A 143 18.721 38.722 96.060 1.00 8.48 C ATOM 1100 CG1 VAL A 143 18.648 37.280 95.547 1.00 7.73 C ATOM 1101 CG2 VAL A 143 19.274 38.779 97.480 1.00 8.69 C ATOM 0 H VAL A 143 18.240 39.381 93.660 1.00 8.22 H new ATOM 0 HA VAL A 143 19.824 40.444 95.528 1.00 8.40 H new ATOM 0 HB VAL A 143 17.818 39.075 96.078 1.00 8.48 H new ATOM 0 HG11 VAL A 143 18.110 36.747 96.154 1.00 7.73 H new ATOM 0 HG12 VAL A 143 18.245 37.270 94.665 1.00 7.73 H new ATOM 0 HG13 VAL A 143 19.543 36.908 95.497 1.00 7.73 H new ATOM 0 HG21 VAL A 143 18.729 38.227 98.062 1.00 8.69 H new ATOM 0 HG22 VAL A 143 20.187 38.451 97.485 1.00 8.69 H new ATOM 0 HG23 VAL A 143 19.259 39.696 97.797 1.00 8.69 H new ATOM 1102 N ALA A 144 21.130 38.590 93.510 1.00 7.83 N ATOM 1103 CA ALA A 144 22.329 37.871 93.084 1.00 8.53 C ATOM 1104 C ALA A 144 23.684 38.338 93.630 1.00 9.28 C ATOM 1105 O ALA A 144 24.551 37.509 93.875 1.00 10.12 O ATOM 1106 CB ALA A 144 22.375 37.796 91.550 1.00 10.30 C ATOM 0 H ALA A 144 20.592 38.787 92.868 1.00 7.83 H new ATOM 0 HA ALA A 144 22.220 36.998 93.494 1.00 8.53 H new ATOM 0 HB1 ALA A 144 23.172 37.318 91.273 1.00 10.30 H new ATOM 0 HB2 ALA A 144 21.589 37.329 91.225 1.00 10.30 H new ATOM 0 HB3 ALA A 144 22.392 38.693 91.182 1.00 10.30 H new ATOM 1107 N PRO A 145 23.891 39.656 93.822 1.00 9.67 N ATOM 1108 CA PRO A 145 25.199 40.066 94.349 1.00 9.52 C ATOM 1109 C PRO A 145 25.464 39.553 95.772 1.00 10.07 C ATOM 1110 O PRO A 145 26.619 39.484 96.206 1.00 12.49 O ATOM 1111 CB PRO A 145 25.122 41.594 94.320 1.00 10.96 C ATOM 1112 CG PRO A 145 24.211 41.872 93.161 1.00 10.83 C ATOM 1113 CD PRO A 145 23.119 40.829 93.366 1.00 9.42 C ATOM 0 HA PRO A 145 25.930 39.700 93.827 1.00 9.52 H new ATOM 0 HB2 PRO A 145 24.766 41.950 95.149 1.00 10.96 H new ATOM 0 HB3 PRO A 145 25.996 41.994 94.192 1.00 10.96 H new ATOM 0 HG2 PRO A 145 23.860 42.776 93.183 1.00 10.83 H new ATOM 0 HG3 PRO A 145 24.662 41.764 92.309 1.00 10.83 H new ATOM 0 HD2 PRO A 145 22.467 41.112 94.026 1.00 9.42 H new ATOM 0 HD3 PRO A 145 22.633 40.647 92.546 1.00 9.42 H new ATOM 1114 N TRP A 146 24.397 39.193 96.486 1.00 9.16 N ATOM 1115 CA TRP A 146 24.505 38.750 97.879 1.00 8.71 C ATOM 1116 C TRP A 146 24.115 37.301 98.160 1.00 8.38 C ATOM 1117 O TRP A 146 24.679 36.675 99.058 1.00 7.60 O ATOM 1118 CB TRP A 146 23.658 39.675 98.763 1.00 9.13 C ATOM 1119 CG TRP A 146 24.034 41.117 98.597 1.00 10.48 C ATOM 1120 CD1 TRP A 146 25.096 41.751 99.172 1.00 11.59 C ATOM 1121 CD2 TRP A 146 23.440 42.060 97.696 1.00 10.97 C ATOM 1122 NE1 TRP A 146 25.210 43.031 98.676 1.00 13.03 N ATOM 1123 CE2 TRP A 146 24.206 43.247 97.768 1.00 11.97 C ATOM 1124 CE3 TRP A 146 22.338 42.018 96.827 1.00 11.19 C ATOM 1125 CZ2 TRP A 146 23.907 44.387 97.003 1.00 11.95 C ATOM 1126 CZ3 TRP A 146 22.040 43.150 96.066 1.00 11.36 C ATOM 1127 CH2 TRP A 146 22.825 44.319 96.161 1.00 11.82 C ATOM 0 H TRP A 146 23.594 39.198 96.179 1.00 9.16 H new ATOM 0 HA TRP A 146 25.452 38.797 98.083 1.00 8.71 H new ATOM 0 HB2 TRP A 146 22.720 39.560 98.544 1.00 9.13 H new ATOM 0 HB3 TRP A 146 23.766 39.419 99.692 1.00 9.13 H new ATOM 0 HD1 TRP A 146 25.661 41.374 99.807 1.00 11.59 H new ATOM 0 HE1 TRP A 146 25.813 43.602 98.900 1.00 13.03 H new ATOM 0 HE3 TRP A 146 21.817 41.251 96.760 1.00 11.19 H new ATOM 0 HZ2 TRP A 146 24.423 45.158 97.065 1.00 11.95 H new ATOM 0 HZ3 TRP A 146 21.312 43.133 95.487 1.00 11.36 H new ATOM 0 HH2 TRP A 146 22.605 45.059 95.642 1.00 11.82 H new ATOM 1128 N ILE A 147 23.157 36.780 97.400 1.00 7.70 N ATOM 1129 CA ILE A 147 22.662 35.418 97.599 1.00 7.31 C ATOM 1130 C ILE A 147 22.399 34.745 96.268 1.00 7.00 C ATOM 1131 O ILE A 147 21.821 35.362 95.362 1.00 8.11 O ATOM 1132 CB ILE A 147 21.308 35.430 98.393 1.00 8.03 C ATOM 1133 CG1 ILE A 147 21.559 35.769 99.868 1.00 7.26 C ATOM 1134 CG2 ILE A 147 20.585 34.084 98.241 1.00 8.83 C ATOM 1135 CD1 ILE A 147 20.303 35.873 100.732 1.00 7.55 C ATOM 0 H ILE A 147 22.775 37.203 96.756 1.00 7.70 H new ATOM 0 HA ILE A 147 23.342 34.936 98.095 1.00 7.31 H new ATOM 0 HB ILE A 147 20.732 36.118 98.023 1.00 8.03 H new ATOM 0 HG12 ILE A 147 22.140 35.091 100.247 1.00 7.26 H new ATOM 0 HG13 ILE A 147 22.038 36.611 99.915 1.00 7.26 H new ATOM 0 HG21 ILE A 147 19.751 34.107 98.736 1.00 8.83 H new ATOM 0 HG22 ILE A 147 20.399 33.920 97.303 1.00 8.83 H new ATOM 0 HG23 ILE A 147 21.147 33.374 98.587 1.00 8.83 H new ATOM 0 HD11 ILE A 147 20.554 36.089 101.644 1.00 7.55 H new ATOM 0 HD12 ILE A 147 19.726 36.570 100.382 1.00 7.55 H new ATOM 0 HD13 ILE A 147 19.830 35.026 100.719 1.00 7.55 H new ATOM 1136 N ASP A 148 22.838 33.497 96.146 1.00 7.33 N ATOM 1137 CA ASP A 148 22.553 32.695 94.962 1.00 8.52 C ATOM 1138 C ASP A 148 21.228 31.997 95.327 1.00 7.84 C ATOM 1139 O ASP A 148 21.192 31.088 96.170 1.00 7.39 O ATOM 1140 CB ASP A 148 23.657 31.661 94.731 1.00 11.24 C ATOM 1141 CG ASP A 148 23.505 30.926 93.415 1.00 19.12 C ATOM 1142 OD1 ASP A 148 22.417 31.005 92.807 1.00 22.66 O ATOM 1143 OD2 ASP A 148 24.475 30.265 92.984 1.00 23.27 O ATOM 0 H ASP A 148 23.307 33.093 96.743 1.00 7.33 H new ATOM 0 HA ASP A 148 22.501 33.220 94.148 1.00 8.52 H new ATOM 0 HB2 ASP A 148 24.519 32.104 94.752 1.00 11.24 H new ATOM 0 HB3 ASP A 148 23.651 31.019 95.458 1.00 11.24 H new ATOM 1144 N LEU A 149 20.140 32.449 94.716 1.00 6.46 N ATOM 1145 CA LEU A 149 18.805 31.915 94.991 1.00 6.75 C ATOM 1146 C LEU A 149 18.347 30.887 93.968 1.00 7.20 C ATOM 1147 O LEU A 149 18.345 31.171 92.765 1.00 8.64 O ATOM 1148 CB LEU A 149 17.786 33.070 95.017 1.00 7.66 C ATOM 1149 CG LEU A 149 16.317 32.753 95.347 1.00 6.28 C ATOM 1150 CD1 LEU A 149 16.211 32.275 96.794 1.00 7.19 C ATOM 1151 CD2 LEU A 149 15.450 34.002 95.149 1.00 8.50 C ATOM 0 H LEU A 149 20.152 33.076 94.128 1.00 6.46 H new ATOM 0 HA LEU A 149 18.857 31.468 95.850 1.00 6.75 H new ATOM 0 HB2 LEU A 149 18.098 33.723 95.663 1.00 7.66 H new ATOM 0 HB3 LEU A 149 17.806 33.499 94.147 1.00 7.66 H new ATOM 0 HG LEU A 149 16.002 32.055 94.752 1.00 6.28 H new ATOM 0 HD11 LEU A 149 15.285 32.075 97.002 1.00 7.19 H new ATOM 0 HD12 LEU A 149 16.748 31.476 96.911 1.00 7.19 H new ATOM 0 HD13 LEU A 149 16.533 32.970 97.389 1.00 7.19 H new ATOM 0 HD21 LEU A 149 14.527 33.792 95.359 1.00 8.50 H new ATOM 0 HD22 LEU A 149 15.762 34.709 95.735 1.00 8.50 H new ATOM 0 HD23 LEU A 149 15.512 34.296 94.227 1.00 8.50 H new ATOM 1152 N GLN A 150 17.971 29.696 94.438 1.00 6.58 N ATOM 1153 CA GLN A 150 17.418 28.648 93.575 1.00 6.39 C ATOM 1154 C GLN A 150 15.907 28.692 93.786 1.00 5.82 C ATOM 1155 O GLN A 150 15.428 28.891 94.906 1.00 6.84 O ATOM 1156 CB GLN A 150 17.930 27.248 93.972 1.00 6.57 C ATOM 1157 CG GLN A 150 19.414 27.017 93.680 1.00 7.59 C ATOM 1158 CD GLN A 150 19.881 25.588 93.955 1.00 6.92 C ATOM 1159 OE1 GLN A 150 18.950 24.699 94.284 1.00 10.15 O flip ATOM 1160 NE2 GLN A 150 21.083 25.291 93.860 1.00 5.43 N flip ATOM 0 H GLN A 150 18.029 29.473 95.266 1.00 6.58 H new ATOM 0 HA GLN A 150 17.681 28.801 92.654 1.00 6.39 H new ATOM 0 HB2 GLN A 150 17.772 27.114 94.920 1.00 6.57 H new ATOM 0 HB3 GLN A 150 17.410 26.579 93.500 1.00 6.57 H new ATOM 0 HG2 GLN A 150 19.590 27.233 92.751 1.00 7.59 H new ATOM 0 HG3 GLN A 150 19.940 27.629 94.218 1.00 7.59 H new ATOM 0 HE21 GLN A 150 21.659 25.892 93.645 1.00 5.43 H new ATOM 0 HE22 GLN A 150 21.340 24.484 94.009 1.00 5.43 H new ATOM 1161 N ILE A 151 15.159 28.509 92.706 1.00 6.01 N ATOM 1162 CA ILE A 151 13.705 28.509 92.779 1.00 6.08 C ATOM 1163 C ILE A 151 13.150 27.134 92.430 1.00 5.59 C ATOM 1164 O ILE A 151 13.469 26.576 91.372 1.00 5.75 O ATOM 1165 CB ILE A 151 13.087 29.555 91.799 1.00 5.88 C ATOM 1166 CG1 ILE A 151 13.441 30.972 92.260 1.00 6.87 C ATOM 1167 CG2 ILE A 151 11.577 29.375 91.711 1.00 6.80 C ATOM 1168 CD1 ILE A 151 13.168 32.055 91.203 1.00 9.01 C ATOM 0 H ILE A 151 15.476 28.382 91.917 1.00 6.01 H new ATOM 0 HA ILE A 151 13.466 28.742 93.690 1.00 6.08 H new ATOM 0 HB ILE A 151 13.457 29.416 90.913 1.00 5.88 H new ATOM 0 HG12 ILE A 151 12.934 31.179 93.061 1.00 6.87 H new ATOM 0 HG13 ILE A 151 14.380 30.999 92.503 1.00 6.87 H new ATOM 0 HG21 ILE A 151 11.208 30.031 91.099 1.00 6.80 H new ATOM 0 HG22 ILE A 151 11.376 28.483 91.388 1.00 6.80 H new ATOM 0 HG23 ILE A 151 11.185 29.496 92.590 1.00 6.80 H new ATOM 0 HD11 ILE A 151 13.413 32.924 91.559 1.00 9.01 H new ATOM 0 HD12 ILE A 151 13.693 31.871 90.408 1.00 9.01 H new ATOM 0 HD13 ILE A 151 12.225 32.054 90.974 1.00 9.01 H new ATOM 1169 N VAL A 152 12.352 26.581 93.343 1.00 5.72 N ATOM 1170 CA VAL A 152 11.695 25.297 93.102 1.00 5.43 C ATOM 1171 C VAL A 152 10.259 25.571 92.642 1.00 5.14 C ATOM 1172 O VAL A 152 9.517 26.314 93.304 1.00 5.76 O ATOM 1173 CB VAL A 152 11.579 24.422 94.389 1.00 5.31 C ATOM 1174 CG1 VAL A 152 11.042 23.022 94.019 1.00 5.95 C ATOM 1175 CG2 VAL A 152 12.928 24.333 95.116 1.00 5.70 C ATOM 0 H VAL A 152 12.178 26.933 94.108 1.00 5.72 H new ATOM 0 HA VAL A 152 12.230 24.824 92.445 1.00 5.43 H new ATOM 0 HB VAL A 152 10.952 24.840 95.000 1.00 5.31 H new ATOM 0 HG11 VAL A 152 10.971 22.480 94.820 1.00 5.95 H new ATOM 0 HG12 VAL A 152 10.167 23.109 93.609 1.00 5.95 H new ATOM 0 HG13 VAL A 152 11.650 22.596 93.395 1.00 5.95 H new ATOM 0 HG21 VAL A 152 12.832 23.786 95.911 1.00 5.70 H new ATOM 0 HG22 VAL A 152 13.588 23.934 94.527 1.00 5.70 H new ATOM 0 HG23 VAL A 152 13.218 25.223 95.370 1.00 5.70 H new ATOM 1176 N ALA A 153 9.878 24.992 91.507 1.00 5.77 N ATOM 1177 CA ALA A 153 8.503 25.103 91.019 1.00 5.57 C ATOM 1178 C ALA A 153 7.759 24.050 91.864 1.00 5.42 C ATOM 1179 O ALA A 153 7.833 22.845 91.599 1.00 5.85 O ATOM 1180 CB ALA A 153 8.450 24.759 89.538 1.00 6.62 C ATOM 0 H ALA A 153 10.400 24.530 91.003 1.00 5.77 H new ATOM 0 HA ALA A 153 8.122 25.991 91.102 1.00 5.57 H new ATOM 0 HB1 ALA A 153 7.537 24.834 89.221 1.00 6.62 H new ATOM 0 HB2 ALA A 153 9.016 25.372 89.043 1.00 6.62 H new ATOM 0 HB3 ALA A 153 8.764 23.851 89.405 1.00 6.62 H new ATOM 1181 N PHE A 154 7.059 24.532 92.887 1.00 5.08 N ATOM 1182 CA PHE A 154 6.373 23.676 93.857 1.00 5.41 C ATOM 1183 C PHE A 154 4.868 23.615 93.618 1.00 5.10 C ATOM 1184 O PHE A 154 4.165 24.584 93.860 1.00 6.11 O ATOM 1185 CB PHE A 154 6.704 24.225 95.253 1.00 5.96 C ATOM 1186 CG PHE A 154 5.949 23.574 96.379 1.00 5.84 C ATOM 1187 CD1 PHE A 154 5.854 22.185 96.485 1.00 6.38 C ATOM 1188 CD2 PHE A 154 5.381 24.362 97.373 1.00 6.47 C ATOM 1189 CE1 PHE A 154 5.196 21.594 97.579 1.00 5.98 C ATOM 1190 CE2 PHE A 154 4.729 23.787 98.464 1.00 7.68 C ATOM 1191 CZ PHE A 154 4.638 22.399 98.563 1.00 7.88 C ATOM 0 H PHE A 154 6.967 25.373 93.041 1.00 5.08 H new ATOM 0 HA PHE A 154 6.680 22.761 93.766 1.00 5.41 H new ATOM 0 HB2 PHE A 154 7.655 24.117 95.412 1.00 5.96 H new ATOM 0 HB3 PHE A 154 6.520 25.177 95.265 1.00 5.96 H new ATOM 0 HD1 PHE A 154 6.229 21.646 95.827 1.00 6.38 H new ATOM 0 HD2 PHE A 154 5.437 25.288 97.310 1.00 6.47 H new ATOM 0 HE1 PHE A 154 5.135 20.668 97.643 1.00 5.98 H new ATOM 0 HE2 PHE A 154 4.356 24.327 99.123 1.00 7.68 H new ATOM 0 HZ PHE A 154 4.203 22.012 99.289 1.00 7.88 H new ATOM 1192 N PRO A 155 4.359 22.472 93.129 1.00 5.10 N ATOM 1193 CA PRO A 155 2.920 22.339 92.867 1.00 5.61 C ATOM 1194 C PRO A 155 2.214 22.004 94.180 1.00 6.44 C ATOM 1195 O PRO A 155 1.831 20.857 94.424 1.00 6.81 O ATOM 1196 CB PRO A 155 2.872 21.209 91.837 1.00 5.88 C ATOM 1197 CG PRO A 155 3.986 20.290 92.291 1.00 5.54 C ATOM 1198 CD PRO A 155 5.089 21.236 92.776 1.00 5.17 C ATOM 0 HA PRO A 155 2.475 23.133 92.533 1.00 5.61 H new ATOM 0 HB2 PRO A 155 2.013 20.759 91.837 1.00 5.88 H new ATOM 0 HB3 PRO A 155 3.021 21.537 90.936 1.00 5.88 H new ATOM 0 HG2 PRO A 155 3.690 19.699 93.001 1.00 5.54 H new ATOM 0 HG3 PRO A 155 4.297 19.727 91.565 1.00 5.54 H new ATOM 0 HD2 PRO A 155 5.562 20.870 93.540 1.00 5.17 H new ATOM 0 HD3 PRO A 155 5.750 21.397 92.084 1.00 5.17 H new ATOM 1199 N GLN A 156 2.043 23.034 95.012 1.00 6.52 N ATOM 1200 CA GLN A 156 1.465 22.905 96.349 1.00 7.54 C ATOM 1201 C GLN A 156 0.176 22.118 96.469 1.00 7.17 C ATOM 1202 O GLN A 156 -0.027 21.427 97.471 1.00 8.35 O ATOM 1203 CB GLN A 156 1.286 24.306 96.974 1.00 7.62 C ATOM 1204 CG GLN A 156 0.592 24.329 98.346 1.00 9.75 C ATOM 1205 CD GLN A 156 1.473 23.856 99.496 1.00 9.35 C ATOM 1206 OE1 GLN A 156 2.146 24.653 100.155 1.00 10.92 O ATOM 1207 NE2 GLN A 156 1.466 22.549 99.746 1.00 10.25 N ATOM 0 H GLN A 156 2.264 23.840 94.810 1.00 6.52 H new ATOM 0 HA GLN A 156 2.110 22.368 96.835 1.00 7.54 H new ATOM 0 HB2 GLN A 156 2.159 24.718 97.063 1.00 7.62 H new ATOM 0 HB3 GLN A 156 0.774 24.855 96.360 1.00 7.62 H new ATOM 0 HG2 GLN A 156 0.292 25.233 98.531 1.00 9.75 H new ATOM 0 HG3 GLN A 156 -0.200 23.770 98.307 1.00 9.75 H new ATOM 0 HE21 GLN A 156 0.985 22.022 99.266 1.00 10.25 H new ATOM 0 HE22 GLN A 156 1.943 22.231 100.387 1.00 10.25 H new ATOM 1208 N GLU A 157 -0.695 22.209 95.471 1.00 7.01 N ATOM 1209 CA GLU A 157 -1.965 21.495 95.544 1.00 7.84 C ATOM 1210 C GLU A 157 -1.995 20.212 94.716 1.00 8.10 C ATOM 1211 O GLU A 157 -3.059 19.633 94.448 1.00 7.98 O ATOM 1212 CB GLU A 157 -3.107 22.452 95.181 1.00 10.03 C ATOM 1213 CG GLU A 157 -3.061 23.715 96.055 1.00 12.14 C ATOM 1214 CD GLU A 157 -4.305 24.567 95.982 1.00 13.15 C ATOM 1215 OE1 GLU A 157 -4.189 25.798 96.163 1.00 13.70 O ATOM 1216 OE2 GLU A 157 -5.400 24.016 95.762 1.00 15.39 O ATOM 0 H GLU A 157 -0.575 22.670 94.755 1.00 7.01 H new ATOM 0 HA GLU A 157 -2.082 21.193 96.458 1.00 7.84 H new ATOM 0 HB2 GLU A 157 -3.042 22.699 94.245 1.00 10.03 H new ATOM 0 HB3 GLU A 157 -3.959 22.004 95.298 1.00 10.03 H new ATOM 0 HG2 GLU A 157 -2.915 23.452 96.977 1.00 12.14 H new ATOM 0 HG3 GLU A 157 -2.298 24.252 95.789 1.00 12.14 H new ATOM 1217 N GLY A 158 -0.805 19.742 94.352 1.00 7.58 N ATOM 1218 CA GLY A 158 -0.684 18.517 93.586 1.00 7.66 C ATOM 1219 C GLY A 158 -0.478 18.717 92.096 1.00 7.39 C ATOM 1220 O GLY A 158 -0.819 19.758 91.532 1.00 8.91 O ATOM 0 H GLY A 158 -0.057 20.122 94.541 1.00 7.58 H new ATOM 0 HA2 GLY A 158 0.060 18.003 93.937 1.00 7.66 H new ATOM 0 HA3 GLY A 158 -1.484 17.986 93.721 1.00 7.66 H new ATOM 1221 N ILE A 159 0.085 17.704 91.458 1.00 7.39 N ATOM 1222 CA ILE A 159 0.325 17.727 90.024 1.00 8.21 C ATOM 1223 C ILE A 159 -0.892 17.149 89.322 1.00 8.33 C ATOM 1224 O ILE A 159 -1.461 17.779 88.432 1.00 10.40 O ATOM 1225 CB ILE A 159 1.589 16.907 89.667 1.00 6.77 C ATOM 1226 CG1 ILE A 159 2.814 17.598 90.280 1.00 6.90 C ATOM 1227 CG2 ILE A 159 1.738 16.774 88.149 1.00 8.60 C ATOM 1228 CD1 ILE A 159 4.133 16.830 90.165 1.00 8.06 C ATOM 0 H ILE A 159 0.340 16.980 91.845 1.00 7.39 H new ATOM 0 HA ILE A 159 0.473 18.641 89.734 1.00 8.21 H new ATOM 0 HB ILE A 159 1.509 16.011 90.030 1.00 6.77 H new ATOM 0 HG12 ILE A 159 2.924 18.463 89.855 1.00 6.90 H new ATOM 0 HG13 ILE A 159 2.636 17.764 91.219 1.00 6.90 H new ATOM 0 HG21 ILE A 159 2.534 16.258 87.946 1.00 8.60 H new ATOM 0 HG22 ILE A 159 0.960 16.323 87.785 1.00 8.60 H new ATOM 0 HG23 ILE A 159 1.815 17.656 87.753 1.00 8.60 H new ATOM 0 HD11 ILE A 159 4.844 17.344 90.579 1.00 8.06 H new ATOM 0 HD12 ILE A 159 4.050 15.974 90.614 1.00 8.06 H new ATOM 0 HD13 ILE A 159 4.342 16.684 89.229 1.00 8.06 H new ATOM 1229 N LEU A 160 -1.322 15.969 89.748 1.00 8.53 N ATOM 1230 CA LEU A 160 -2.474 15.316 89.139 1.00 9.14 C ATOM 1231 C LEU A 160 -3.796 15.701 89.792 1.00 8.96 C ATOM 1232 O LEU A 160 -4.855 15.517 89.190 1.00 11.21 O ATOM 1233 CB LEU A 160 -2.293 13.795 89.199 1.00 10.68 C ATOM 1234 CG LEU A 160 -1.081 13.304 88.403 1.00 16.00 C ATOM 1235 CD1 LEU A 160 -0.904 11.814 88.601 1.00 18.94 C ATOM 1236 CD2 LEU A 160 -1.262 13.642 86.922 1.00 19.09 C ATOM 0 H LEU A 160 -0.960 15.527 90.391 1.00 8.53 H new ATOM 0 HA LEU A 160 -2.517 15.619 88.219 1.00 9.14 H new ATOM 0 HB2 LEU A 160 -2.197 13.522 90.125 1.00 10.68 H new ATOM 0 HB3 LEU A 160 -3.093 13.366 88.858 1.00 10.68 H new ATOM 0 HG LEU A 160 -0.281 13.750 88.723 1.00 16.00 H new ATOM 0 HD11 LEU A 160 -0.135 11.509 88.094 1.00 18.94 H new ATOM 0 HD12 LEU A 160 -0.765 11.627 89.543 1.00 18.94 H new ATOM 0 HD13 LEU A 160 -1.698 11.350 88.293 1.00 18.94 H new ATOM 0 HD21 LEU A 160 -0.492 13.329 86.422 1.00 19.09 H new ATOM 0 HD22 LEU A 160 -2.063 13.209 86.587 1.00 19.09 H new ATOM 0 HD23 LEU A 160 -1.346 14.603 86.817 1.00 19.09 H new ATOM 1237 N SER A 161 -3.741 16.277 90.989 1.00 8.41 N ATOM 1238 CA SER A 161 -4.949 16.619 91.738 1.00 8.22 C ATOM 1239 C SER A 161 -5.392 18.075 91.654 1.00 8.65 C ATOM 1240 O SER A 161 -6.333 18.476 92.334 1.00 9.02 O ATOM 1241 CB SER A 161 -4.752 16.227 93.211 1.00 8.04 C ATOM 1242 OG SER A 161 -4.341 14.867 93.324 1.00 6.94 O ATOM 0 H SER A 161 -3.007 16.480 91.389 1.00 8.41 H new ATOM 0 HA SER A 161 -5.664 16.117 91.317 1.00 8.22 H new ATOM 0 HB2 SER A 161 -4.087 16.805 93.617 1.00 8.04 H new ATOM 0 HB3 SER A 161 -5.580 16.360 93.699 1.00 8.04 H new ATOM 0 HG SER A 161 -3.522 14.806 93.147 1.00 6.94 H new ATOM 1243 N TYR A 162 -4.715 18.862 90.821 1.00 9.53 N ATOM 1244 CA TYR A 162 -5.036 20.281 90.645 1.00 9.53 C ATOM 1245 C TYR A 162 -5.235 20.522 89.144 1.00 9.13 C ATOM 1246 O TYR A 162 -4.526 19.943 88.324 1.00 8.99 O ATOM 1247 CB TYR A 162 -3.888 21.141 91.202 1.00 9.87 C ATOM 1248 CG TYR A 162 -4.156 22.631 91.201 1.00 10.55 C ATOM 1249 CD1 TYR A 162 -3.693 23.442 90.163 1.00 9.48 C ATOM 1250 CD2 TYR A 162 -4.909 23.222 92.214 1.00 11.52 C ATOM 1251 CE1 TYR A 162 -3.980 24.804 90.132 1.00 11.20 C ATOM 1252 CE2 TYR A 162 -5.205 24.588 92.195 1.00 11.97 C ATOM 1253 CZ TYR A 162 -4.736 25.367 91.149 1.00 10.83 C ATOM 1254 OH TYR A 162 -5.026 26.713 91.119 1.00 13.31 O ATOM 0 H TYR A 162 -4.056 18.590 90.341 1.00 9.53 H new ATOM 0 HA TYR A 162 -5.843 20.525 91.125 1.00 9.53 H new ATOM 0 HB2 TYR A 162 -3.701 20.859 92.111 1.00 9.87 H new ATOM 0 HB3 TYR A 162 -3.088 20.968 90.681 1.00 9.87 H new ATOM 0 HD1 TYR A 162 -3.184 23.066 89.481 1.00 9.48 H new ATOM 0 HD2 TYR A 162 -5.220 22.698 92.916 1.00 11.52 H new ATOM 0 HE1 TYR A 162 -3.667 25.333 89.434 1.00 11.20 H new ATOM 0 HE2 TYR A 162 -5.711 24.970 92.876 1.00 11.97 H new ATOM 0 HH TYR A 162 -4.933 27.002 90.336 1.00 13.31 H new ATOM 1255 N PRO A 163 -6.219 21.363 88.765 1.00 10.43 N ATOM 1256 CA PRO A 163 -6.463 21.628 87.340 1.00 10.63 C ATOM 1257 C PRO A 163 -5.225 22.135 86.609 1.00 9.76 C ATOM 1258 O PRO A 163 -4.625 23.124 87.021 1.00 10.74 O ATOM 1259 CB PRO A 163 -7.577 22.675 87.367 1.00 12.26 C ATOM 1260 CG PRO A 163 -8.305 22.364 88.640 1.00 14.06 C ATOM 1261 CD PRO A 163 -7.174 22.106 89.605 1.00 11.41 C ATOM 0 HA PRO A 163 -6.703 20.824 86.853 1.00 10.63 H new ATOM 0 HB2 PRO A 163 -7.221 23.577 87.368 1.00 12.26 H new ATOM 0 HB3 PRO A 163 -8.158 22.600 86.594 1.00 12.26 H new ATOM 0 HG2 PRO A 163 -8.864 23.103 88.927 1.00 14.06 H new ATOM 0 HG3 PRO A 163 -8.884 21.591 88.546 1.00 14.06 H new ATOM 0 HD2 PRO A 163 -6.793 22.930 89.946 1.00 11.41 H new ATOM 0 HD3 PRO A 163 -7.462 21.588 90.372 1.00 11.41 H new ATOM 1262 N ASN A 164 -4.855 21.445 85.534 1.00 10.09 N ATOM 1263 CA ASN A 164 -3.686 21.802 84.724 1.00 10.59 C ATOM 1264 C ASN A 164 -2.387 21.825 85.524 1.00 10.40 C ATOM 1265 O ASN A 164 -1.425 22.505 85.154 1.00 10.08 O ATOM 1266 CB ASN A 164 -3.899 23.160 84.044 1.00 13.47 C ATOM 1267 CG ASN A 164 -5.102 23.163 83.119 1.00 15.66 C ATOM 1268 OD1 ASN A 164 -5.287 22.246 82.319 1.00 19.02 O ATOM 1269 ND2 ASN A 164 -5.925 24.196 83.227 1.00 19.56 N ATOM 0 H ASN A 164 -5.276 20.751 85.250 1.00 10.09 H new ATOM 0 HA ASN A 164 -3.596 21.107 84.054 1.00 10.59 H new ATOM 0 HB2 ASN A 164 -4.014 23.844 84.722 1.00 13.47 H new ATOM 0 HB3 ASN A 164 -3.105 23.393 83.538 1.00 13.47 H new ATOM 0 HD21 ASN A 164 -6.622 24.245 82.726 1.00 19.56 H new ATOM 0 HD22 ASN A 164 -5.762 24.818 83.798 1.00 19.56 H new ATOM 1270 N GLY A 165 -2.345 21.052 86.605 1.00 9.53 N ATOM 1271 CA GLY A 165 -1.152 21.023 87.435 1.00 8.38 C ATOM 1272 C GLY A 165 0.133 20.683 86.702 1.00 7.39 C ATOM 1273 O GLY A 165 1.153 21.343 86.919 1.00 7.49 O ATOM 0 H GLY A 165 -2.987 20.545 86.870 1.00 9.53 H new ATOM 0 HA2 GLY A 165 -1.047 21.890 87.858 1.00 8.38 H new ATOM 0 HA3 GLY A 165 -1.284 20.375 88.145 1.00 8.38 H new ATOM 1274 N GLU A 166 0.111 19.662 85.847 1.00 7.84 N ATOM 1275 CA GLU A 166 1.329 19.287 85.142 1.00 10.13 C ATOM 1276 C GLU A 166 1.748 20.358 84.142 1.00 8.88 C ATOM 1277 O GLU A 166 2.937 20.659 84.019 1.00 9.18 O ATOM 1278 CB GLU A 166 1.185 17.939 84.412 1.00 12.84 C ATOM 1279 CG GLU A 166 2.540 17.415 83.904 1.00 16.93 C ATOM 1280 CD GLU A 166 2.485 16.046 83.238 1.00 18.94 C ATOM 1281 OE1 GLU A 166 3.560 15.557 82.820 1.00 21.77 O ATOM 1282 OE2 GLU A 166 1.388 15.466 83.130 1.00 20.00 O ATOM 0 H GLU A 166 -0.582 19.185 85.666 1.00 7.84 H new ATOM 0 HA GLU A 166 2.017 19.198 85.820 1.00 10.13 H new ATOM 0 HB2 GLU A 166 0.791 17.287 85.012 1.00 12.84 H new ATOM 0 HB3 GLU A 166 0.576 18.040 83.664 1.00 12.84 H new ATOM 0 HG2 GLU A 166 2.903 18.054 83.271 1.00 16.93 H new ATOM 0 HG3 GLU A 166 3.157 17.373 84.651 1.00 16.93 H new ATOM 1283 N ALA A 167 0.781 20.928 83.422 1.00 9.60 N ATOM 1284 CA ALA A 167 1.099 21.980 82.451 1.00 8.13 C ATOM 1285 C ALA A 167 1.697 23.202 83.154 1.00 7.13 C ATOM 1286 O ALA A 167 2.653 23.802 82.660 1.00 8.15 O ATOM 1287 CB ALA A 167 -0.154 22.378 81.670 1.00 9.51 C ATOM 0 H ALA A 167 -0.053 20.725 83.478 1.00 9.60 H new ATOM 0 HA ALA A 167 1.757 21.633 81.829 1.00 8.13 H new ATOM 0 HB1 ALA A 167 0.069 23.074 81.032 1.00 9.51 H new ATOM 0 HB2 ALA A 167 -0.500 21.605 81.197 1.00 9.51 H new ATOM 0 HB3 ALA A 167 -0.828 22.708 82.285 1.00 9.51 H new ATOM 1288 N LEU A 168 1.150 23.572 84.307 1.00 6.88 N ATOM 1289 CA LEU A 168 1.665 24.716 85.049 1.00 6.86 C ATOM 1290 C LEU A 168 3.068 24.445 85.593 1.00 6.16 C ATOM 1291 O LEU A 168 3.917 25.344 85.618 1.00 6.83 O ATOM 1292 CB LEU A 168 0.707 25.078 86.188 1.00 7.57 C ATOM 1293 CG LEU A 168 -0.586 25.760 85.721 1.00 8.12 C ATOM 1294 CD1 LEU A 168 -1.576 25.834 86.874 1.00 9.43 C ATOM 1295 CD2 LEU A 168 -0.264 27.168 85.197 1.00 9.96 C ATOM 0 H LEU A 168 0.482 23.175 84.676 1.00 6.88 H new ATOM 0 HA LEU A 168 1.728 25.467 84.438 1.00 6.86 H new ATOM 0 HB2 LEU A 168 0.479 24.271 86.675 1.00 7.57 H new ATOM 0 HB3 LEU A 168 1.165 25.665 86.810 1.00 7.57 H new ATOM 0 HG LEU A 168 -0.985 25.242 85.004 1.00 8.12 H new ATOM 0 HD11 LEU A 168 -2.391 26.266 86.574 1.00 9.43 H new ATOM 0 HD12 LEU A 168 -1.780 24.938 87.183 1.00 9.43 H new ATOM 0 HD13 LEU A 168 -1.189 26.346 87.601 1.00 9.43 H new ATOM 0 HD21 LEU A 168 -1.082 27.599 84.902 1.00 9.96 H new ATOM 0 HD22 LEU A 168 0.140 27.693 85.906 1.00 9.96 H new ATOM 0 HD23 LEU A 168 0.354 27.103 84.452 1.00 9.96 H new ATOM 1296 N LEU A 169 3.320 23.209 86.022 1.00 6.14 N ATOM 1297 CA LEU A 169 4.638 22.842 86.534 1.00 6.31 C ATOM 1298 C LEU A 169 5.666 22.996 85.402 1.00 6.09 C ATOM 1299 O LEU A 169 6.753 23.562 85.599 1.00 6.55 O ATOM 1300 CB LEU A 169 4.602 21.397 87.055 1.00 6.58 C ATOM 1301 CG LEU A 169 5.909 20.824 87.615 1.00 5.28 C ATOM 1302 CD1 LEU A 169 6.414 21.681 88.786 1.00 8.35 C ATOM 1303 CD2 LEU A 169 5.665 19.381 88.061 1.00 6.74 C ATOM 0 H LEU A 169 2.743 22.571 86.025 1.00 6.14 H new ATOM 0 HA LEU A 169 4.891 23.421 87.270 1.00 6.31 H new ATOM 0 HB2 LEU A 169 3.928 21.344 87.750 1.00 6.58 H new ATOM 0 HB3 LEU A 169 4.308 20.823 86.331 1.00 6.58 H new ATOM 0 HG LEU A 169 6.592 20.836 86.927 1.00 5.28 H new ATOM 0 HD11 LEU A 169 7.240 21.306 89.129 1.00 8.35 H new ATOM 0 HD12 LEU A 169 6.574 22.587 88.479 1.00 8.35 H new ATOM 0 HD13 LEU A 169 5.747 21.692 89.491 1.00 8.35 H new ATOM 0 HD21 LEU A 169 6.487 19.009 88.417 1.00 6.74 H new ATOM 0 HD22 LEU A 169 4.979 19.366 88.747 1.00 6.74 H new ATOM 0 HD23 LEU A 169 5.374 18.852 87.302 1.00 6.74 H new ATOM 1304 N GLU A 170 5.327 22.496 84.217 1.00 6.85 N ATOM 1305 CA GLU A 170 6.239 22.616 83.085 1.00 6.49 C ATOM 1306 C GLU A 170 6.406 24.080 82.651 1.00 6.64 C ATOM 1307 O GLU A 170 7.513 24.503 82.294 1.00 6.65 O ATOM 1308 CB GLU A 170 5.761 21.757 81.909 1.00 7.56 C ATOM 1309 CG GLU A 170 6.757 21.790 80.738 1.00 8.36 C ATOM 1310 CD GLU A 170 6.606 20.647 79.749 1.00 9.38 C ATOM 1311 OE1 GLU A 170 7.489 20.519 78.869 1.00 9.86 O ATOM 1312 OE2 GLU A 170 5.629 19.867 79.837 1.00 10.42 O ATOM 0 H GLU A 170 4.587 22.091 84.049 1.00 6.85 H new ATOM 0 HA GLU A 170 7.107 22.291 83.372 1.00 6.49 H new ATOM 0 HB2 GLU A 170 5.640 20.841 82.205 1.00 7.56 H new ATOM 0 HB3 GLU A 170 4.896 22.074 81.607 1.00 7.56 H new ATOM 0 HG2 GLU A 170 6.652 22.629 80.263 1.00 8.36 H new ATOM 0 HG3 GLU A 170 7.659 21.777 81.095 1.00 8.36 H new ATOM 1313 N GLU A 171 5.324 24.854 82.687 1.00 5.76 N ATOM 1314 CA GLU A 171 5.405 26.271 82.323 1.00 5.80 C ATOM 1315 C GLU A 171 6.399 26.965 83.266 1.00 5.53 C ATOM 1316 O GLU A 171 7.213 27.784 82.837 1.00 6.38 O ATOM 1317 CB GLU A 171 4.023 26.926 82.421 1.00 6.49 C ATOM 1318 CG GLU A 171 4.016 28.396 82.011 1.00 7.38 C ATOM 1319 CD GLU A 171 2.637 29.029 82.060 1.00 8.77 C ATOM 1320 OE1 GLU A 171 2.535 30.236 81.759 1.00 11.69 O ATOM 1321 OE2 GLU A 171 1.648 28.339 82.389 1.00 10.45 O ATOM 0 H GLU A 171 4.540 24.584 82.917 1.00 5.76 H new ATOM 0 HA GLU A 171 5.711 26.358 81.407 1.00 5.80 H new ATOM 0 HB2 GLU A 171 3.401 26.438 81.859 1.00 6.49 H new ATOM 0 HB3 GLU A 171 3.701 26.850 83.333 1.00 6.49 H new ATOM 0 HG2 GLU A 171 4.612 28.890 82.595 1.00 7.38 H new ATOM 0 HG3 GLU A 171 4.369 28.476 81.111 1.00 7.38 H new ATOM 1322 N ALA A 172 6.351 26.624 84.556 1.00 6.35 N ATOM 1323 CA ALA A 172 7.266 27.212 85.533 1.00 6.45 C ATOM 1324 C ALA A 172 8.722 26.891 85.175 1.00 5.68 C ATOM 1325 O ALA A 172 9.609 27.734 85.357 1.00 6.57 O ATOM 1326 CB ALA A 172 6.930 26.698 86.944 1.00 7.32 C ATOM 0 H ALA A 172 5.796 26.055 84.884 1.00 6.35 H new ATOM 0 HA ALA A 172 7.159 28.176 85.518 1.00 6.45 H new ATOM 0 HB1 ALA A 172 7.541 27.092 87.586 1.00 7.32 H new ATOM 0 HB2 ALA A 172 6.020 26.945 87.170 1.00 7.32 H new ATOM 0 HB3 ALA A 172 7.017 25.732 86.966 1.00 7.32 H new ATOM 1327 N LEU A 173 8.979 25.683 84.682 1.00 6.23 N ATOM 1328 CA LEU A 173 10.336 25.319 84.277 1.00 6.96 C ATOM 1329 C LEU A 173 10.725 26.103 83.019 1.00 7.03 C ATOM 1330 O LEU A 173 11.865 26.563 82.900 1.00 6.57 O ATOM 1331 CB LEU A 173 10.443 23.814 84.018 1.00 7.45 C ATOM 1332 CG LEU A 173 10.134 22.926 85.236 1.00 6.43 C ATOM 1333 CD1 LEU A 173 10.222 21.473 84.805 1.00 8.00 C ATOM 1334 CD2 LEU A 173 11.108 23.203 86.382 1.00 7.85 C ATOM 0 H LEU A 173 8.390 25.065 84.574 1.00 6.23 H new ATOM 0 HA LEU A 173 10.946 25.544 84.997 1.00 6.96 H new ATOM 0 HB2 LEU A 173 9.836 23.578 83.299 1.00 7.45 H new ATOM 0 HB3 LEU A 173 11.340 23.615 83.708 1.00 7.45 H new ATOM 0 HG LEU A 173 9.242 23.124 85.561 1.00 6.43 H new ATOM 0 HD11 LEU A 173 10.030 20.898 85.562 1.00 8.00 H new ATOM 0 HD12 LEU A 173 9.577 21.305 84.100 1.00 8.00 H new ATOM 0 HD13 LEU A 173 11.115 21.286 84.477 1.00 8.00 H new ATOM 0 HD21 LEU A 173 10.892 22.632 87.136 1.00 7.85 H new ATOM 0 HD22 LEU A 173 12.014 23.021 86.088 1.00 7.85 H new ATOM 0 HD23 LEU A 173 11.036 24.132 86.650 1.00 7.85 H new ATOM 1335 N ARG A 174 9.789 26.264 82.086 1.00 6.51 N ATOM 1336 CA ARG A 174 10.086 27.022 80.869 1.00 6.39 C ATOM 1337 C ARG A 174 10.376 28.491 81.189 1.00 6.65 C ATOM 1338 O ARG A 174 11.112 29.164 80.452 1.00 7.43 O ATOM 1339 CB ARG A 174 8.935 26.867 79.869 1.00 6.16 C ATOM 1340 CG ARG A 174 8.883 25.446 79.303 1.00 7.84 C ATOM 1341 CD ARG A 174 7.893 25.253 78.157 1.00 9.56 C ATOM 1342 NE ARG A 174 6.496 25.313 78.570 1.00 9.61 N ATOM 1343 CZ ARG A 174 5.740 26.406 78.527 1.00 9.05 C ATOM 1344 NH1 ARG A 174 4.475 26.347 78.921 1.00 9.14 N ATOM 1345 NH2 ARG A 174 6.245 27.561 78.093 1.00 9.68 N ATOM 0 H ARG A 174 8.990 25.950 82.134 1.00 6.51 H new ATOM 0 HA ARG A 174 10.890 26.664 80.461 1.00 6.39 H new ATOM 0 HB2 ARG A 174 8.094 27.075 80.305 1.00 6.16 H new ATOM 0 HB3 ARG A 174 9.044 27.503 79.145 1.00 6.16 H new ATOM 0 HG2 ARG A 174 9.769 25.201 78.994 1.00 7.84 H new ATOM 0 HG3 ARG A 174 8.654 24.834 80.019 1.00 7.84 H new ATOM 0 HD2 ARG A 174 8.052 25.934 77.485 1.00 9.56 H new ATOM 0 HD3 ARG A 174 8.061 24.395 77.737 1.00 9.56 H new ATOM 0 HE ARG A 174 6.135 24.589 78.862 1.00 9.61 H new ATOM 0 HH11 ARG A 174 4.147 25.604 79.203 1.00 9.14 H new ATOM 0 HH12 ARG A 174 3.983 27.052 78.895 1.00 9.14 H new ATOM 0 HH21 ARG A 174 7.065 27.603 77.838 1.00 9.68 H new ATOM 0 HH22 ARG A 174 5.750 28.264 78.068 1.00 9.68 H new ATOM 1346 N LEU A 175 9.830 28.993 82.294 1.00 6.31 N ATOM 1347 CA LEU A 175 10.085 30.366 82.712 1.00 6.81 C ATOM 1348 C LEU A 175 11.402 30.510 83.480 1.00 6.64 C ATOM 1349 O LEU A 175 11.830 31.625 83.785 1.00 8.02 O ATOM 1350 CB LEU A 175 8.923 30.904 83.551 1.00 7.24 C ATOM 1351 CG LEU A 175 7.638 31.178 82.758 1.00 6.43 C ATOM 1352 CD1 LEU A 175 6.452 31.354 83.704 1.00 8.03 C ATOM 1353 CD2 LEU A 175 7.835 32.438 81.889 1.00 7.12 C ATOM 0 H LEU A 175 9.308 28.552 82.816 1.00 6.31 H new ATOM 0 HA LEU A 175 10.164 30.893 81.902 1.00 6.81 H new ATOM 0 HB2 LEU A 175 8.725 30.267 84.255 1.00 7.24 H new ATOM 0 HB3 LEU A 175 9.204 31.726 83.983 1.00 7.24 H new ATOM 0 HG LEU A 175 7.449 30.421 82.182 1.00 6.43 H new ATOM 0 HD11 LEU A 175 5.649 31.526 83.188 1.00 8.03 H new ATOM 0 HD12 LEU A 175 6.333 30.546 84.227 1.00 8.03 H new ATOM 0 HD13 LEU A 175 6.620 32.102 84.299 1.00 8.03 H new ATOM 0 HD21 LEU A 175 7.025 32.614 81.386 1.00 7.12 H new ATOM 0 HD22 LEU A 175 8.033 33.197 82.460 1.00 7.12 H new ATOM 0 HD23 LEU A 175 8.572 32.295 81.274 1.00 7.12 H new ATOM 1354 N GLY A 176 12.029 29.383 83.818 1.00 6.76 N ATOM 1355 CA GLY A 176 13.314 29.448 84.491 1.00 7.54 C ATOM 1356 C GLY A 176 13.475 28.842 85.871 1.00 7.35 C ATOM 1357 O GLY A 176 14.553 28.971 86.452 1.00 8.49 O ATOM 0 H GLY A 176 11.732 28.590 83.669 1.00 6.76 H new ATOM 0 HA2 GLY A 176 13.966 29.024 83.911 1.00 7.54 H new ATOM 0 HA3 GLY A 176 13.559 30.384 84.556 1.00 7.54 H new ATOM 1358 N ALA A 177 12.449 28.200 86.426 1.00 6.70 N ATOM 1359 CA ALA A 177 12.628 27.598 87.756 1.00 6.30 C ATOM 1360 C ALA A 177 13.780 26.584 87.693 1.00 6.03 C ATOM 1361 O ALA A 177 13.903 25.810 86.743 1.00 7.02 O ATOM 1362 CB ALA A 177 11.336 26.920 88.213 1.00 7.54 C ATOM 0 H ALA A 177 11.672 28.101 86.072 1.00 6.70 H new ATOM 0 HA ALA A 177 12.844 28.290 88.400 1.00 6.30 H new ATOM 0 HB1 ALA A 177 11.469 26.528 89.090 1.00 7.54 H new ATOM 0 HB2 ALA A 177 10.624 27.577 88.257 1.00 7.54 H new ATOM 0 HB3 ALA A 177 11.095 26.224 87.582 1.00 7.54 H new ATOM 1363 N ASP A 178 14.619 26.587 88.726 1.00 5.93 N ATOM 1364 CA ASP A 178 15.807 25.734 88.795 1.00 6.37 C ATOM 1365 C ASP A 178 15.574 24.299 89.222 1.00 5.55 C ATOM 1366 O ASP A 178 16.370 23.403 88.911 1.00 6.03 O ATOM 1367 CB ASP A 178 16.802 26.338 89.798 1.00 6.08 C ATOM 1368 CG ASP A 178 17.136 27.782 89.495 1.00 7.62 C ATOM 1369 OD1 ASP A 178 17.823 28.025 88.477 1.00 9.80 O ATOM 1370 OD2 ASP A 178 16.718 28.674 90.260 1.00 8.27 O ATOM 0 H ASP A 178 14.514 27.090 89.416 1.00 5.93 H new ATOM 0 HA ASP A 178 16.134 25.705 87.882 1.00 6.37 H new ATOM 0 HB2 ASP A 178 16.431 26.277 90.692 1.00 6.08 H new ATOM 0 HB3 ASP A 178 17.618 25.814 89.793 1.00 6.08 H new ATOM 1371 N VAL A 179 14.481 24.090 89.942 1.00 5.92 N ATOM 1372 CA VAL A 179 14.209 22.781 90.533 1.00 5.70 C ATOM 1373 C VAL A 179 12.755 22.388 90.334 1.00 5.25 C ATOM 1374 O VAL A 179 11.871 23.245 90.388 1.00 6.09 O ATOM 1375 CB VAL A 179 14.489 22.856 92.077 1.00 5.57 C ATOM 1376 CG1 VAL A 179 14.458 21.471 92.709 1.00 5.95 C ATOM 1377 CG2 VAL A 179 15.827 23.566 92.345 1.00 6.58 C ATOM 0 H VAL A 179 13.884 24.688 90.102 1.00 5.92 H new ATOM 0 HA VAL A 179 14.778 22.124 90.103 1.00 5.70 H new ATOM 0 HB VAL A 179 13.783 23.377 92.491 1.00 5.57 H new ATOM 0 HG11 VAL A 179 14.633 21.545 93.660 1.00 5.95 H new ATOM 0 HG12 VAL A 179 13.585 21.072 92.572 1.00 5.95 H new ATOM 0 HG13 VAL A 179 15.136 20.912 92.298 1.00 5.95 H new ATOM 0 HG21 VAL A 179 15.987 23.605 93.301 1.00 6.58 H new ATOM 0 HG22 VAL A 179 16.546 23.075 91.917 1.00 6.58 H new ATOM 0 HG23 VAL A 179 15.793 24.467 91.986 1.00 6.58 H new ATOM 1378 N VAL A 180 12.515 21.096 90.107 1.00 5.30 N ATOM 1379 CA VAL A 180 11.161 20.570 89.941 1.00 5.85 C ATOM 1380 C VAL A 180 10.681 20.041 91.294 1.00 5.59 C ATOM 1381 O VAL A 180 11.375 19.237 91.922 1.00 6.07 O ATOM 1382 CB VAL A 180 11.103 19.382 88.944 1.00 6.08 C ATOM 1383 CG1 VAL A 180 9.641 19.138 88.533 1.00 6.44 C ATOM 1384 CG2 VAL A 180 11.989 19.646 87.728 1.00 7.39 C ATOM 0 H VAL A 180 13.133 20.501 90.045 1.00 5.30 H new ATOM 0 HA VAL A 180 10.609 21.291 89.600 1.00 5.85 H new ATOM 0 HB VAL A 180 11.444 18.583 89.375 1.00 6.08 H new ATOM 0 HG11 VAL A 180 9.599 18.396 87.910 1.00 6.44 H new ATOM 0 HG12 VAL A 180 9.114 18.928 89.320 1.00 6.44 H new ATOM 0 HG13 VAL A 180 9.286 19.935 88.110 1.00 6.44 H new ATOM 0 HG21 VAL A 180 11.937 18.892 87.120 1.00 7.39 H new ATOM 0 HG22 VAL A 180 11.686 20.448 87.274 1.00 7.39 H new ATOM 0 HG23 VAL A 180 12.907 19.766 88.016 1.00 7.39 H new ATOM 1385 N GLY A 181 9.513 20.493 91.746 1.00 4.91 N ATOM 1386 CA GLY A 181 8.957 20.003 93.004 1.00 5.58 C ATOM 1387 C GLY A 181 7.777 19.062 92.788 1.00 4.94 C ATOM 1388 O GLY A 181 7.312 18.854 91.663 1.00 6.30 O ATOM 0 H GLY A 181 9.030 21.079 91.342 1.00 4.91 H new ATOM 0 HA2 GLY A 181 9.649 19.541 93.503 1.00 5.58 H new ATOM 0 HA3 GLY A 181 8.672 20.756 93.545 1.00 5.58 H new ATOM 1389 N ALA A 182 7.295 18.486 93.894 1.00 5.22 N ATOM 1390 CA ALA A 182 6.152 17.573 93.897 1.00 5.28 C ATOM 1391 C ALA A 182 5.697 17.445 95.350 1.00 4.92 C ATOM 1392 O ALA A 182 6.388 17.895 96.265 1.00 5.29 O ATOM 1393 CB ALA A 182 6.546 16.188 93.326 1.00 5.14 C ATOM 0 H ALA A 182 7.630 18.619 94.675 1.00 5.22 H new ATOM 0 HA ALA A 182 5.439 17.915 93.336 1.00 5.28 H new ATOM 0 HB1 ALA A 182 5.774 15.601 93.338 1.00 5.14 H new ATOM 0 HB2 ALA A 182 6.859 16.291 92.414 1.00 5.14 H new ATOM 0 HB3 ALA A 182 7.252 15.803 93.868 1.00 5.14 H new ATOM 1394 N ILE A 183 4.532 16.838 95.558 1.00 5.00 N ATOM 1395 CA ILE A 183 3.978 16.662 96.909 1.00 5.05 C ATOM 1396 C ILE A 183 3.062 15.421 96.838 1.00 5.22 C ATOM 1397 O ILE A 183 1.838 15.499 97.008 1.00 5.54 O ATOM 1398 CB ILE A 183 3.230 17.971 97.328 1.00 5.11 C ATOM 1399 CG1 ILE A 183 2.792 17.878 98.789 1.00 5.89 C ATOM 1400 CG2 ILE A 183 2.078 18.289 96.365 1.00 6.70 C ATOM 1401 CD1 ILE A 183 2.186 19.167 99.324 1.00 6.78 C ATOM 0 H ILE A 183 4.040 16.517 94.929 1.00 5.00 H new ATOM 0 HA ILE A 183 4.655 16.513 97.588 1.00 5.05 H new ATOM 0 HB ILE A 183 3.839 18.723 97.262 1.00 5.11 H new ATOM 0 HG12 ILE A 183 2.144 17.162 98.880 1.00 5.89 H new ATOM 0 HG13 ILE A 183 3.558 17.638 99.334 1.00 5.89 H new ATOM 0 HG21 ILE A 183 1.634 19.103 96.649 1.00 6.70 H new ATOM 0 HG22 ILE A 183 2.429 18.408 95.469 1.00 6.70 H new ATOM 0 HG23 ILE A 183 1.442 17.557 96.368 1.00 6.70 H new ATOM 0 HD11 ILE A 183 1.930 19.044 100.251 1.00 6.78 H new ATOM 0 HD12 ILE A 183 2.839 19.882 99.262 1.00 6.78 H new ATOM 0 HD13 ILE A 183 1.403 19.398 98.800 1.00 6.78 H new ATOM 1402 N PRO A 184 3.670 14.236 96.651 1.00 5.00 N ATOM 1403 CA PRO A 184 2.878 13.007 96.522 1.00 5.17 C ATOM 1404 C PRO A 184 1.859 12.647 97.585 1.00 4.90 C ATOM 1405 O PRO A 184 0.790 12.130 97.250 1.00 5.75 O ATOM 1406 CB PRO A 184 3.940 11.918 96.294 1.00 5.56 C ATOM 1407 CG PRO A 184 5.164 12.468 96.971 1.00 5.46 C ATOM 1408 CD PRO A 184 5.115 13.948 96.618 1.00 5.39 C ATOM 0 HA PRO A 184 2.246 13.130 95.796 1.00 5.17 H new ATOM 0 HB2 PRO A 184 3.670 11.070 96.680 1.00 5.56 H new ATOM 0 HB3 PRO A 184 4.095 11.763 95.349 1.00 5.56 H new ATOM 0 HG2 PRO A 184 5.138 12.327 97.930 1.00 5.46 H new ATOM 0 HG3 PRO A 184 5.975 12.047 96.644 1.00 5.46 H new ATOM 0 HD2 PRO A 184 5.606 14.488 97.257 1.00 5.39 H new ATOM 0 HD3 PRO A 184 5.498 14.124 95.745 1.00 5.39 H new ATOM 1409 N HIS A 185 2.163 12.919 98.847 1.00 5.48 N ATOM 1410 CA HIS A 185 1.230 12.606 99.930 1.00 5.82 C ATOM 1411 C HIS A 185 -0.005 13.511 99.943 1.00 7.42 C ATOM 1412 O HIS A 185 -0.952 13.243 100.676 1.00 8.77 O ATOM 1413 CB HIS A 185 1.935 12.712 101.285 1.00 7.25 C ATOM 1414 CG HIS A 185 2.593 14.039 101.506 1.00 8.34 C ATOM 1415 ND1 HIS A 185 3.793 14.375 100.915 1.00 9.75 N ATOM 1416 CD2 HIS A 185 2.181 15.141 102.173 1.00 11.16 C ATOM 1417 CE1 HIS A 185 4.088 15.629 101.206 1.00 9.29 C ATOM 1418 NE2 HIS A 185 3.123 16.117 101.967 1.00 9.53 N ATOM 0 H HIS A 185 2.900 13.283 99.101 1.00 5.48 H new ATOM 0 HA HIS A 185 0.927 11.698 99.771 1.00 5.82 H new ATOM 0 HB2 HIS A 185 1.289 12.556 101.992 1.00 7.25 H new ATOM 0 HB3 HIS A 185 2.603 12.012 101.351 1.00 7.25 H new ATOM 0 HD1 HIS A 185 4.274 13.850 100.433 1.00 9.75 H new ATOM 0 HD2 HIS A 185 1.404 15.222 102.677 1.00 11.16 H new ATOM 0 HE1 HIS A 185 4.845 16.090 100.924 1.00 9.29 H new ATOM 1419 N PHE A 186 0.000 14.593 99.164 1.00 5.67 N ATOM 1420 CA PHE A 186 -1.163 15.486 99.107 1.00 5.74 C ATOM 1421 C PHE A 186 -2.039 15.151 97.895 1.00 5.50 C ATOM 1422 O PHE A 186 -3.151 15.666 97.777 1.00 7.11 O ATOM 1423 CB PHE A 186 -0.719 16.965 99.073 1.00 5.94 C ATOM 1424 CG PHE A 186 -1.831 17.956 99.357 1.00 6.95 C ATOM 1425 CD1 PHE A 186 -2.366 18.089 100.638 1.00 8.22 C ATOM 1426 CD2 PHE A 186 -2.327 18.772 98.342 1.00 7.58 C ATOM 1427 CE1 PHE A 186 -3.378 19.029 100.908 1.00 8.44 C ATOM 1428 CE2 PHE A 186 -3.338 19.710 98.600 1.00 8.93 C ATOM 1429 CZ PHE A 186 -3.860 19.837 99.887 1.00 8.59 C ATOM 0 H PHE A 186 0.659 14.828 98.664 1.00 5.67 H new ATOM 0 HA PHE A 186 -1.690 15.351 99.910 1.00 5.74 H new ATOM 0 HB2 PHE A 186 -0.011 17.094 99.723 1.00 5.94 H new ATOM 0 HB3 PHE A 186 -0.342 17.159 98.200 1.00 5.94 H new ATOM 0 HD1 PHE A 186 -2.049 17.548 101.325 1.00 8.22 H new ATOM 0 HD2 PHE A 186 -1.983 18.694 97.482 1.00 7.58 H new ATOM 0 HE1 PHE A 186 -3.723 19.109 101.768 1.00 8.44 H new ATOM 0 HE2 PHE A 186 -3.660 20.247 97.913 1.00 8.93 H new ATOM 0 HZ PHE A 186 -4.528 20.460 100.061 1.00 8.59 H new ATOM 1430 N GLU A 187 -1.548 14.306 96.987 1.00 6.05 N ATOM 1431 CA GLU A 187 -2.361 13.910 95.832 1.00 5.91 C ATOM 1432 C GLU A 187 -3.557 13.087 96.352 1.00 5.99 C ATOM 1433 O GLU A 187 -3.498 12.475 97.430 1.00 6.25 O ATOM 1434 CB GLU A 187 -1.549 13.066 94.841 1.00 5.93 C ATOM 1435 CG GLU A 187 -0.296 13.735 94.272 1.00 5.37 C ATOM 1436 CD GLU A 187 -0.552 14.734 93.140 1.00 6.24 C ATOM 1437 OE1 GLU A 187 0.442 15.323 92.670 1.00 7.03 O ATOM 1438 OE2 GLU A 187 -1.715 14.931 92.720 1.00 7.03 O ATOM 0 H GLU A 187 -0.763 13.956 97.018 1.00 6.05 H new ATOM 0 HA GLU A 187 -2.662 14.705 95.365 1.00 5.91 H new ATOM 0 HB2 GLU A 187 -1.285 12.244 95.282 1.00 5.93 H new ATOM 0 HB3 GLU A 187 -2.127 12.818 94.103 1.00 5.93 H new ATOM 0 HG2 GLU A 187 0.164 14.194 94.992 1.00 5.37 H new ATOM 0 HG3 GLU A 187 0.303 13.045 93.947 1.00 5.37 H new ATOM 1439 N PHE A 188 -4.637 13.067 95.576 1.00 6.06 N ATOM 1440 CA PHE A 188 -5.853 12.362 95.971 1.00 5.53 C ATOM 1441 C PHE A 188 -5.674 10.881 96.294 1.00 5.52 C ATOM 1442 O PHE A 188 -6.347 10.359 97.189 1.00 6.00 O ATOM 1443 CB PHE A 188 -6.921 12.474 94.868 1.00 6.40 C ATOM 1444 CG PHE A 188 -7.473 13.871 94.651 1.00 6.63 C ATOM 1445 CD1 PHE A 188 -7.404 14.850 95.633 1.00 7.29 C ATOM 1446 CD2 PHE A 188 -8.146 14.165 93.460 1.00 8.42 C ATOM 1447 CE1 PHE A 188 -8.003 16.113 95.437 1.00 8.55 C ATOM 1448 CE2 PHE A 188 -8.746 15.419 93.258 1.00 9.21 C ATOM 1449 CZ PHE A 188 -8.672 16.389 94.249 1.00 9.52 C ATOM 0 H PHE A 188 -4.686 13.458 94.812 1.00 6.06 H new ATOM 0 HA PHE A 188 -6.124 12.801 96.792 1.00 5.53 H new ATOM 0 HB2 PHE A 188 -6.540 12.158 94.034 1.00 6.40 H new ATOM 0 HB3 PHE A 188 -7.656 11.880 95.087 1.00 6.40 H new ATOM 0 HD1 PHE A 188 -6.958 14.672 96.429 1.00 7.29 H new ATOM 0 HD2 PHE A 188 -8.197 13.520 92.792 1.00 8.42 H new ATOM 0 HE1 PHE A 188 -7.950 16.761 96.102 1.00 8.55 H new ATOM 0 HE2 PHE A 188 -9.192 15.599 92.462 1.00 9.21 H new ATOM 0 HZ PHE A 188 -9.068 17.220 94.119 1.00 9.52 H new ATOM 1450 N THR A 189 -4.797 10.203 95.558 1.00 5.87 N ATOM 1451 CA THR A 189 -4.592 8.772 95.767 1.00 5.61 C ATOM 1452 C THR A 189 -3.122 8.399 95.733 1.00 5.83 C ATOM 1453 O THR A 189 -2.291 9.132 95.181 1.00 5.63 O ATOM 1454 CB THR A 189 -5.279 7.929 94.675 1.00 5.88 C ATOM 1455 OG1 THR A 189 -4.601 8.141 93.429 1.00 6.24 O ATOM 1456 CG2 THR A 189 -6.748 8.313 94.529 1.00 5.85 C ATOM 0 H THR A 189 -4.314 10.550 94.937 1.00 5.87 H new ATOM 0 HA THR A 189 -4.974 8.586 96.639 1.00 5.61 H new ATOM 0 HB THR A 189 -5.235 6.994 94.928 1.00 5.88 H new ATOM 0 HG1 THR A 189 -5.076 7.853 92.799 1.00 6.24 H new ATOM 0 HG21 THR A 189 -7.157 7.770 93.837 1.00 5.85 H new ATOM 0 HG22 THR A 189 -7.207 8.164 95.371 1.00 5.85 H new ATOM 0 HG23 THR A 189 -6.815 9.250 94.286 1.00 5.85 H new ATOM 1457 N ARG A 190 -2.815 7.241 96.298 1.00 5.17 N ATOM 1458 CA ARG A 190 -1.453 6.729 96.302 1.00 5.32 C ATOM 1459 C ARG A 190 -0.960 6.586 94.861 1.00 5.16 C ATOM 1460 O ARG A 190 0.210 6.874 94.568 1.00 5.71 O ATOM 1461 CB ARG A 190 -1.414 5.361 96.997 1.00 5.72 C ATOM 1462 CG ARG A 190 -0.015 4.824 97.228 1.00 6.77 C ATOM 1463 CD ARG A 190 -0.057 3.400 97.793 1.00 6.75 C ATOM 1464 NE ARG A 190 1.259 2.992 98.290 1.00 7.01 N ATOM 1465 CZ ARG A 190 2.272 2.580 97.531 1.00 7.54 C ATOM 1466 NH1 ARG A 190 3.426 2.254 98.103 1.00 7.58 N ATOM 1467 NH2 ARG A 190 2.136 2.466 96.216 1.00 7.23 N ATOM 0 H ARG A 190 -3.387 6.731 96.689 1.00 5.17 H new ATOM 0 HA ARG A 190 -0.879 7.346 96.782 1.00 5.32 H new ATOM 0 HB2 ARG A 190 -1.869 5.430 97.851 1.00 5.72 H new ATOM 0 HB3 ARG A 190 -1.911 4.723 96.462 1.00 5.72 H new ATOM 0 HG2 ARG A 190 0.479 4.829 96.393 1.00 6.77 H new ATOM 0 HG3 ARG A 190 0.460 5.405 97.842 1.00 6.77 H new ATOM 0 HD2 ARG A 190 -0.707 3.353 98.512 1.00 6.75 H new ATOM 0 HD3 ARG A 190 -0.351 2.784 97.104 1.00 6.75 H new ATOM 0 HE ARG A 190 1.387 3.021 99.140 1.00 7.01 H new ATOM 0 HH11 ARG A 190 3.514 2.310 98.957 1.00 7.58 H new ATOM 0 HH12 ARG A 190 4.085 1.987 97.620 1.00 7.58 H new ATOM 0 HH21 ARG A 190 1.386 2.659 95.843 1.00 7.23 H new ATOM 0 HH22 ARG A 190 2.798 2.199 95.737 1.00 7.23 H new ATOM 1468 N GLU A 191 -1.844 6.139 93.966 1.00 5.30 N ATOM 1469 CA GLU A 191 -1.475 5.970 92.560 1.00 5.66 C ATOM 1470 C GLU A 191 -1.119 7.318 91.929 1.00 6.07 C ATOM 1471 O GLU A 191 -0.148 7.414 91.171 1.00 5.82 O ATOM 1472 CB GLU A 191 -2.598 5.277 91.777 1.00 5.93 C ATOM 1473 CG GLU A 191 -2.777 3.789 92.146 1.00 7.01 C ATOM 1474 CD GLU A 191 -3.270 3.569 93.581 1.00 7.09 C ATOM 1475 OE1 GLU A 191 -4.139 4.328 94.046 1.00 6.09 O ATOM 1476 OE2 GLU A 191 -2.789 2.624 94.246 1.00 10.15 O ATOM 0 H GLU A 191 -2.657 5.929 94.152 1.00 5.30 H new ATOM 0 HA GLU A 191 -0.690 5.401 92.520 1.00 5.66 H new ATOM 0 HB2 GLU A 191 -3.432 5.746 91.938 1.00 5.93 H new ATOM 0 HB3 GLU A 191 -2.412 5.347 90.828 1.00 5.93 H new ATOM 0 HG2 GLU A 191 -3.407 3.384 91.530 1.00 7.01 H new ATOM 0 HG3 GLU A 191 -1.931 3.330 92.029 1.00 7.01 H new ATOM 1477 N TYR A 192 -1.891 8.362 92.222 1.00 5.34 N ATOM 1478 CA TYR A 192 -1.547 9.696 91.703 1.00 5.96 C ATOM 1479 C TYR A 192 -0.192 10.126 92.298 1.00 5.84 C ATOM 1480 O TYR A 192 0.610 10.779 91.625 1.00 6.06 O ATOM 1481 CB TYR A 192 -2.587 10.748 92.106 1.00 6.77 C ATOM 1482 CG TYR A 192 -3.867 10.807 91.297 1.00 7.76 C ATOM 1483 CD1 TYR A 192 -4.155 9.881 90.291 1.00 9.18 C ATOM 1484 CD2 TYR A 192 -4.808 11.800 91.567 1.00 8.59 C ATOM 1485 CE1 TYR A 192 -5.361 9.952 89.579 1.00 9.31 C ATOM 1486 CE2 TYR A 192 -6.002 11.878 90.868 1.00 9.29 C ATOM 1487 CZ TYR A 192 -6.272 10.955 89.882 1.00 9.11 C ATOM 1488 OH TYR A 192 -7.472 11.035 89.206 1.00 11.00 O ATOM 0 H TYR A 192 -2.601 8.328 92.706 1.00 5.34 H new ATOM 0 HA TYR A 192 -1.515 9.639 90.735 1.00 5.96 H new ATOM 0 HB2 TYR A 192 -2.825 10.594 93.034 1.00 6.77 H new ATOM 0 HB3 TYR A 192 -2.164 11.620 92.062 1.00 6.77 H new ATOM 0 HD1 TYR A 192 -3.541 9.211 90.092 1.00 9.18 H new ATOM 0 HD2 TYR A 192 -4.630 12.425 92.232 1.00 8.59 H new ATOM 0 HE1 TYR A 192 -5.549 9.333 88.910 1.00 9.31 H new ATOM 0 HE2 TYR A 192 -6.616 12.548 91.063 1.00 9.29 H new ATOM 0 HH TYR A 192 -8.004 11.522 89.636 1.00 11.00 H new ATOM 1489 N GLY A 193 0.054 9.779 93.563 1.00 5.46 N ATOM 1490 CA GLY A 193 1.323 10.138 94.178 1.00 5.53 C ATOM 1491 C GLY A 193 2.495 9.522 93.436 1.00 5.69 C ATOM 1492 O GLY A 193 3.464 10.214 93.085 1.00 5.74 O ATOM 0 H GLY A 193 -0.490 9.345 94.069 1.00 5.46 H new ATOM 0 HA2 GLY A 193 1.417 11.103 94.189 1.00 5.53 H new ATOM 0 HA3 GLY A 193 1.332 9.842 95.102 1.00 5.53 H new ATOM 1493 N VAL A 194 2.424 8.221 93.174 1.00 5.17 N ATOM 1494 CA VAL A 194 3.510 7.547 92.468 1.00 5.58 C ATOM 1495 C VAL A 194 3.646 8.089 91.038 1.00 5.93 C ATOM 1496 O VAL A 194 4.755 8.388 90.583 1.00 6.29 O ATOM 1497 CB VAL A 194 3.289 6.005 92.452 1.00 5.81 C ATOM 1498 CG1 VAL A 194 4.326 5.329 91.554 1.00 7.62 C ATOM 1499 CG2 VAL A 194 3.409 5.452 93.881 1.00 6.91 C ATOM 0 H VAL A 194 1.764 7.715 93.393 1.00 5.17 H new ATOM 0 HA VAL A 194 4.336 7.729 92.943 1.00 5.58 H new ATOM 0 HB VAL A 194 2.403 5.819 92.104 1.00 5.81 H new ATOM 0 HG11 VAL A 194 4.178 4.370 91.553 1.00 7.62 H new ATOM 0 HG12 VAL A 194 4.243 5.670 90.650 1.00 7.62 H new ATOM 0 HG13 VAL A 194 5.217 5.517 91.889 1.00 7.62 H new ATOM 0 HG21 VAL A 194 3.271 4.492 93.869 1.00 6.91 H new ATOM 0 HG22 VAL A 194 4.293 5.647 94.231 1.00 6.91 H new ATOM 0 HG23 VAL A 194 2.739 5.867 94.446 1.00 6.91 H new ATOM 1500 N GLU A 195 2.527 8.234 90.334 1.00 6.19 N ATOM 1501 CA GLU A 195 2.562 8.746 88.970 1.00 6.69 C ATOM 1502 C GLU A 195 3.146 10.159 88.912 1.00 6.12 C ATOM 1503 O GLU A 195 3.888 10.497 87.975 1.00 6.43 O ATOM 1504 CB GLU A 195 1.149 8.738 88.366 1.00 7.19 C ATOM 1505 CG GLU A 195 1.104 9.171 86.900 1.00 11.12 C ATOM 1506 CD GLU A 195 -0.303 9.169 86.305 1.00 17.03 C ATOM 1507 OE1 GLU A 195 -1.279 8.842 87.022 1.00 19.00 O ATOM 1508 OE2 GLU A 195 -0.433 9.504 85.105 1.00 19.82 O ATOM 0 H GLU A 195 1.741 8.042 90.627 1.00 6.19 H new ATOM 0 HA GLU A 195 3.139 8.164 88.451 1.00 6.69 H new ATOM 0 HB2 GLU A 195 0.778 7.845 88.443 1.00 7.19 H new ATOM 0 HB3 GLU A 195 0.580 9.327 88.886 1.00 7.19 H new ATOM 0 HG2 GLU A 195 1.479 10.062 86.822 1.00 11.12 H new ATOM 0 HG3 GLU A 195 1.669 8.579 86.378 1.00 11.12 H new ATOM 1509 N SER A 196 2.819 10.983 89.900 1.00 5.59 N ATOM 1510 CA SER A 196 3.323 12.352 89.926 1.00 5.80 C ATOM 1511 C SER A 196 4.846 12.366 89.982 1.00 5.68 C ATOM 1512 O SER A 196 5.482 13.268 89.425 1.00 6.51 O ATOM 1513 CB SER A 196 2.740 13.141 91.111 1.00 6.16 C ATOM 1514 OG SER A 196 3.372 12.834 92.345 1.00 6.24 O ATOM 0 H SER A 196 2.310 10.772 90.561 1.00 5.59 H new ATOM 0 HA SER A 196 3.037 12.784 89.106 1.00 5.80 H new ATOM 0 HB2 SER A 196 2.828 14.091 90.936 1.00 6.16 H new ATOM 0 HB3 SER A 196 1.791 12.953 91.183 1.00 6.16 H new ATOM 0 HG SER A 196 3.356 12.003 92.469 1.00 6.24 H new ATOM 1515 N LEU A 197 5.443 11.370 90.628 1.00 5.65 N ATOM 1516 CA LEU A 197 6.897 11.308 90.716 1.00 5.43 C ATOM 1517 C LEU A 197 7.513 10.920 89.370 1.00 5.70 C ATOM 1518 O LEU A 197 8.561 11.451 88.983 1.00 6.19 O ATOM 1519 CB LEU A 197 7.323 10.353 91.843 1.00 5.59 C ATOM 1520 CG LEU A 197 6.911 10.868 93.231 1.00 5.26 C ATOM 1521 CD1 LEU A 197 7.267 9.814 94.265 1.00 6.13 C ATOM 1522 CD2 LEU A 197 7.589 12.201 93.564 1.00 6.91 C ATOM 0 H LEU A 197 5.029 10.726 91.019 1.00 5.65 H new ATOM 0 HA LEU A 197 7.234 12.191 90.935 1.00 5.43 H new ATOM 0 HB2 LEU A 197 6.925 9.481 91.693 1.00 5.59 H new ATOM 0 HB3 LEU A 197 8.285 10.234 91.817 1.00 5.59 H new ATOM 0 HG LEU A 197 5.954 11.029 93.236 1.00 5.26 H new ATOM 0 HD11 LEU A 197 7.012 10.127 95.147 1.00 6.13 H new ATOM 0 HD12 LEU A 197 6.794 8.991 94.065 1.00 6.13 H new ATOM 0 HD13 LEU A 197 8.223 9.650 94.244 1.00 6.13 H new ATOM 0 HD21 LEU A 197 7.308 12.496 94.444 1.00 6.91 H new ATOM 0 HD22 LEU A 197 8.552 12.086 93.555 1.00 6.91 H new ATOM 0 HD23 LEU A 197 7.337 12.866 92.904 1.00 6.91 H new ATOM 1523 N HIS A 198 6.882 10.007 88.639 1.00 5.77 N ATOM 1524 CA HIS A 198 7.400 9.680 87.311 1.00 6.09 C ATOM 1525 C HIS A 198 7.380 10.957 86.450 1.00 5.95 C ATOM 1526 O HIS A 198 8.334 11.233 85.731 1.00 6.70 O ATOM 1527 CB HIS A 198 6.550 8.582 86.653 1.00 7.02 C ATOM 1528 CG HIS A 198 6.813 7.215 87.202 1.00 7.11 C ATOM 1529 ND1 HIS A 198 7.839 6.419 86.740 1.00 8.96 N ATOM 1530 CD2 HIS A 198 6.216 6.519 88.200 1.00 9.39 C ATOM 1531 CE1 HIS A 198 7.862 5.293 87.429 1.00 9.09 C ATOM 1532 NE2 HIS A 198 6.889 5.329 88.321 1.00 8.61 N ATOM 0 H HIS A 198 6.177 9.578 88.880 1.00 5.77 H new ATOM 0 HA HIS A 198 8.308 9.347 87.389 1.00 6.09 H new ATOM 0 HB2 HIS A 198 5.611 8.795 86.771 1.00 7.02 H new ATOM 0 HB3 HIS A 198 6.722 8.578 85.698 1.00 7.02 H new ATOM 0 HD1 HIS A 198 8.379 6.624 86.103 1.00 8.96 H new ATOM 0 HD2 HIS A 198 5.487 6.796 88.707 1.00 9.39 H new ATOM 0 HE1 HIS A 198 8.462 4.593 87.307 1.00 9.09 H new ATOM 1533 N LYS A 199 6.305 11.739 86.535 1.00 6.01 N ATOM 1534 CA LYS A 199 6.201 12.974 85.753 1.00 6.48 C ATOM 1535 C LYS A 199 7.246 14.010 86.173 1.00 6.79 C ATOM 1536 O LYS A 199 7.798 14.718 85.326 1.00 6.54 O ATOM 1537 CB LYS A 199 4.790 13.558 85.875 1.00 7.81 C ATOM 1538 CG LYS A 199 3.726 12.709 85.173 1.00 9.37 C ATOM 1539 CD LYS A 199 2.326 13.263 85.394 1.00 12.91 C ATOM 1540 CE LYS A 199 1.271 12.460 84.647 1.00 15.32 C ATOM 1541 NZ LYS A 199 1.409 12.600 83.174 1.00 17.55 N ATOM 0 H LYS A 199 5.626 11.575 87.037 1.00 6.01 H new ATOM 0 HA LYS A 199 6.376 12.749 84.826 1.00 6.48 H new ATOM 0 HB2 LYS A 199 4.561 13.643 86.814 1.00 7.81 H new ATOM 0 HB3 LYS A 199 4.782 14.452 85.499 1.00 7.81 H new ATOM 0 HG2 LYS A 199 3.914 12.675 84.222 1.00 9.37 H new ATOM 0 HG3 LYS A 199 3.769 11.798 85.503 1.00 9.37 H new ATOM 0 HD2 LYS A 199 2.123 13.258 86.343 1.00 12.91 H new ATOM 0 HD3 LYS A 199 2.295 14.187 85.102 1.00 12.91 H new ATOM 0 HE2 LYS A 199 1.344 11.524 84.891 1.00 15.32 H new ATOM 0 HE3 LYS A 199 0.388 12.755 84.918 1.00 15.32 H new ATOM 0 HZ1 LYS A 199 0.692 12.255 82.774 1.00 17.55 H new ATOM 0 HZ2 LYS A 199 1.480 13.462 82.963 1.00 17.55 H new ATOM 0 HZ3 LYS A 199 2.137 12.167 82.901 1.00 17.55 H new ATOM 1542 N THR A 200 7.519 14.099 87.474 1.00 5.83 N ATOM 1543 CA THR A 200 8.511 15.028 88.011 1.00 5.54 C ATOM 1544 C THR A 200 9.897 14.674 87.471 1.00 5.56 C ATOM 1545 O THR A 200 10.633 15.555 86.995 1.00 6.56 O ATOM 1546 CB THR A 200 8.497 14.960 89.561 1.00 6.00 C ATOM 1547 OG1 THR A 200 7.231 15.438 90.035 1.00 7.12 O ATOM 1548 CG2 THR A 200 9.618 15.795 90.181 1.00 6.01 C ATOM 0 H THR A 200 7.131 13.619 88.073 1.00 5.83 H new ATOM 0 HA THR A 200 8.294 15.932 87.735 1.00 5.54 H new ATOM 0 HB THR A 200 8.638 14.037 89.824 1.00 6.00 H new ATOM 0 HG1 THR A 200 6.641 14.856 89.895 1.00 7.12 H new ATOM 0 HG21 THR A 200 9.576 15.727 91.148 1.00 6.01 H new ATOM 0 HG22 THR A 200 10.476 15.466 89.871 1.00 6.01 H new ATOM 0 HG23 THR A 200 9.514 16.723 89.918 1.00 6.01 H new ATOM 1549 N PHE A 201 10.256 13.393 87.532 1.00 5.53 N ATOM 1550 CA PHE A 201 11.557 12.976 87.027 1.00 5.84 C ATOM 1551 C PHE A 201 11.670 13.175 85.524 1.00 6.29 C ATOM 1552 O PHE A 201 12.721 13.587 85.037 1.00 7.20 O ATOM 1553 CB PHE A 201 11.835 11.520 87.416 1.00 5.96 C ATOM 1554 CG PHE A 201 12.437 11.372 88.789 1.00 5.44 C ATOM 1555 CD1 PHE A 201 13.806 11.184 88.938 1.00 6.44 C ATOM 1556 CD2 PHE A 201 11.649 11.470 89.933 1.00 5.70 C ATOM 1557 CE1 PHE A 201 14.389 11.095 90.196 1.00 6.84 C ATOM 1558 CE2 PHE A 201 12.229 11.378 91.201 1.00 6.52 C ATOM 1559 CZ PHE A 201 13.600 11.191 91.332 1.00 7.11 C ATOM 0 H PHE A 201 9.770 12.762 87.856 1.00 5.53 H new ATOM 0 HA PHE A 201 12.231 13.540 87.437 1.00 5.84 H new ATOM 0 HB2 PHE A 201 11.006 11.018 87.378 1.00 5.96 H new ATOM 0 HB3 PHE A 201 12.435 11.127 86.763 1.00 5.96 H new ATOM 0 HD1 PHE A 201 14.342 11.116 88.181 1.00 6.44 H new ATOM 0 HD2 PHE A 201 10.731 11.597 89.853 1.00 5.70 H new ATOM 0 HE1 PHE A 201 15.307 10.971 90.276 1.00 6.84 H new ATOM 0 HE2 PHE A 201 11.696 11.442 91.960 1.00 6.52 H new ATOM 0 HZ PHE A 201 13.986 11.131 92.176 1.00 7.11 H new ATOM 1560 N ALA A 202 10.602 12.899 84.781 1.00 6.18 N ATOM 1561 CA ALA A 202 10.651 13.100 83.331 1.00 6.71 C ATOM 1562 C ALA A 202 10.903 14.585 83.009 1.00 6.19 C ATOM 1563 O ALA A 202 11.691 14.907 82.111 1.00 7.30 O ATOM 1564 CB ALA A 202 9.348 12.612 82.675 1.00 7.49 C ATOM 0 H ALA A 202 9.855 12.601 85.085 1.00 6.18 H new ATOM 0 HA ALA A 202 11.384 12.579 82.968 1.00 6.71 H new ATOM 0 HB1 ALA A 202 9.396 12.752 81.716 1.00 7.49 H new ATOM 0 HB2 ALA A 202 9.228 11.667 82.858 1.00 7.49 H new ATOM 0 HB3 ALA A 202 8.598 13.109 83.037 1.00 7.49 H new ATOM 1565 N LEU A 203 10.253 15.490 83.740 1.00 6.30 N ATOM 1566 CA LEU A 203 10.463 16.924 83.505 1.00 5.85 C ATOM 1567 C LEU A 203 11.891 17.339 83.865 1.00 6.52 C ATOM 1568 O LEU A 203 12.512 18.145 83.153 1.00 7.03 O ATOM 1569 CB LEU A 203 9.461 17.767 84.306 1.00 5.90 C ATOM 1570 CG LEU A 203 8.043 17.806 83.721 1.00 6.32 C ATOM 1571 CD1 LEU A 203 7.085 18.414 84.736 1.00 8.16 C ATOM 1572 CD2 LEU A 203 8.033 18.629 82.428 1.00 7.69 C ATOM 0 H LEU A 203 9.695 15.302 84.367 1.00 6.30 H new ATOM 0 HA LEU A 203 10.321 17.085 82.559 1.00 5.85 H new ATOM 0 HB2 LEU A 203 9.415 17.420 85.210 1.00 5.90 H new ATOM 0 HB3 LEU A 203 9.797 18.675 84.368 1.00 5.90 H new ATOM 0 HG LEU A 203 7.757 16.902 83.518 1.00 6.32 H new ATOM 0 HD11 LEU A 203 6.190 18.437 84.363 1.00 8.16 H new ATOM 0 HD12 LEU A 203 7.085 17.876 85.543 1.00 8.16 H new ATOM 0 HD13 LEU A 203 7.369 19.317 84.949 1.00 8.16 H new ATOM 0 HD21 LEU A 203 7.134 18.649 82.064 1.00 7.69 H new ATOM 0 HD22 LEU A 203 8.325 19.534 82.618 1.00 7.69 H new ATOM 0 HD23 LEU A 203 8.634 18.225 81.782 1.00 7.69 H new ATOM 1573 N ALA A 204 12.424 16.813 84.967 1.00 5.81 N ATOM 1574 CA ALA A 204 13.784 17.149 85.371 1.00 6.29 C ATOM 1575 C ALA A 204 14.809 16.687 84.337 1.00 6.93 C ATOM 1576 O ALA A 204 15.815 17.364 84.119 1.00 7.31 O ATOM 1577 CB ALA A 204 14.100 16.534 86.734 1.00 6.06 C ATOM 0 H ALA A 204 12.017 16.264 85.489 1.00 5.81 H new ATOM 0 HA ALA A 204 13.841 18.115 85.435 1.00 6.29 H new ATOM 0 HB1 ALA A 204 15.006 16.765 86.991 1.00 6.06 H new ATOM 0 HB2 ALA A 204 13.479 16.877 87.396 1.00 6.06 H new ATOM 0 HB3 ALA A 204 14.015 15.569 86.681 1.00 6.06 H new ATOM 1578 N GLN A 205 14.567 15.542 83.701 1.00 7.14 N ATOM 1579 CA GLN A 205 15.499 15.057 82.687 1.00 8.36 C ATOM 1580 C GLN A 205 15.304 15.826 81.377 1.00 8.95 C ATOM 1581 O GLN A 205 16.275 16.096 80.668 1.00 10.51 O ATOM 1582 CB GLN A 205 15.317 13.550 82.471 1.00 8.25 C ATOM 1583 CG GLN A 205 15.731 12.696 83.674 1.00 9.38 C ATOM 1584 CD GLN A 205 17.218 12.787 83.974 1.00 9.39 C ATOM 1585 OE1 GLN A 205 17.730 13.852 84.322 1.00 10.50 O ATOM 1586 NE2 GLN A 205 17.921 11.665 83.842 1.00 10.86 N ATOM 0 H GLN A 205 13.882 15.040 83.838 1.00 7.14 H new ATOM 0 HA GLN A 205 16.406 15.209 82.996 1.00 8.36 H new ATOM 0 HB2 GLN A 205 14.386 13.372 82.264 1.00 8.25 H new ATOM 0 HB3 GLN A 205 15.836 13.278 81.698 1.00 8.25 H new ATOM 0 HG2 GLN A 205 15.230 12.979 84.455 1.00 9.38 H new ATOM 0 HG3 GLN A 205 15.495 11.770 83.505 1.00 9.38 H new ATOM 0 HE21 GLN A 205 17.530 10.939 83.597 1.00 10.86 H new ATOM 0 HE22 GLN A 205 18.766 11.666 84.002 1.00 10.86 H new ATOM 1587 N LYS A 206 14.067 16.201 81.065 1.00 7.99 N ATOM 1588 CA LYS A 206 13.789 16.947 79.837 1.00 9.30 C ATOM 1589 C LYS A 206 14.443 18.335 79.849 1.00 8.90 C ATOM 1590 O LYS A 206 14.999 18.781 78.837 1.00 9.37 O ATOM 1591 CB LYS A 206 12.274 17.084 79.654 1.00 8.54 C ATOM 1592 CG LYS A 206 11.835 17.886 78.425 1.00 8.83 C ATOM 1593 CD LYS A 206 10.312 17.852 78.288 1.00 8.41 C ATOM 1594 CE LYS A 206 9.834 18.688 77.102 1.00 8.33 C ATOM 1595 NZ LYS A 206 8.348 18.662 76.970 1.00 10.00 N ATOM 0 H LYS A 206 13.375 16.035 81.548 1.00 7.99 H new ATOM 0 HA LYS A 206 14.169 16.453 79.094 1.00 9.30 H new ATOM 0 HB2 LYS A 206 11.888 16.196 79.598 1.00 8.54 H new ATOM 0 HB3 LYS A 206 11.904 17.504 80.446 1.00 8.54 H new ATOM 0 HG2 LYS A 206 12.139 18.804 78.504 1.00 8.83 H new ATOM 0 HG3 LYS A 206 12.246 17.519 77.627 1.00 8.83 H new ATOM 0 HD2 LYS A 206 10.017 16.935 78.178 1.00 8.41 H new ATOM 0 HD3 LYS A 206 9.906 18.185 79.104 1.00 8.41 H new ATOM 0 HE2 LYS A 206 10.133 19.604 77.210 1.00 8.33 H new ATOM 0 HE3 LYS A 206 10.237 18.353 76.286 1.00 8.33 H new ATOM 0 HZ1 LYS A 206 8.114 19.006 76.183 1.00 10.00 H new ATOM 0 HZ2 LYS A 206 8.060 17.822 77.024 1.00 10.00 H new ATOM 0 HZ3 LYS A 206 7.983 19.143 77.624 1.00 10.00 H new ATOM 1596 N TYR A 207 14.416 19.003 80.999 1.00 8.15 N ATOM 1597 CA TYR A 207 14.967 20.347 81.144 1.00 7.88 C ATOM 1598 C TYR A 207 16.321 20.445 81.845 1.00 8.38 C ATOM 1599 O TYR A 207 16.851 21.553 81.995 1.00 8.89 O ATOM 1600 CB TYR A 207 13.958 21.235 81.892 1.00 8.84 C ATOM 1601 CG TYR A 207 12.718 21.534 81.086 1.00 7.47 C ATOM 1602 CD1 TYR A 207 11.591 20.716 81.160 1.00 7.80 C ATOM 1603 CD2 TYR A 207 12.701 22.599 80.183 1.00 8.94 C ATOM 1604 CE1 TYR A 207 10.479 20.948 80.343 1.00 7.86 C ATOM 1605 CE2 TYR A 207 11.606 22.836 79.370 1.00 8.76 C ATOM 1606 CZ TYR A 207 10.501 22.009 79.446 1.00 7.90 C ATOM 1607 OH TYR A 207 9.444 22.224 78.599 1.00 8.93 O ATOM 0 H TYR A 207 14.075 18.687 81.722 1.00 8.15 H new ATOM 0 HA TYR A 207 15.125 20.647 80.235 1.00 7.88 H new ATOM 0 HB2 TYR A 207 13.702 20.797 82.719 1.00 8.84 H new ATOM 0 HB3 TYR A 207 14.388 22.070 82.135 1.00 8.84 H new ATOM 0 HD1 TYR A 207 11.578 20.006 81.761 1.00 7.80 H new ATOM 0 HD2 TYR A 207 13.440 23.160 80.127 1.00 8.94 H new ATOM 0 HE1 TYR A 207 9.732 20.397 80.400 1.00 7.86 H new ATOM 0 HE2 TYR A 207 11.614 23.550 78.774 1.00 8.76 H new ATOM 0 HH TYR A 207 8.896 21.591 78.668 1.00 8.93 H new ATOM 1608 N ASP A 208 16.887 19.306 82.255 1.00 7.68 N ATOM 1609 CA ASP A 208 18.157 19.275 82.997 1.00 7.94 C ATOM 1610 C ASP A 208 18.061 20.158 84.247 1.00 8.46 C ATOM 1611 O ASP A 208 18.822 21.121 84.427 1.00 8.57 O ATOM 1612 CB ASP A 208 19.337 19.736 82.130 1.00 10.20 C ATOM 1613 CG ASP A 208 20.685 19.457 82.790 1.00 13.80 C ATOM 1614 OD1 ASP A 208 21.724 19.928 82.274 1.00 17.45 O ATOM 1615 OD2 ASP A 208 20.717 18.757 83.824 1.00 13.44 O ATOM 0 H ASP A 208 16.547 18.529 82.112 1.00 7.68 H new ATOM 0 HA ASP A 208 18.318 18.355 83.258 1.00 7.94 H new ATOM 0 HB2 ASP A 208 19.300 19.286 81.272 1.00 10.20 H new ATOM 0 HB3 ASP A 208 19.255 20.687 81.955 1.00 10.20 H new ATOM 1616 N ARG A 209 17.115 19.823 85.123 1.00 6.92 N ATOM 1617 CA ARG A 209 16.919 20.582 86.357 1.00 6.24 C ATOM 1618 C ARG A 209 17.052 19.655 87.554 1.00 5.83 C ATOM 1619 O ARG A 209 17.056 18.434 87.402 1.00 6.74 O ATOM 1620 CB ARG A 209 15.527 21.227 86.365 1.00 7.02 C ATOM 1621 CG ARG A 209 15.255 22.188 85.194 1.00 6.66 C ATOM 1622 CD ARG A 209 16.119 23.460 85.217 1.00 7.70 C ATOM 1623 NE ARG A 209 16.174 24.006 83.859 1.00 8.65 N ATOM 1624 CZ ARG A 209 15.231 24.765 83.307 1.00 7.85 C ATOM 1625 NH1 ARG A 209 15.373 25.160 82.048 1.00 10.68 N ATOM 1626 NH2 ARG A 209 14.189 25.189 84.007 1.00 8.37 N ATOM 0 H ARG A 209 16.577 19.160 85.022 1.00 6.92 H new ATOM 0 HA ARG A 209 17.593 21.278 86.407 1.00 6.24 H new ATOM 0 HB2 ARG A 209 14.859 20.524 86.352 1.00 7.02 H new ATOM 0 HB3 ARG A 209 15.413 21.711 87.198 1.00 7.02 H new ATOM 0 HG2 ARG A 209 15.409 21.718 84.359 1.00 6.66 H new ATOM 0 HG3 ARG A 209 14.319 22.443 85.207 1.00 6.66 H new ATOM 0 HD2 ARG A 209 15.743 24.113 85.828 1.00 7.70 H new ATOM 0 HD3 ARG A 209 17.012 23.256 85.535 1.00 7.70 H new ATOM 0 HE ARG A 209 16.867 23.822 83.384 1.00 8.65 H new ATOM 0 HH11 ARG A 209 16.068 24.925 81.599 1.00 10.68 H new ATOM 0 HH12 ARG A 209 14.770 25.651 81.681 1.00 10.68 H new ATOM 0 HH21 ARG A 209 14.112 24.974 84.836 1.00 8.37 H new ATOM 0 HH22 ARG A 209 13.590 25.679 83.632 1.00 8.37 H new ATOM 1627 N LEU A 210 17.172 20.248 88.740 1.00 5.60 N ATOM 1628 CA LEU A 210 17.259 19.473 89.970 1.00 5.31 C ATOM 1629 C LEU A 210 15.835 19.098 90.403 1.00 5.86 C ATOM 1630 O LEU A 210 14.853 19.568 89.818 1.00 6.34 O ATOM 1631 CB LEU A 210 17.941 20.300 91.063 1.00 6.89 C ATOM 1632 CG LEU A 210 19.302 20.906 90.688 1.00 5.81 C ATOM 1633 CD1 LEU A 210 19.838 21.752 91.841 1.00 7.40 C ATOM 1634 CD2 LEU A 210 20.289 19.797 90.324 1.00 7.12 C ATOM 0 H LEU A 210 17.205 21.100 88.852 1.00 5.60 H new ATOM 0 HA LEU A 210 17.784 18.671 89.823 1.00 5.31 H new ATOM 0 HB2 LEU A 210 17.345 21.020 91.320 1.00 6.89 H new ATOM 0 HB3 LEU A 210 18.060 19.738 91.844 1.00 6.89 H new ATOM 0 HG LEU A 210 19.189 21.481 89.915 1.00 5.81 H new ATOM 0 HD11 LEU A 210 20.697 22.129 91.594 1.00 7.40 H new ATOM 0 HD12 LEU A 210 19.214 22.469 92.034 1.00 7.40 H new ATOM 0 HD13 LEU A 210 19.944 21.196 92.629 1.00 7.40 H new ATOM 0 HD21 LEU A 210 21.144 20.189 90.089 1.00 7.12 H new ATOM 0 HD22 LEU A 210 20.403 19.204 91.083 1.00 7.12 H new ATOM 0 HD23 LEU A 210 19.946 19.294 89.569 1.00 7.12 H new ATOM 1635 N ILE A 211 15.732 18.238 91.414 1.00 5.84 N ATOM 1636 CA ILE A 211 14.443 17.805 91.954 1.00 5.62 C ATOM 1637 C ILE A 211 14.443 17.969 93.471 1.00 5.28 C ATOM 1638 O ILE A 211 15.437 17.657 94.139 1.00 5.94 O ATOM 1639 CB ILE A 211 14.173 16.304 91.647 1.00 5.22 C ATOM 1640 CG1 ILE A 211 13.963 16.108 90.142 1.00 6.08 C ATOM 1641 CG2 ILE A 211 12.955 15.799 92.459 1.00 6.43 C ATOM 1642 CD1 ILE A 211 13.848 14.643 89.711 1.00 6.47 C ATOM 0 H ILE A 211 16.411 17.887 91.808 1.00 5.84 H new ATOM 0 HA ILE A 211 13.756 18.350 91.539 1.00 5.62 H new ATOM 0 HB ILE A 211 14.944 15.779 91.915 1.00 5.22 H new ATOM 0 HG12 ILE A 211 13.158 16.578 89.874 1.00 6.08 H new ATOM 0 HG13 ILE A 211 14.702 16.518 89.666 1.00 6.08 H new ATOM 0 HG21 ILE A 211 12.798 14.863 92.259 1.00 6.43 H new ATOM 0 HG22 ILE A 211 13.133 15.901 93.407 1.00 6.43 H new ATOM 0 HG23 ILE A 211 12.170 16.317 92.221 1.00 6.43 H new ATOM 0 HD11 ILE A 211 13.717 14.597 88.751 1.00 6.47 H new ATOM 0 HD12 ILE A 211 14.661 14.171 89.949 1.00 6.47 H new ATOM 0 HD13 ILE A 211 13.093 14.232 90.160 1.00 6.47 H new ATOM 1643 N ASP A 212 13.344 18.486 94.009 1.00 5.01 N ATOM 1644 CA ASP A 212 13.199 18.607 95.460 1.00 5.67 C ATOM 1645 C ASP A 212 11.721 18.383 95.762 1.00 5.54 C ATOM 1646 O ASP A 212 10.868 19.234 95.500 1.00 6.58 O ATOM 1647 CB ASP A 212 13.683 19.969 95.980 1.00 6.42 C ATOM 1648 CG ASP A 212 13.792 20.003 97.505 1.00 5.77 C ATOM 1649 OD1 ASP A 212 14.764 20.584 98.030 1.00 6.33 O ATOM 1650 OD2 ASP A 212 12.897 19.446 98.183 1.00 6.19 O ATOM 0 H ASP A 212 12.672 18.772 93.556 1.00 5.01 H new ATOM 0 HA ASP A 212 13.752 17.952 95.914 1.00 5.67 H new ATOM 0 HB2 ASP A 212 14.548 20.172 95.591 1.00 6.42 H new ATOM 0 HB3 ASP A 212 13.070 20.661 95.686 1.00 6.42 H new ATOM 1651 N VAL A 213 11.433 17.203 96.302 1.00 5.29 N ATOM 1652 CA VAL A 213 10.071 16.777 96.597 1.00 5.60 C ATOM 1653 C VAL A 213 9.656 16.993 98.051 1.00 5.45 C ATOM 1654 O VAL A 213 10.422 16.656 98.949 1.00 5.92 O ATOM 1655 CB VAL A 213 9.939 15.245 96.301 1.00 5.28 C ATOM 1656 CG1 VAL A 213 8.528 14.759 96.616 1.00 6.64 C ATOM 1657 CG2 VAL A 213 10.319 14.944 94.852 1.00 7.25 C ATOM 0 H VAL A 213 12.031 16.621 96.510 1.00 5.29 H new ATOM 0 HA VAL A 213 9.494 17.320 96.038 1.00 5.60 H new ATOM 0 HB VAL A 213 10.555 14.764 96.876 1.00 5.28 H new ATOM 0 HG11 VAL A 213 8.463 13.810 96.428 1.00 6.64 H new ATOM 0 HG12 VAL A 213 8.333 14.916 97.553 1.00 6.64 H new ATOM 0 HG13 VAL A 213 7.889 15.241 96.068 1.00 6.64 H new ATOM 0 HG21 VAL A 213 10.232 13.992 94.685 1.00 7.25 H new ATOM 0 HG22 VAL A 213 9.730 15.432 94.255 1.00 7.25 H new ATOM 0 HG23 VAL A 213 11.236 15.217 94.695 1.00 7.25 H new ATOM 1658 N HIS A 214 8.481 17.592 98.283 1.00 5.95 N ATOM 1659 CA HIS A 214 7.935 17.685 99.655 1.00 5.87 C ATOM 1660 C HIS A 214 7.443 16.234 99.762 1.00 5.92 C ATOM 1661 O HIS A 214 6.386 15.862 99.221 1.00 6.19 O ATOM 1662 CB HIS A 214 6.774 18.682 99.729 1.00 7.42 C ATOM 1663 CG HIS A 214 7.196 20.081 100.076 1.00 7.19 C ATOM 1664 ND1 HIS A 214 7.950 20.874 99.234 1.00 8.33 N ATOM 1665 CD2 HIS A 214 6.982 20.819 101.194 1.00 8.32 C ATOM 1666 CE1 HIS A 214 8.184 22.036 99.818 1.00 8.63 C ATOM 1667 NE2 HIS A 214 7.609 22.029 101.010 1.00 10.24 N ATOM 0 H HIS A 214 7.988 17.947 97.674 1.00 5.95 H new ATOM 0 HA HIS A 214 8.542 17.990 100.347 1.00 5.87 H new ATOM 0 HB2 HIS A 214 6.315 18.694 98.875 1.00 7.42 H new ATOM 0 HB3 HIS A 214 6.135 18.373 100.390 1.00 7.42 H new ATOM 0 HD1 HIS A 214 8.225 20.647 98.451 1.00 8.33 H new ATOM 0 HD2 HIS A 214 6.501 20.556 101.945 1.00 8.32 H new ATOM 0 HE1 HIS A 214 8.670 22.740 99.453 1.00 8.63 H new ATOM 1668 N CYS A 215 8.204 15.424 100.488 1.00 5.30 N ATOM 1669 CA CYS A 215 7.995 13.981 100.511 1.00 4.57 C ATOM 1670 C CYS A 215 7.541 13.364 101.820 1.00 4.50 C ATOM 1671 O CYS A 215 8.282 13.374 102.797 1.00 4.94 O ATOM 1672 CB CYS A 215 9.322 13.334 100.072 1.00 4.90 C ATOM 1673 SG CYS A 215 9.226 11.620 99.520 1.00 6.06 S ATOM 0 H CYS A 215 8.855 15.694 100.981 1.00 5.30 H new ATOM 0 HA CYS A 215 7.248 13.809 99.916 1.00 4.57 H new ATOM 0 HB2 CYS A 215 9.697 13.866 99.353 1.00 4.90 H new ATOM 0 HB3 CYS A 215 9.945 13.381 100.814 1.00 4.90 H new ATOM 0 HG CYS A 215 8.738 10.947 100.386 1.00 6.06 H new ATOM 1674 N ASP A 216 6.336 12.793 101.827 1.00 4.54 N ATOM 1675 CA ASP A 216 5.795 12.135 103.024 1.00 4.70 C ATOM 1676 C ASP A 216 5.788 13.067 104.248 1.00 4.86 C ATOM 1677 O ASP A 216 6.197 12.663 105.345 1.00 4.81 O ATOM 1678 CB ASP A 216 6.603 10.853 103.351 1.00 5.27 C ATOM 1679 CG ASP A 216 6.711 9.892 102.167 1.00 4.69 C ATOM 1680 OD1 ASP A 216 7.853 9.487 101.835 1.00 5.88 O ATOM 1681 OD2 ASP A 216 5.665 9.528 101.579 1.00 4.85 O ATOM 0 H ASP A 216 5.811 12.775 101.146 1.00 4.54 H new ATOM 0 HA ASP A 216 4.875 11.899 102.825 1.00 4.70 H new ATOM 0 HB2 ASP A 216 7.495 11.104 103.639 1.00 5.27 H new ATOM 0 HB3 ASP A 216 6.183 10.394 104.095 1.00 5.27 H new ATOM 1682 N GLU A 217 5.327 14.308 104.068 1.00 4.74 N ATOM 1683 CA GLU A 217 5.257 15.247 105.205 1.00 4.92 C ATOM 1684 C GLU A 217 3.903 14.991 105.875 1.00 5.18 C ATOM 1685 O GLU A 217 2.956 15.776 105.750 1.00 5.68 O ATOM 1686 CB GLU A 217 5.362 16.717 104.745 1.00 6.33 C ATOM 1687 CG GLU A 217 5.499 17.676 105.940 1.00 7.75 C ATOM 1688 CD GLU A 217 5.425 19.150 105.581 1.00 9.35 C ATOM 1689 OE1 GLU A 217 5.224 19.478 104.391 1.00 8.98 O ATOM 1690 OE2 GLU A 217 5.569 19.997 106.499 1.00 9.19 O ATOM 0 H GLU A 217 5.055 14.625 103.316 1.00 4.74 H new ATOM 0 HA GLU A 217 5.998 15.103 105.814 1.00 4.92 H new ATOM 0 HB2 GLU A 217 6.127 16.819 104.158 1.00 6.33 H new ATOM 0 HB3 GLU A 217 4.575 16.952 104.229 1.00 6.33 H new ATOM 0 HG2 GLU A 217 4.799 17.476 106.582 1.00 7.75 H new ATOM 0 HG3 GLU A 217 6.346 17.505 106.381 1.00 7.75 H new ATOM 1691 N ILE A 218 3.830 13.881 106.604 1.00 5.15 N ATOM 1692 CA ILE A 218 2.578 13.443 107.205 1.00 5.36 C ATOM 1693 C ILE A 218 2.868 12.300 108.183 1.00 5.20 C ATOM 1694 O ILE A 218 3.751 11.473 107.937 1.00 5.55 O ATOM 1695 CB ILE A 218 1.628 12.956 106.054 1.00 4.90 C ATOM 1696 CG1 ILE A 218 0.254 12.569 106.601 1.00 5.66 C ATOM 1697 CG2 ILE A 218 2.280 11.789 105.273 1.00 6.73 C ATOM 1698 CD1 ILE A 218 -0.780 12.245 105.504 1.00 7.27 C ATOM 0 H ILE A 218 4.500 13.365 106.762 1.00 5.15 H new ATOM 0 HA ILE A 218 2.153 14.167 107.691 1.00 5.36 H new ATOM 0 HB ILE A 218 1.494 13.691 105.435 1.00 4.90 H new ATOM 0 HG12 ILE A 218 0.351 11.798 107.181 1.00 5.66 H new ATOM 0 HG13 ILE A 218 -0.084 13.295 107.149 1.00 5.66 H new ATOM 0 HG21 ILE A 218 1.683 11.499 104.566 1.00 6.73 H new ATOM 0 HG22 ILE A 218 3.118 12.087 104.886 1.00 6.73 H new ATOM 0 HG23 ILE A 218 2.448 11.049 105.877 1.00 6.73 H new ATOM 0 HD11 ILE A 218 -1.626 12.008 105.916 1.00 7.27 H new ATOM 0 HD12 ILE A 218 -0.904 13.022 104.936 1.00 7.27 H new ATOM 0 HD13 ILE A 218 -0.462 11.501 104.969 1.00 7.27 H new ATOM 1699 N ASP A 219 2.141 12.262 109.299 1.00 5.14 N ATOM 1700 CA ASP A 219 2.325 11.197 110.292 1.00 4.96 C ATOM 1701 C ASP A 219 1.512 9.967 109.874 1.00 5.48 C ATOM 1702 O ASP A 219 0.607 9.525 110.585 1.00 6.60 O ATOM 1703 CB ASP A 219 1.870 11.675 111.681 1.00 5.64 C ATOM 1704 CG ASP A 219 2.733 12.797 112.233 1.00 5.67 C ATOM 1705 OD1 ASP A 219 2.157 13.713 112.858 1.00 7.27 O ATOM 1706 OD2 ASP A 219 3.968 12.777 112.047 1.00 6.29 O ATOM 0 H ASP A 219 1.537 12.840 109.502 1.00 5.14 H new ATOM 0 HA ASP A 219 3.266 10.966 110.338 1.00 4.96 H new ATOM 0 HB2 ASP A 219 0.950 11.977 111.628 1.00 5.64 H new ATOM 0 HB3 ASP A 219 1.888 10.926 112.297 1.00 5.64 H new ATOM 1707 N ASP A 220 1.839 9.430 108.706 1.00 5.24 N ATOM 1708 CA ASP A 220 1.154 8.255 108.149 1.00 5.19 C ATOM 1709 C ASP A 220 2.228 7.203 107.889 1.00 5.32 C ATOM 1710 O ASP A 220 3.065 7.372 107.003 1.00 5.50 O ATOM 1711 CB ASP A 220 0.447 8.648 106.837 1.00 5.80 C ATOM 1712 CG ASP A 220 -0.228 7.474 106.137 1.00 5.01 C ATOM 1713 OD1 ASP A 220 -0.621 7.650 104.956 1.00 7.21 O ATOM 1714 OD2 ASP A 220 -0.360 6.392 106.756 1.00 6.45 O ATOM 0 H ASP A 220 2.469 9.735 108.206 1.00 5.24 H new ATOM 0 HA ASP A 220 0.481 7.910 108.757 1.00 5.19 H new ATOM 0 HB2 ASP A 220 -0.218 9.328 107.027 1.00 5.80 H new ATOM 0 HB3 ASP A 220 1.095 9.046 106.235 1.00 5.80 H new ATOM 1715 N GLU A 221 2.198 6.110 108.651 1.00 5.36 N ATOM 1716 CA GLU A 221 3.186 5.046 108.506 1.00 5.55 C ATOM 1717 C GLU A 221 3.140 4.357 107.136 1.00 5.17 C ATOM 1718 O GLU A 221 4.066 3.620 106.777 1.00 5.87 O ATOM 1719 CB GLU A 221 3.024 4.012 109.639 1.00 7.95 C ATOM 1720 CG GLU A 221 1.888 3.003 109.475 1.00 8.74 C ATOM 1721 CD GLU A 221 0.488 3.565 109.682 1.00 9.51 C ATOM 1722 OE1 GLU A 221 -0.475 2.837 109.315 1.00 10.35 O ATOM 1723 OE2 GLU A 221 0.332 4.698 110.210 1.00 9.31 O ATOM 0 H GLU A 221 1.609 5.967 109.261 1.00 5.36 H new ATOM 0 HA GLU A 221 4.058 5.465 108.569 1.00 5.55 H new ATOM 0 HB2 GLU A 221 3.857 3.522 109.726 1.00 7.95 H new ATOM 0 HB3 GLU A 221 2.888 4.491 110.472 1.00 7.95 H new ATOM 0 HG2 GLU A 221 1.940 2.621 108.585 1.00 8.74 H new ATOM 0 HG3 GLU A 221 2.026 2.277 110.103 1.00 8.74 H new ATOM 1724 N GLN A 222 2.076 4.609 106.371 1.00 4.47 N ATOM 1725 CA GLN A 222 1.931 4.033 105.033 1.00 4.44 C ATOM 1726 C GLN A 222 2.385 4.996 103.927 1.00 4.95 C ATOM 1727 O GLN A 222 2.321 4.646 102.747 1.00 5.81 O ATOM 1728 CB GLN A 222 0.469 3.627 104.787 1.00 4.98 C ATOM 1729 CG GLN A 222 0.011 2.495 105.694 1.00 5.58 C ATOM 1730 CD GLN A 222 -1.492 2.274 105.656 1.00 4.95 C ATOM 1731 OE1 GLN A 222 -2.086 2.122 104.589 1.00 6.19 O ATOM 1732 NE2 GLN A 222 -2.112 2.239 106.831 1.00 6.34 N ATOM 0 H GLN A 222 1.423 5.115 106.611 1.00 4.47 H new ATOM 0 HA GLN A 222 2.505 3.252 104.998 1.00 4.44 H new ATOM 0 HB2 GLN A 222 -0.104 4.398 104.924 1.00 4.98 H new ATOM 0 HB3 GLN A 222 0.364 3.357 103.861 1.00 4.98 H new ATOM 0 HG2 GLN A 222 0.460 1.676 105.432 1.00 5.58 H new ATOM 0 HG3 GLN A 222 0.281 2.688 106.605 1.00 5.58 H new ATOM 0 HE21 GLN A 222 -1.664 2.349 107.557 1.00 6.34 H new ATOM 0 HE22 GLN A 222 -2.961 2.106 106.865 1.00 6.34 H new ATOM 1733 N SER A 223 2.829 6.199 104.287 1.00 4.44 N ATOM 1734 CA SER A 223 3.280 7.166 103.279 1.00 4.64 C ATOM 1735 C SER A 223 4.747 6.841 103.013 1.00 4.41 C ATOM 1736 O SER A 223 5.628 7.198 103.800 1.00 4.95 O ATOM 1737 CB SER A 223 3.108 8.597 103.798 1.00 4.67 C ATOM 1738 OG SER A 223 3.237 9.540 102.743 1.00 5.62 O ATOM 0 H SER A 223 2.878 6.475 105.100 1.00 4.44 H new ATOM 0 HA SER A 223 2.760 7.106 102.462 1.00 4.64 H new ATOM 0 HB2 SER A 223 2.238 8.691 104.216 1.00 4.67 H new ATOM 0 HB3 SER A 223 3.772 8.779 104.482 1.00 4.67 H new ATOM 0 HG SER A 223 4.010 9.494 102.418 1.00 5.62 H new ATOM 1739 N ARG A 224 4.991 6.158 101.892 1.00 4.38 N ATOM 1740 CA ARG A 224 6.318 5.680 101.503 1.00 4.92 C ATOM 1741 C ARG A 224 6.757 6.160 100.126 1.00 4.39 C ATOM 1742 O ARG A 224 7.422 5.437 99.378 1.00 5.57 O ATOM 1743 CB ARG A 224 6.331 4.145 101.538 1.00 5.41 C ATOM 1744 CG ARG A 224 6.133 3.584 102.940 1.00 4.92 C ATOM 1745 CD ARG A 224 6.071 2.060 102.940 1.00 6.31 C ATOM 1746 NE ARG A 224 6.039 1.525 104.298 1.00 6.27 N ATOM 1747 CZ ARG A 224 6.108 0.232 104.615 1.00 5.83 C ATOM 1748 NH1 ARG A 224 6.073 -0.123 105.887 1.00 6.71 N ATOM 1749 NH2 ARG A 224 6.205 -0.700 103.674 1.00 7.34 N ATOM 0 H ARG A 224 4.376 5.956 101.326 1.00 4.38 H new ATOM 0 HA ARG A 224 6.949 6.050 102.140 1.00 4.92 H new ATOM 0 HB2 ARG A 224 5.632 3.807 100.957 1.00 5.41 H new ATOM 0 HB3 ARG A 224 7.175 3.825 101.182 1.00 5.41 H new ATOM 0 HG2 ARG A 224 6.860 3.878 103.511 1.00 4.92 H new ATOM 0 HG3 ARG A 224 5.314 3.941 103.318 1.00 4.92 H new ATOM 0 HD2 ARG A 224 5.282 1.767 102.457 1.00 6.31 H new ATOM 0 HD3 ARG A 224 6.840 1.704 102.469 1.00 6.31 H new ATOM 0 HE ARG A 224 5.970 2.088 104.944 1.00 6.27 H new ATOM 0 HH11 ARG A 224 6.006 0.477 106.499 1.00 6.71 H new ATOM 0 HH12 ARG A 224 6.117 -0.954 106.103 1.00 6.71 H new ATOM 0 HH21 ARG A 224 6.224 -0.473 102.845 1.00 7.34 H new ATOM 0 HH22 ARG A 224 6.249 -1.530 103.894 1.00 7.34 H new ATOM 1750 N PHE A 225 6.402 7.384 99.780 1.00 4.57 N ATOM 1751 CA PHE A 225 6.792 7.908 98.480 1.00 4.37 C ATOM 1752 C PHE A 225 8.304 8.068 98.355 1.00 4.21 C ATOM 1753 O PHE A 225 8.852 8.051 97.244 1.00 5.00 O ATOM 1754 CB PHE A 225 6.029 9.215 98.198 1.00 4.81 C ATOM 1755 CG PHE A 225 4.539 9.016 98.091 1.00 4.84 C ATOM 1756 CD1 PHE A 225 3.682 9.481 99.084 1.00 4.77 C ATOM 1757 CD2 PHE A 225 3.999 8.291 97.025 1.00 6.50 C ATOM 1758 CE1 PHE A 225 2.313 9.227 99.026 1.00 5.83 C ATOM 1759 CE2 PHE A 225 2.622 8.032 96.960 1.00 6.30 C ATOM 1760 CZ PHE A 225 1.781 8.498 97.958 1.00 6.82 C ATOM 0 H PHE A 225 5.944 7.921 100.271 1.00 4.57 H new ATOM 0 HA PHE A 225 6.545 7.264 97.798 1.00 4.37 H new ATOM 0 HB2 PHE A 225 6.215 9.851 98.906 1.00 4.81 H new ATOM 0 HB3 PHE A 225 6.358 9.604 97.373 1.00 4.81 H new ATOM 0 HD1 PHE A 225 4.028 9.968 99.797 1.00 4.77 H new ATOM 0 HD2 PHE A 225 4.559 7.977 96.352 1.00 6.50 H new ATOM 0 HE1 PHE A 225 1.753 9.543 99.698 1.00 5.83 H new ATOM 0 HE2 PHE A 225 2.273 7.547 96.247 1.00 6.30 H new ATOM 0 HZ PHE A 225 0.868 8.327 97.918 1.00 6.82 H new ATOM 1761 N VAL A 226 8.995 8.185 99.486 1.00 4.75 N ATOM 1762 CA VAL A 226 10.443 8.300 99.464 1.00 5.10 C ATOM 1763 C VAL A 226 11.111 7.128 98.715 1.00 4.73 C ATOM 1764 O VAL A 226 12.137 7.327 98.048 1.00 4.89 O ATOM 1765 CB VAL A 226 11.020 8.405 100.912 1.00 6.10 C ATOM 1766 CG1 VAL A 226 10.728 7.125 101.704 1.00 7.29 C ATOM 1767 CG2 VAL A 226 12.523 8.712 100.870 1.00 7.26 C ATOM 0 H VAL A 226 8.644 8.200 100.271 1.00 4.75 H new ATOM 0 HA VAL A 226 10.649 9.116 98.981 1.00 5.10 H new ATOM 0 HB VAL A 226 10.581 9.139 101.370 1.00 6.10 H new ATOM 0 HG11 VAL A 226 11.093 7.208 102.599 1.00 7.29 H new ATOM 0 HG12 VAL A 226 9.769 6.989 101.757 1.00 7.29 H new ATOM 0 HG13 VAL A 226 11.137 6.367 101.257 1.00 7.29 H new ATOM 0 HG21 VAL A 226 12.866 8.774 101.775 1.00 7.26 H new ATOM 0 HG22 VAL A 226 12.985 8.002 100.397 1.00 7.26 H new ATOM 0 HG23 VAL A 226 12.669 9.554 100.411 1.00 7.26 H new ATOM 1768 N GLU A 227 10.564 5.911 98.788 1.00 4.23 N ATOM 1769 CA GLU A 227 11.221 4.805 98.076 1.00 4.37 C ATOM 1770 C GLU A 227 11.147 5.005 96.556 1.00 4.76 C ATOM 1771 O GLU A 227 12.061 4.601 95.834 1.00 5.83 O ATOM 1772 CB GLU A 227 10.671 3.421 98.507 1.00 4.91 C ATOM 1773 CG GLU A 227 9.249 3.081 98.089 1.00 5.11 C ATOM 1774 CD GLU A 227 8.795 1.699 98.555 1.00 5.25 C ATOM 1775 OE1 GLU A 227 7.806 1.176 97.987 1.00 6.43 O ATOM 1776 OE2 GLU A 227 9.415 1.139 99.491 1.00 7.00 O ATOM 0 H GLU A 227 9.849 5.708 99.221 1.00 4.23 H new ATOM 0 HA GLU A 227 12.158 4.816 98.327 1.00 4.37 H new ATOM 0 HB2 GLU A 227 11.261 2.738 98.151 1.00 4.91 H new ATOM 0 HB3 GLU A 227 10.722 3.364 99.474 1.00 4.91 H new ATOM 0 HG2 GLU A 227 8.645 3.750 98.447 1.00 5.11 H new ATOM 0 HG3 GLU A 227 9.183 3.127 97.122 1.00 5.11 H new ATOM 1777 N THR A 228 10.077 5.625 96.067 1.00 5.30 N ATOM 1778 CA THR A 228 9.979 5.888 94.636 1.00 5.31 C ATOM 1779 C THR A 228 10.959 7.003 94.244 1.00 5.26 C ATOM 1780 O THR A 228 11.613 6.922 93.209 1.00 5.71 O ATOM 1781 CB THR A 228 8.538 6.261 94.239 1.00 5.51 C ATOM 1782 OG1 THR A 228 7.698 5.106 94.413 1.00 6.47 O ATOM 1783 CG2 THR A 228 8.461 6.716 92.769 1.00 6.48 C ATOM 0 H THR A 228 9.409 5.897 96.536 1.00 5.30 H new ATOM 0 HA THR A 228 10.215 5.079 94.155 1.00 5.31 H new ATOM 0 HB THR A 228 8.243 6.994 94.802 1.00 5.51 H new ATOM 0 HG1 THR A 228 7.419 5.079 95.205 1.00 6.47 H new ATOM 0 HG21 THR A 228 7.544 6.944 92.548 1.00 6.48 H new ATOM 0 HG22 THR A 228 9.027 7.493 92.641 1.00 6.48 H new ATOM 0 HG23 THR A 228 8.763 5.998 92.191 1.00 6.48 H new ATOM 1784 N VAL A 229 11.072 8.043 95.065 1.00 4.89 N ATOM 1785 CA VAL A 229 12.016 9.119 94.767 1.00 5.04 C ATOM 1786 C VAL A 229 13.428 8.546 94.658 1.00 5.46 C ATOM 1787 O VAL A 229 14.164 8.833 93.707 1.00 6.30 O ATOM 1788 CB VAL A 229 11.996 10.215 95.862 1.00 5.04 C ATOM 1789 CG1 VAL A 229 13.065 11.265 95.570 1.00 6.52 C ATOM 1790 CG2 VAL A 229 10.626 10.879 95.920 1.00 6.21 C ATOM 0 H VAL A 229 10.620 8.146 95.789 1.00 4.89 H new ATOM 0 HA VAL A 229 11.750 9.523 93.926 1.00 5.04 H new ATOM 0 HB VAL A 229 12.181 9.800 96.719 1.00 5.04 H new ATOM 0 HG11 VAL A 229 13.046 11.947 96.260 1.00 6.52 H new ATOM 0 HG12 VAL A 229 13.938 10.843 95.557 1.00 6.52 H new ATOM 0 HG13 VAL A 229 12.891 11.673 94.707 1.00 6.52 H new ATOM 0 HG21 VAL A 229 10.626 11.562 96.608 1.00 6.21 H new ATOM 0 HG22 VAL A 229 10.426 11.285 95.062 1.00 6.21 H new ATOM 0 HG23 VAL A 229 9.952 10.213 96.127 1.00 6.21 H new ATOM 1791 N ALA A 230 13.811 7.722 95.629 1.00 4.86 N ATOM 1792 CA ALA A 230 15.152 7.137 95.616 1.00 5.29 C ATOM 1793 C ALA A 230 15.366 6.137 94.473 1.00 5.65 C ATOM 1794 O ALA A 230 16.424 6.128 93.841 1.00 6.03 O ATOM 1795 CB ALA A 230 15.449 6.472 96.961 1.00 5.97 C ATOM 0 H ALA A 230 13.319 7.490 96.296 1.00 4.86 H new ATOM 0 HA ALA A 230 15.772 7.868 95.464 1.00 5.29 H new ATOM 0 HB1 ALA A 230 16.339 6.087 96.942 1.00 5.97 H new ATOM 0 HB2 ALA A 230 15.398 7.134 97.668 1.00 5.97 H new ATOM 0 HB3 ALA A 230 14.798 5.772 97.127 1.00 5.97 H new ATOM 1796 N ALA A 231 14.374 5.299 94.198 1.00 5.12 N ATOM 1797 CA ALA A 231 14.503 4.315 93.126 1.00 5.53 C ATOM 1798 C ALA A 231 14.595 4.972 91.751 1.00 6.01 C ATOM 1799 O ALA A 231 15.387 4.530 90.908 1.00 6.34 O ATOM 1800 CB ALA A 231 13.332 3.337 93.160 1.00 6.29 C ATOM 0 H ALA A 231 13.622 5.282 94.616 1.00 5.12 H new ATOM 0 HA ALA A 231 15.331 3.833 93.277 1.00 5.53 H new ATOM 0 HB1 ALA A 231 13.430 2.690 92.444 1.00 6.29 H new ATOM 0 HB2 ALA A 231 13.320 2.875 94.013 1.00 6.29 H new ATOM 0 HB3 ALA A 231 12.501 3.823 93.044 1.00 6.29 H new ATOM 1801 N LEU A 232 13.789 6.006 91.505 1.00 5.79 N ATOM 1802 CA LEU A 232 13.848 6.687 90.213 1.00 6.60 C ATOM 1803 C LEU A 232 15.191 7.397 90.064 1.00 6.30 C ATOM 1804 O LEU A 232 15.774 7.414 88.975 1.00 7.33 O ATOM 1805 CB LEU A 232 12.694 7.684 90.061 1.00 7.29 C ATOM 1806 CG LEU A 232 11.325 7.043 89.818 1.00 7.51 C ATOM 1807 CD1 LEU A 232 10.245 8.112 89.807 1.00 9.08 C ATOM 1808 CD2 LEU A 232 11.338 6.292 88.485 1.00 12.08 C ATOM 0 H LEU A 232 13.213 6.323 92.060 1.00 5.79 H new ATOM 0 HA LEU A 232 13.760 6.023 89.511 1.00 6.60 H new ATOM 0 HB2 LEU A 232 12.645 8.229 90.862 1.00 7.29 H new ATOM 0 HB3 LEU A 232 12.894 8.282 89.323 1.00 7.29 H new ATOM 0 HG LEU A 232 11.134 6.416 90.533 1.00 7.51 H new ATOM 0 HD11 LEU A 232 9.381 7.698 89.653 1.00 9.08 H new ATOM 0 HD12 LEU A 232 10.235 8.571 90.661 1.00 9.08 H new ATOM 0 HD13 LEU A 232 10.428 8.750 89.100 1.00 9.08 H new ATOM 0 HD21 LEU A 232 10.470 5.887 88.333 1.00 12.08 H new ATOM 0 HD22 LEU A 232 11.535 6.912 87.766 1.00 12.08 H new ATOM 0 HD23 LEU A 232 12.017 5.600 88.510 1.00 12.08 H new ATOM 1809 N ALA A 233 15.697 7.975 91.146 1.00 5.82 N ATOM 1810 CA ALA A 233 16.991 8.646 91.087 1.00 6.45 C ATOM 1811 C ALA A 233 18.079 7.626 90.762 1.00 7.14 C ATOM 1812 O ALA A 233 18.950 7.883 89.924 1.00 7.51 O ATOM 1813 CB ALA A 233 17.296 9.328 92.412 1.00 6.77 C ATOM 0 H ALA A 233 15.314 7.991 91.916 1.00 5.82 H new ATOM 0 HA ALA A 233 16.965 9.322 90.392 1.00 6.45 H new ATOM 0 HB1 ALA A 233 18.158 9.769 92.358 1.00 6.77 H new ATOM 0 HB2 ALA A 233 16.608 9.985 92.604 1.00 6.77 H new ATOM 0 HB3 ALA A 233 17.316 8.665 93.120 1.00 6.77 H new ATOM 1814 N HIS A 234 18.023 6.461 91.407 1.00 6.84 N ATOM 1815 CA HIS A 234 19.025 5.427 91.172 1.00 7.90 C ATOM 1816 C HIS A 234 18.962 4.936 89.728 1.00 8.66 C ATOM 1817 O HIS A 234 19.995 4.776 89.077 1.00 9.05 O ATOM 1818 CB HIS A 234 18.824 4.254 92.146 1.00 8.25 C ATOM 1819 CG HIS A 234 19.911 3.224 92.083 1.00 8.81 C ATOM 1820 ND1 HIS A 234 19.838 2.111 91.272 1.00 10.00 N ATOM 1821 CD2 HIS A 234 21.109 3.156 92.712 1.00 10.78 C ATOM 1822 CE1 HIS A 234 20.944 1.400 91.408 1.00 9.32 C ATOM 1823 NE2 HIS A 234 21.731 2.011 92.275 1.00 10.67 N ATOM 0 H HIS A 234 17.417 6.252 91.980 1.00 6.84 H new ATOM 0 HA HIS A 234 19.902 5.811 91.327 1.00 7.90 H new ATOM 0 HB2 HIS A 234 18.770 4.601 93.050 1.00 8.25 H new ATOM 0 HB3 HIS A 234 17.974 3.827 91.955 1.00 8.25 H new ATOM 0 HD1 HIS A 234 19.177 1.911 90.759 1.00 10.00 H new ATOM 0 HD2 HIS A 234 21.447 3.769 93.324 1.00 10.78 H new ATOM 0 HE1 HIS A 234 21.136 0.604 90.967 1.00 9.32 H new ATOM 1824 N HIS A 235 17.755 4.714 89.223 1.00 8.21 N ATOM 1825 CA HIS A 235 17.564 4.236 87.858 1.00 10.35 C ATOM 1826 C HIS A 235 18.150 5.208 86.832 1.00 11.07 C ATOM 1827 O HIS A 235 18.796 4.784 85.866 1.00 13.55 O ATOM 1828 CB HIS A 235 16.072 4.039 87.580 1.00 12.37 C ATOM 1829 CG HIS A 235 15.769 3.624 86.175 1.00 16.02 C ATOM 1830 ND1 HIS A 235 16.034 2.359 85.700 1.00 19.66 N ATOM 1831 CD2 HIS A 235 15.245 4.316 85.135 1.00 18.57 C ATOM 1832 CE1 HIS A 235 15.685 2.288 84.427 1.00 19.24 C ATOM 1833 NE2 HIS A 235 15.204 3.462 84.060 1.00 20.84 N ATOM 0 H HIS A 235 17.024 4.836 89.660 1.00 8.21 H new ATOM 0 HA HIS A 235 18.031 3.390 87.773 1.00 10.35 H new ATOM 0 HB2 HIS A 235 15.724 3.369 88.188 1.00 12.37 H new ATOM 0 HB3 HIS A 235 15.604 4.867 87.772 1.00 12.37 H new ATOM 0 HD2 HIS A 235 14.965 5.203 85.147 1.00 18.57 H new ATOM 0 HE1 HIS A 235 15.765 1.538 83.882 1.00 19.24 H new ATOM 0 HE2 HIS A 235 14.912 3.660 83.275 1.00 20.84 H new ATOM 1834 N GLU A 236 17.927 6.504 87.050 1.00 11.14 N ATOM 1835 CA GLU A 236 18.408 7.555 86.150 1.00 12.90 C ATOM 1836 C GLU A 236 19.852 7.979 86.434 1.00 12.49 C ATOM 1837 O GLU A 236 20.410 8.794 85.696 1.00 14.63 O ATOM 1838 CB GLU A 236 17.489 8.784 86.256 1.00 13.14 C ATOM 1839 CG GLU A 236 16.024 8.543 85.874 1.00 15.55 C ATOM 1840 CD GLU A 236 15.763 8.577 84.370 1.00 16.10 C ATOM 1841 OE1 GLU A 236 14.663 8.148 83.962 1.00 19.79 O ATOM 1842 OE2 GLU A 236 16.635 9.040 83.597 1.00 15.65 O ATOM 0 H GLU A 236 17.490 6.801 87.728 1.00 11.14 H new ATOM 0 HA GLU A 236 18.390 7.185 85.253 1.00 12.90 H new ATOM 0 HB2 GLU A 236 17.520 9.115 87.167 1.00 13.14 H new ATOM 0 HB3 GLU A 236 17.845 9.485 85.688 1.00 13.14 H new ATOM 0 HG2 GLU A 236 15.746 7.681 86.222 1.00 15.55 H new ATOM 0 HG3 GLU A 236 15.472 9.215 86.304 1.00 15.55 H new ATOM 1843 N GLY A 237 20.459 7.428 87.483 1.00 11.43 N ATOM 1844 CA GLY A 237 21.820 7.783 87.857 1.00 11.87 C ATOM 1845 C GLY A 237 21.935 9.270 88.144 1.00 12.70 C ATOM 1846 O GLY A 237 22.894 9.924 87.726 1.00 16.07 O ATOM 0 H GLY A 237 20.093 6.841 87.994 1.00 11.43 H new ATOM 0 HA2 GLY A 237 22.086 7.277 88.641 1.00 11.87 H new ATOM 0 HA3 GLY A 237 22.429 7.540 87.142 1.00 11.87 H new ATOM 1847 N MET A 238 20.975 9.816 88.883 1.00 10.03 N ATOM 1848 CA MET A 238 20.990 11.251 89.153 1.00 9.65 C ATOM 1849 C MET A 238 20.800 11.631 90.614 1.00 10.13 C ATOM 1850 O MET A 238 20.328 12.730 90.909 1.00 11.06 O ATOM 1851 CB MET A 238 19.908 11.926 88.301 1.00 12.25 C ATOM 1852 CG MET A 238 18.491 11.464 88.636 1.00 12.16 C ATOM 1853 SD MET A 238 17.184 12.101 87.546 1.00 11.40 S ATOM 1854 CE MET A 238 17.077 13.773 88.100 1.00 12.21 C ATOM 0 H MET A 238 20.318 9.384 89.232 1.00 10.03 H new ATOM 0 HA MET A 238 21.879 11.561 88.920 1.00 9.65 H new ATOM 0 HB2 MET A 238 19.964 12.887 88.422 1.00 12.25 H new ATOM 0 HB3 MET A 238 20.086 11.747 87.364 1.00 12.25 H new ATOM 0 HG2 MET A 238 18.469 10.495 88.610 1.00 12.16 H new ATOM 0 HG3 MET A 238 18.288 11.728 89.547 1.00 12.16 H new ATOM 0 HE1 MET A 238 16.398 14.241 87.589 1.00 12.21 H new ATOM 0 HE2 MET A 238 16.840 13.788 89.040 1.00 12.21 H new ATOM 0 HE3 MET A 238 17.934 14.211 87.976 1.00 12.21 H new ATOM 1855 N GLY A 239 21.187 10.746 91.527 1.00 9.09 N ATOM 1856 CA GLY A 239 21.005 11.020 92.944 1.00 10.16 C ATOM 1857 C GLY A 239 21.461 12.378 93.451 1.00 8.06 C ATOM 1858 O GLY A 239 20.771 13.014 94.225 1.00 9.46 O ATOM 0 H GLY A 239 21.553 9.989 91.348 1.00 9.09 H new ATOM 0 HA2 GLY A 239 20.062 10.923 93.151 1.00 10.16 H new ATOM 0 HA3 GLY A 239 21.477 10.337 93.446 1.00 10.16 H new ATOM 1859 N ALA A 240 22.626 12.831 93.005 1.00 9.79 N ATOM 1860 CA ALA A 240 23.176 14.113 93.430 1.00 9.78 C ATOM 1861 C ALA A 240 22.253 15.302 93.151 1.00 9.09 C ATOM 1862 O ALA A 240 22.308 16.319 93.832 1.00 11.45 O ATOM 1863 CB ALA A 240 24.521 14.338 92.737 1.00 10.65 C ATOM 0 H ALA A 240 23.121 12.404 92.447 1.00 9.79 H new ATOM 0 HA ALA A 240 23.281 14.067 94.393 1.00 9.78 H new ATOM 0 HB1 ALA A 240 24.891 15.190 93.017 1.00 10.65 H new ATOM 0 HB2 ALA A 240 25.133 13.625 92.979 1.00 10.65 H new ATOM 0 HB3 ALA A 240 24.393 14.342 91.775 1.00 10.65 H new ATOM 1864 N ARG A 241 21.404 15.161 92.151 1.00 7.08 N ATOM 1865 CA ARG A 241 20.487 16.221 91.737 1.00 6.51 C ATOM 1866 C ARG A 241 19.111 16.143 92.398 1.00 5.92 C ATOM 1867 O ARG A 241 18.251 16.975 92.118 1.00 6.38 O ATOM 1868 CB ARG A 241 20.295 16.122 90.218 1.00 7.55 C ATOM 1869 CG ARG A 241 21.545 16.458 89.391 1.00 7.52 C ATOM 1870 CD ARG A 241 21.426 15.955 87.953 1.00 8.17 C ATOM 1871 NE ARG A 241 20.252 16.509 87.286 1.00 7.93 N ATOM 1872 CZ ARG A 241 19.566 15.886 86.332 1.00 7.46 C ATOM 1873 NH1 ARG A 241 18.502 16.469 85.788 1.00 8.11 N ATOM 1874 NH2 ARG A 241 19.930 14.676 85.919 1.00 8.57 N ATOM 0 H ARG A 241 21.338 14.442 91.684 1.00 7.08 H new ATOM 0 HA ARG A 241 20.885 17.062 92.011 1.00 6.51 H new ATOM 0 HB2 ARG A 241 20.009 15.222 89.998 1.00 7.55 H new ATOM 0 HB3 ARG A 241 19.578 16.720 89.955 1.00 7.55 H new ATOM 0 HG2 ARG A 241 21.682 17.418 89.387 1.00 7.52 H new ATOM 0 HG3 ARG A 241 22.325 16.062 89.809 1.00 7.52 H new ATOM 0 HD2 ARG A 241 22.224 16.196 87.458 1.00 8.17 H new ATOM 0 HD3 ARG A 241 21.373 14.986 87.951 1.00 8.17 H new ATOM 0 HE ARG A 241 19.986 17.291 87.526 1.00 7.93 H new ATOM 0 HH11 ARG A 241 18.257 17.250 86.053 1.00 8.11 H new ATOM 0 HH12 ARG A 241 18.059 16.066 85.171 1.00 8.11 H new ATOM 0 HH21 ARG A 241 20.614 14.290 86.269 1.00 8.57 H new ATOM 0 HH22 ARG A 241 19.481 14.279 85.302 1.00 8.57 H new ATOM 1875 N VAL A 242 18.927 15.167 93.284 1.00 5.84 N ATOM 1876 CA VAL A 242 17.631 14.899 93.900 1.00 5.49 C ATOM 1877 C VAL A 242 17.598 15.061 95.410 1.00 5.55 C ATOM 1878 O VAL A 242 18.501 14.614 96.114 1.00 5.90 O ATOM 1879 CB VAL A 242 17.201 13.450 93.536 1.00 5.38 C ATOM 1880 CG1 VAL A 242 15.834 13.112 94.150 1.00 6.34 C ATOM 1881 CG2 VAL A 242 17.163 13.291 92.016 1.00 7.03 C ATOM 0 H VAL A 242 19.554 14.639 93.546 1.00 5.84 H new ATOM 0 HA VAL A 242 17.019 15.565 93.549 1.00 5.49 H new ATOM 0 HB VAL A 242 17.851 12.831 93.903 1.00 5.38 H new ATOM 0 HG11 VAL A 242 15.587 12.205 93.910 1.00 6.34 H new ATOM 0 HG12 VAL A 242 15.885 13.188 95.116 1.00 6.34 H new ATOM 0 HG13 VAL A 242 15.166 13.729 93.812 1.00 6.34 H new ATOM 0 HG21 VAL A 242 16.895 12.386 91.792 1.00 7.03 H new ATOM 0 HG22 VAL A 242 16.526 13.919 91.641 1.00 7.03 H new ATOM 0 HG23 VAL A 242 18.044 13.466 91.650 1.00 7.03 H new ATOM 1882 N THR A 243 16.522 15.670 95.893 1.00 4.86 N ATOM 1883 CA THR A 243 16.309 15.899 97.316 1.00 5.35 C ATOM 1884 C THR A 243 14.897 15.493 97.734 1.00 5.53 C ATOM 1885 O THR A 243 13.922 15.731 97.005 1.00 5.68 O ATOM 1886 CB THR A 243 16.488 17.390 97.669 1.00 5.32 C ATOM 1887 OG1 THR A 243 17.840 17.766 97.409 1.00 6.72 O ATOM 1888 CG2 THR A 243 16.182 17.657 99.147 1.00 5.58 C ATOM 0 H THR A 243 15.886 15.966 95.396 1.00 4.86 H new ATOM 0 HA THR A 243 16.965 15.361 97.786 1.00 5.35 H new ATOM 0 HB THR A 243 15.871 17.907 97.128 1.00 5.32 H new ATOM 0 HG1 THR A 243 17.903 18.060 96.625 1.00 6.72 H new ATOM 0 HG21 THR A 243 16.303 18.600 99.337 1.00 5.58 H new ATOM 0 HG22 THR A 243 15.265 17.404 99.339 1.00 5.58 H new ATOM 0 HG23 THR A 243 16.784 17.136 99.701 1.00 5.58 H new ATOM 1889 N ALA A 244 14.810 14.828 98.886 1.00 5.32 N ATOM 1890 CA ALA A 244 13.524 14.468 99.482 1.00 4.72 C ATOM 1891 C ALA A 244 13.416 15.341 100.741 1.00 4.56 C ATOM 1892 O ALA A 244 14.148 15.134 101.718 1.00 5.14 O ATOM 1893 CB ALA A 244 13.477 12.978 99.848 1.00 6.88 C ATOM 0 H ALA A 244 15.493 14.574 99.343 1.00 5.32 H new ATOM 0 HA ALA A 244 12.788 14.616 98.867 1.00 4.72 H new ATOM 0 HB1 ALA A 244 12.615 12.768 100.240 1.00 6.88 H new ATOM 0 HB2 ALA A 244 13.607 12.444 99.049 1.00 6.88 H new ATOM 0 HB3 ALA A 244 14.179 12.779 100.487 1.00 6.88 H new ATOM 1894 N SER A 245 12.537 16.338 100.695 1.00 4.69 N ATOM 1895 CA SER A 245 12.326 17.236 101.830 1.00 5.17 C ATOM 1896 C SER A 245 11.303 16.628 102.791 1.00 5.05 C ATOM 1897 O SER A 245 10.352 15.951 102.366 1.00 5.40 O ATOM 1898 CB SER A 245 11.830 18.616 101.355 1.00 5.95 C ATOM 1899 OG SER A 245 12.889 19.448 100.886 1.00 6.33 O ATOM 0 H SER A 245 12.048 16.513 100.010 1.00 4.69 H new ATOM 0 HA SER A 245 13.174 17.352 102.287 1.00 5.17 H new ATOM 0 HB2 SER A 245 11.180 18.495 100.646 1.00 5.95 H new ATOM 0 HB3 SER A 245 11.373 19.061 102.086 1.00 5.95 H new ATOM 0 HG SER A 245 12.903 19.437 100.046 1.00 6.33 H new ATOM 1900 N HIS A 246 11.525 16.886 104.078 1.00 4.91 N ATOM 1901 CA HIS A 246 10.685 16.438 105.191 1.00 4.58 C ATOM 1902 C HIS A 246 10.791 14.973 105.611 1.00 4.67 C ATOM 1903 O HIS A 246 11.396 14.674 106.646 1.00 4.92 O ATOM 1904 CB HIS A 246 9.201 16.797 104.960 1.00 5.57 C ATOM 1905 CG HIS A 246 8.912 18.266 105.030 1.00 5.60 C ATOM 1906 ND1 HIS A 246 9.121 19.018 106.169 1.00 6.76 N ATOM 1907 CD2 HIS A 246 8.408 19.114 104.102 1.00 6.77 C ATOM 1908 CE1 HIS A 246 8.750 20.267 105.935 1.00 7.39 C ATOM 1909 NE2 HIS A 246 8.315 20.352 104.691 1.00 7.29 N ATOM 0 H HIS A 246 12.201 17.349 104.340 1.00 4.91 H new ATOM 0 HA HIS A 246 11.059 16.932 105.937 1.00 4.58 H new ATOM 0 HB2 HIS A 246 8.929 16.464 104.091 1.00 5.57 H new ATOM 0 HB3 HIS A 246 8.660 16.338 105.622 1.00 5.57 H new ATOM 0 HD2 HIS A 246 8.169 18.899 103.229 1.00 6.77 H new ATOM 0 HE1 HIS A 246 8.789 20.968 106.545 1.00 7.39 H new ATOM 0 HE2 HIS A 246 8.021 21.066 104.311 1.00 7.29 H new ATOM 1910 N THR A 247 10.230 14.071 104.800 1.00 5.21 N ATOM 1911 CA THR A 247 10.132 12.628 105.096 1.00 4.61 C ATOM 1912 C THR A 247 9.777 12.393 106.569 1.00 4.68 C ATOM 1913 O THR A 247 10.294 11.486 107.229 1.00 4.99 O ATOM 1914 CB THR A 247 11.395 11.784 104.658 1.00 4.49 C ATOM 1915 OG1 THR A 247 12.570 12.160 105.389 1.00 5.18 O ATOM 1916 CG2 THR A 247 11.634 11.962 103.155 1.00 5.30 C ATOM 0 H THR A 247 9.886 14.283 104.041 1.00 5.21 H new ATOM 0 HA THR A 247 9.407 12.296 104.543 1.00 4.61 H new ATOM 0 HB THR A 247 11.215 10.852 104.856 1.00 4.49 H new ATOM 0 HG1 THR A 247 12.393 12.812 105.888 1.00 5.18 H new ATOM 0 HG21 THR A 247 12.409 11.444 102.887 1.00 5.30 H new ATOM 0 HG22 THR A 247 10.855 11.655 102.665 1.00 5.30 H new ATOM 0 HG23 THR A 247 11.789 12.900 102.961 1.00 5.30 H new ATOM 1917 N THR A 248 8.847 13.200 107.075 1.00 4.23 N ATOM 1918 CA THR A 248 8.462 13.063 108.475 1.00 4.74 C ATOM 1919 C THR A 248 7.749 11.742 108.756 1.00 4.96 C ATOM 1920 O THR A 248 7.778 11.258 109.887 1.00 5.02 O ATOM 1921 CB THR A 248 7.605 14.249 108.952 1.00 5.26 C ATOM 1922 OG1 THR A 248 6.463 14.381 108.103 1.00 6.34 O ATOM 1923 CG2 THR A 248 8.420 15.545 108.920 1.00 6.12 C ATOM 0 H THR A 248 8.437 13.817 106.638 1.00 4.23 H new ATOM 0 HA THR A 248 9.289 13.063 108.982 1.00 4.74 H new ATOM 0 HB THR A 248 7.319 14.083 109.864 1.00 5.26 H new ATOM 0 HG1 THR A 248 5.994 15.027 108.363 1.00 6.34 H new ATOM 0 HG21 THR A 248 7.867 16.283 109.223 1.00 6.12 H new ATOM 0 HG22 THR A 248 9.190 15.458 109.503 1.00 6.12 H new ATOM 0 HG23 THR A 248 8.719 15.717 108.014 1.00 6.12 H new ATOM 1924 N ALA A 249 7.125 11.142 107.741 1.00 4.34 N ATOM 1925 CA ALA A 249 6.472 9.848 107.941 1.00 4.38 C ATOM 1926 C ALA A 249 7.491 8.802 108.394 1.00 5.25 C ATOM 1927 O ALA A 249 7.134 7.840 109.081 1.00 5.14 O ATOM 1928 CB ALA A 249 5.805 9.387 106.647 1.00 5.20 C ATOM 0 H ALA A 249 7.069 11.460 106.944 1.00 4.34 H new ATOM 0 HA ALA A 249 5.796 9.950 108.629 1.00 4.38 H new ATOM 0 HB1 ALA A 249 5.376 8.529 106.792 1.00 5.20 H new ATOM 0 HB2 ALA A 249 5.140 10.039 106.375 1.00 5.20 H new ATOM 0 HB3 ALA A 249 6.475 9.300 105.951 1.00 5.20 H new ATOM 1929 N MET A 250 8.760 8.979 108.027 1.00 4.65 N ATOM 1930 CA MET A 250 9.788 8.014 108.400 1.00 5.22 C ATOM 1931 C MET A 250 9.908 7.904 109.924 1.00 5.87 C ATOM 1932 O MET A 250 10.340 6.870 110.444 1.00 6.89 O ATOM 1933 CB MET A 250 11.130 8.411 107.776 1.00 6.96 C ATOM 1934 CG MET A 250 12.121 7.258 107.677 1.00 6.74 C ATOM 1935 SD MET A 250 13.776 7.770 107.161 1.00 8.28 S ATOM 1936 CE MET A 250 13.440 8.373 105.515 1.00 8.29 C ATOM 0 H MET A 250 9.043 9.647 107.565 1.00 4.65 H new ATOM 0 HA MET A 250 9.532 7.142 108.060 1.00 5.22 H new ATOM 0 HB2 MET A 250 10.972 8.769 106.888 1.00 6.96 H new ATOM 0 HB3 MET A 250 11.525 9.123 108.303 1.00 6.96 H new ATOM 0 HG2 MET A 250 12.181 6.818 108.539 1.00 6.74 H new ATOM 0 HG3 MET A 250 11.782 6.603 107.047 1.00 6.74 H new ATOM 0 HE1 MET A 250 14.276 8.494 105.038 1.00 8.29 H new ATOM 0 HE2 MET A 250 12.888 7.731 105.042 1.00 8.29 H new ATOM 0 HE3 MET A 250 12.974 9.222 105.570 1.00 8.29 H new ATOM 1937 N HIS A 251 9.519 8.955 110.645 1.00 5.48 N ATOM 1938 CA HIS A 251 9.545 8.937 112.111 1.00 6.22 C ATOM 1939 C HIS A 251 8.584 7.878 112.652 1.00 7.03 C ATOM 1940 O HIS A 251 8.742 7.406 113.791 1.00 8.68 O ATOM 1941 CB HIS A 251 9.108 10.304 112.656 1.00 6.23 C ATOM 1942 CG HIS A 251 9.383 10.492 114.116 1.00 5.40 C ATOM 1943 ND1 HIS A 251 10.507 10.912 114.737 1.00 7.42 N flip ATOM 1944 CD2 HIS A 251 8.474 10.215 115.116 1.00 5.33 C flip ATOM 1945 CE1 HIS A 251 10.266 10.879 116.088 1.00 4.36 C flip ATOM 1946 NE2 HIS A 251 9.034 10.457 116.293 1.00 9.20 N flip ATOM 0 H HIS A 251 9.235 9.692 110.304 1.00 5.48 H new ATOM 0 HA HIS A 251 10.450 8.733 112.394 1.00 6.22 H new ATOM 0 HB2 HIS A 251 9.563 11.001 112.158 1.00 6.23 H new ATOM 0 HB3 HIS A 251 8.158 10.416 112.498 1.00 6.23 H new ATOM 0 HD1 HIS A 251 11.239 11.155 114.356 1.00 7.42 H new ATOM 0 HD2 HIS A 251 7.606 9.907 114.985 1.00 5.33 H new ATOM 0 HE1 HIS A 251 10.873 11.116 116.751 1.00 4.36 H new ATOM 1947 N SER A 252 7.589 7.516 111.841 1.00 6.26 N ATOM 1948 CA SER A 252 6.557 6.556 112.242 1.00 6.86 C ATOM 1949 C SER A 252 6.633 5.164 111.609 1.00 7.17 C ATOM 1950 O SER A 252 5.779 4.316 111.888 1.00 9.39 O ATOM 1951 CB SER A 252 5.176 7.157 111.981 1.00 8.17 C ATOM 1952 OG SER A 252 5.002 8.359 112.731 1.00 10.61 O ATOM 0 H SER A 252 7.493 7.820 111.042 1.00 6.26 H new ATOM 0 HA SER A 252 6.722 6.403 113.186 1.00 6.86 H new ATOM 0 HB2 SER A 252 5.072 7.342 111.035 1.00 8.17 H new ATOM 0 HB3 SER A 252 4.488 6.517 112.222 1.00 8.17 H new ATOM 0 HG SER A 252 5.239 9.017 112.265 1.00 10.61 H new ATOM 1953 N TYR A 253 7.645 4.915 110.783 1.00 6.67 N ATOM 1954 CA TYR A 253 7.797 3.601 110.152 1.00 6.72 C ATOM 1955 C TYR A 253 8.273 2.542 111.141 1.00 8.55 C ATOM 1956 O TYR A 253 8.955 2.856 112.125 1.00 8.62 O ATOM 1957 CB TYR A 253 8.872 3.617 109.069 1.00 5.78 C ATOM 1958 CG TYR A 253 8.642 4.445 107.828 1.00 4.51 C ATOM 1959 CD1 TYR A 253 7.384 4.966 107.501 1.00 4.93 C ATOM 1960 CD2 TYR A 253 9.704 4.678 106.950 1.00 5.05 C ATOM 1961 CE1 TYR A 253 7.200 5.705 106.316 1.00 4.81 C ATOM 1962 CE2 TYR A 253 9.534 5.403 105.783 1.00 4.82 C ATOM 1963 CZ TYR A 253 8.287 5.914 105.472 1.00 4.58 C ATOM 1964 OH TYR A 253 8.147 6.657 104.325 1.00 5.33 O ATOM 0 H TYR A 253 8.252 5.487 110.574 1.00 6.67 H new ATOM 0 HA TYR A 253 6.918 3.396 109.796 1.00 6.72 H new ATOM 0 HB2 TYR A 253 9.696 3.924 109.478 1.00 5.78 H new ATOM 0 HB3 TYR A 253 9.019 2.700 108.787 1.00 5.78 H new ATOM 0 HD1 TYR A 253 6.664 4.823 108.071 1.00 4.93 H new ATOM 0 HD2 TYR A 253 10.545 4.338 107.155 1.00 5.05 H new ATOM 0 HE1 TYR A 253 6.363 6.049 106.100 1.00 4.81 H new ATOM 0 HE2 TYR A 253 10.254 5.546 105.212 1.00 4.82 H new ATOM 0 HH TYR A 253 7.373 6.982 104.294 1.00 5.33 H new ATOM 1965 N ASN A 254 7.937 1.281 110.869 1.00 7.58 N ATOM 1966 CA ASN A 254 8.472 0.206 111.693 1.00 6.99 C ATOM 1967 C ASN A 254 9.966 0.103 111.316 1.00 6.59 C ATOM 1968 O ASN A 254 10.394 0.541 110.230 1.00 6.74 O ATOM 1969 CB ASN A 254 7.716 -1.128 111.481 1.00 7.18 C ATOM 1970 CG ASN A 254 7.797 -1.666 110.056 1.00 6.13 C ATOM 1971 OD1 ASN A 254 8.851 -2.121 109.603 1.00 7.33 O ATOM 1972 ND2 ASN A 254 6.672 -1.630 109.348 1.00 7.20 N ATOM 0 H ASN A 254 7.416 1.034 110.231 1.00 7.58 H new ATOM 0 HA ASN A 254 8.361 0.396 112.638 1.00 6.99 H new ATOM 0 HB2 ASN A 254 8.075 -1.793 112.089 1.00 7.18 H new ATOM 0 HB3 ASN A 254 6.784 -1.002 111.717 1.00 7.18 H new ATOM 0 HD21 ASN A 254 6.661 -1.931 108.542 1.00 7.20 H new ATOM 0 HD22 ASN A 254 5.955 -1.306 109.696 1.00 7.20 H new ATOM 1973 N GLY A 255 10.765 -0.445 112.225 1.00 6.03 N ATOM 1974 CA GLY A 255 12.197 -0.534 112.012 1.00 7.00 C ATOM 1975 C GLY A 255 12.685 -1.467 110.926 1.00 6.03 C ATOM 1976 O GLY A 255 13.732 -1.218 110.326 1.00 7.09 O ATOM 0 H GLY A 255 10.493 -0.771 112.973 1.00 6.03 H new ATOM 0 HA2 GLY A 255 12.526 0.356 111.812 1.00 7.00 H new ATOM 0 HA3 GLY A 255 12.608 -0.807 112.848 1.00 7.00 H new ATOM 1977 N ALA A 256 11.952 -2.551 110.680 1.00 5.50 N ATOM 1978 CA ALA A 256 12.349 -3.521 109.658 1.00 6.15 C ATOM 1979 C ALA A 256 12.261 -2.910 108.257 1.00 5.89 C ATOM 1980 O ALA A 256 13.199 -3.030 107.461 1.00 6.57 O ATOM 1981 CB ALA A 256 11.478 -4.762 109.757 1.00 7.38 C ATOM 0 H ALA A 256 11.222 -2.744 111.092 1.00 5.50 H new ATOM 0 HA ALA A 256 13.273 -3.772 109.814 1.00 6.15 H new ATOM 0 HB1 ALA A 256 11.746 -5.401 109.078 1.00 7.38 H new ATOM 0 HB2 ALA A 256 11.582 -5.162 110.635 1.00 7.38 H new ATOM 0 HB3 ALA A 256 10.549 -4.517 109.622 1.00 7.38 H new ATOM 1982 N TYR A 257 11.139 -2.259 107.951 1.00 5.86 N ATOM 1983 CA TYR A 257 11.014 -1.601 106.651 1.00 5.44 C ATOM 1984 C TYR A 257 12.081 -0.500 106.543 1.00 5.32 C ATOM 1985 O TYR A 257 12.720 -0.345 105.503 1.00 5.54 O ATOM 1986 CB TYR A 257 9.626 -0.975 106.467 1.00 5.89 C ATOM 1987 CG TYR A 257 9.552 -0.079 105.239 1.00 5.59 C ATOM 1988 CD1 TYR A 257 9.580 -0.621 103.948 1.00 6.37 C ATOM 1989 CD2 TYR A 257 9.518 1.311 105.365 1.00 5.68 C ATOM 1990 CE1 TYR A 257 9.580 0.205 102.823 1.00 6.11 C ATOM 1991 CE2 TYR A 257 9.522 2.144 104.241 1.00 5.47 C ATOM 1992 CZ TYR A 257 9.553 1.582 102.981 1.00 5.24 C ATOM 1993 OH TYR A 257 9.565 2.397 101.865 1.00 6.49 O ATOM 0 H TYR A 257 10.455 -2.187 108.467 1.00 5.86 H new ATOM 0 HA TYR A 257 11.138 -2.269 105.959 1.00 5.44 H new ATOM 0 HB2 TYR A 257 8.964 -1.680 106.391 1.00 5.89 H new ATOM 0 HB3 TYR A 257 9.400 -0.458 107.256 1.00 5.89 H new ATOM 0 HD1 TYR A 257 9.599 -1.544 103.839 1.00 6.37 H new ATOM 0 HD2 TYR A 257 9.492 1.691 106.213 1.00 5.68 H new ATOM 0 HE1 TYR A 257 9.598 -0.167 101.971 1.00 6.11 H new ATOM 0 HE2 TYR A 257 9.504 3.068 104.342 1.00 5.47 H new ATOM 0 HH TYR A 257 9.516 1.925 101.172 1.00 6.49 H new ATOM 1994 N THR A 258 12.282 0.272 107.610 1.00 5.94 N ATOM 1995 CA THR A 258 13.284 1.340 107.553 1.00 5.37 C ATOM 1996 C THR A 258 14.679 0.789 107.233 1.00 6.03 C ATOM 1997 O THR A 258 15.426 1.382 106.454 1.00 6.41 O ATOM 1998 CB THR A 258 13.318 2.148 108.877 1.00 5.75 C ATOM 1999 OG1 THR A 258 12.014 2.696 109.130 1.00 7.18 O ATOM 2000 CG2 THR A 258 14.329 3.294 108.797 1.00 8.04 C ATOM 0 H THR A 258 11.863 0.199 108.357 1.00 5.94 H new ATOM 0 HA THR A 258 13.023 1.937 106.834 1.00 5.37 H new ATOM 0 HB THR A 258 13.582 1.550 109.593 1.00 5.75 H new ATOM 0 HG1 THR A 258 11.520 2.103 109.461 1.00 7.18 H new ATOM 0 HG21 THR A 258 14.331 3.783 109.635 1.00 8.04 H new ATOM 0 HG22 THR A 258 15.214 2.934 108.631 1.00 8.04 H new ATOM 0 HG23 THR A 258 14.083 3.893 108.075 1.00 8.04 H new ATOM 2001 N SER A 259 15.044 -0.337 107.837 1.00 6.16 N ATOM 2002 CA SER A 259 16.350 -0.927 107.564 1.00 7.00 C ATOM 2003 C SER A 259 16.466 -1.328 106.087 1.00 5.83 C ATOM 2004 O SER A 259 17.487 -1.070 105.436 1.00 6.88 O ATOM 2005 CB SER A 259 16.562 -2.147 108.457 1.00 8.48 C ATOM 2006 OG SER A 259 17.870 -2.663 108.287 1.00 11.61 O ATOM 0 H SER A 259 14.559 -0.770 108.400 1.00 6.16 H new ATOM 0 HA SER A 259 17.035 -0.267 107.755 1.00 7.00 H new ATOM 0 HB2 SER A 259 16.422 -1.903 109.385 1.00 8.48 H new ATOM 0 HB3 SER A 259 15.908 -2.830 108.242 1.00 8.48 H new ATOM 0 HG SER A 259 17.974 -3.332 108.784 1.00 11.61 H new ATOM 2007 N ARG A 260 15.416 -1.943 105.547 1.00 5.62 N ATOM 2008 CA ARG A 260 15.430 -2.352 104.145 1.00 5.99 C ATOM 2009 C ARG A 260 15.581 -1.099 103.273 1.00 5.86 C ATOM 2010 O ARG A 260 16.425 -1.047 102.368 1.00 5.95 O ATOM 2011 CB ARG A 260 14.128 -3.101 103.808 1.00 5.81 C ATOM 2012 CG ARG A 260 14.157 -3.877 102.478 1.00 6.21 C ATOM 2013 CD ARG A 260 14.054 -2.962 101.267 1.00 6.29 C ATOM 2014 NE ARG A 260 12.681 -2.523 101.028 1.00 7.41 N ATOM 2015 CZ ARG A 260 12.329 -1.493 100.262 1.00 7.14 C ATOM 2016 NH1 ARG A 260 13.246 -0.744 99.663 1.00 7.26 N ATOM 2017 NH2 ARG A 260 11.039 -1.262 100.042 1.00 7.75 N ATOM 0 H ARG A 260 14.692 -2.131 105.971 1.00 5.62 H new ATOM 0 HA ARG A 260 16.174 -2.951 103.975 1.00 5.99 H new ATOM 0 HB2 ARG A 260 13.932 -3.722 104.527 1.00 5.81 H new ATOM 0 HB3 ARG A 260 13.400 -2.461 103.779 1.00 5.81 H new ATOM 0 HG2 ARG A 260 14.979 -4.389 102.424 1.00 6.21 H new ATOM 0 HG3 ARG A 260 13.425 -4.513 102.462 1.00 6.21 H new ATOM 0 HD2 ARG A 260 14.622 -2.187 101.399 1.00 6.29 H new ATOM 0 HD3 ARG A 260 14.385 -3.426 100.483 1.00 6.29 H new ATOM 0 HE ARG A 260 12.051 -2.965 101.412 1.00 7.41 H new ATOM 0 HH11 ARG A 260 14.081 -0.921 99.767 1.00 7.26 H new ATOM 0 HH12 ARG A 260 13.005 -0.081 99.171 1.00 7.26 H new ATOM 0 HH21 ARG A 260 10.444 -1.775 100.393 1.00 7.75 H new ATOM 0 HH22 ARG A 260 10.799 -0.600 99.549 1.00 7.75 H new ATOM 2018 N LEU A 261 14.772 -0.085 103.565 1.00 5.53 N ATOM 2019 CA LEU A 261 14.796 1.171 102.827 1.00 5.84 C ATOM 2020 C LEU A 261 16.164 1.865 102.837 1.00 5.24 C ATOM 2021 O LEU A 261 16.601 2.398 101.809 1.00 5.86 O ATOM 2022 CB LEU A 261 13.737 2.118 103.410 1.00 5.73 C ATOM 2023 CG LEU A 261 13.647 3.530 102.823 1.00 5.56 C ATOM 2024 CD1 LEU A 261 13.164 3.451 101.374 1.00 8.15 C ATOM 2025 CD2 LEU A 261 12.693 4.382 103.657 1.00 7.67 C ATOM 0 H LEU A 261 14.192 -0.107 104.199 1.00 5.53 H new ATOM 0 HA LEU A 261 14.603 0.956 101.901 1.00 5.84 H new ATOM 0 HB2 LEU A 261 12.870 1.696 103.307 1.00 5.73 H new ATOM 0 HB3 LEU A 261 13.902 2.200 104.362 1.00 5.73 H new ATOM 0 HG LEU A 261 14.524 3.943 102.841 1.00 5.56 H new ATOM 0 HD11 LEU A 261 13.107 4.345 101.002 1.00 8.15 H new ATOM 0 HD12 LEU A 261 13.789 2.924 100.853 1.00 8.15 H new ATOM 0 HD13 LEU A 261 12.289 3.034 101.347 1.00 8.15 H new ATOM 0 HD21 LEU A 261 12.641 5.274 103.279 1.00 7.67 H new ATOM 0 HD22 LEU A 261 11.811 3.978 103.653 1.00 7.67 H new ATOM 0 HD23 LEU A 261 13.020 4.436 104.569 1.00 7.67 H new ATOM 2026 N PHE A 262 16.835 1.867 103.989 1.00 5.51 N ATOM 2027 CA PHE A 262 18.121 2.560 104.104 1.00 5.75 C ATOM 2028 C PHE A 262 19.167 2.104 103.091 1.00 6.23 C ATOM 2029 O PHE A 262 19.979 2.920 102.640 1.00 6.78 O ATOM 2030 CB PHE A 262 18.664 2.470 105.546 1.00 6.47 C ATOM 2031 CG PHE A 262 18.397 3.709 106.382 1.00 6.97 C ATOM 2032 CD1 PHE A 262 19.442 4.331 107.060 1.00 8.52 C ATOM 2033 CD2 PHE A 262 17.119 4.257 106.479 1.00 7.65 C ATOM 2034 CE1 PHE A 262 19.220 5.486 107.821 1.00 9.87 C ATOM 2035 CE2 PHE A 262 16.889 5.411 107.238 1.00 7.85 C ATOM 2036 CZ PHE A 262 17.948 6.024 107.908 1.00 8.83 C ATOM 0 H PHE A 262 16.568 1.478 104.708 1.00 5.51 H new ATOM 0 HA PHE A 262 17.942 3.489 103.889 1.00 5.75 H new ATOM 0 HB2 PHE A 262 18.265 1.702 105.985 1.00 6.47 H new ATOM 0 HB3 PHE A 262 19.621 2.313 105.513 1.00 6.47 H new ATOM 0 HD1 PHE A 262 20.299 3.975 107.007 1.00 8.52 H new ATOM 0 HD2 PHE A 262 16.410 3.851 106.034 1.00 7.65 H new ATOM 0 HE1 PHE A 262 19.928 5.891 108.268 1.00 9.87 H new ATOM 0 HE2 PHE A 262 16.032 5.768 107.295 1.00 7.85 H new ATOM 0 HZ PHE A 262 17.800 6.792 108.411 1.00 8.83 H new ATOM 2037 N ARG A 263 19.151 0.827 102.714 1.00 6.53 N ATOM 2038 CA ARG A 263 20.113 0.346 101.712 1.00 7.20 C ATOM 2039 C ARG A 263 19.903 1.132 100.405 1.00 6.72 C ATOM 2040 O ARG A 263 20.857 1.604 99.784 1.00 7.43 O ATOM 2041 CB ARG A 263 19.920 -1.158 101.463 1.00 8.47 C ATOM 2042 CG ARG A 263 20.778 -1.716 100.320 1.00 10.61 C ATOM 2043 CD ARG A 263 20.629 -3.237 100.192 1.00 11.29 C ATOM 2044 NE ARG A 263 21.435 -3.772 99.093 1.00 14.84 N ATOM 2045 CZ ARG A 263 20.978 -4.000 97.866 1.00 14.23 C ATOM 2046 NH1 ARG A 263 21.796 -4.481 96.936 1.00 17.75 N ATOM 2047 NH2 ARG A 263 19.708 -3.773 97.562 1.00 12.34 N ATOM 0 H ARG A 263 18.607 0.233 103.015 1.00 6.53 H new ATOM 0 HA ARG A 263 21.016 0.485 102.037 1.00 7.20 H new ATOM 0 HB2 ARG A 263 20.129 -1.641 102.278 1.00 8.47 H new ATOM 0 HB3 ARG A 263 18.985 -1.327 101.266 1.00 8.47 H new ATOM 0 HG2 ARG A 263 20.521 -1.294 99.486 1.00 10.61 H new ATOM 0 HG3 ARG A 263 21.709 -1.493 100.475 1.00 10.61 H new ATOM 0 HD2 ARG A 263 20.895 -3.659 101.024 1.00 11.29 H new ATOM 0 HD3 ARG A 263 19.696 -3.460 100.047 1.00 11.29 H new ATOM 0 HE ARG A 263 22.261 -3.951 99.252 1.00 14.84 H new ATOM 0 HH11 ARG A 263 22.618 -4.644 97.129 1.00 17.75 H new ATOM 0 HH12 ARG A 263 21.503 -4.630 96.141 1.00 17.75 H new ATOM 0 HH21 ARG A 263 19.169 -3.475 98.162 1.00 12.34 H new ATOM 0 HH22 ARG A 263 19.423 -3.924 96.765 1.00 12.34 H new ATOM 2048 N LEU A 264 18.649 1.259 99.988 1.00 6.58 N ATOM 2049 CA LEU A 264 18.312 2.014 98.782 1.00 6.04 C ATOM 2050 C LEU A 264 18.640 3.504 98.946 1.00 6.58 C ATOM 2051 O LEU A 264 19.161 4.137 98.022 1.00 6.98 O ATOM 2052 CB LEU A 264 16.824 1.862 98.455 1.00 6.21 C ATOM 2053 CG LEU A 264 16.241 2.893 97.472 1.00 6.12 C ATOM 2054 CD1 LEU A 264 16.894 2.764 96.087 1.00 7.92 C ATOM 2055 CD2 LEU A 264 14.730 2.678 97.370 1.00 7.97 C ATOM 0 H LEU A 264 17.972 0.914 100.391 1.00 6.58 H new ATOM 0 HA LEU A 264 18.845 1.655 98.056 1.00 6.04 H new ATOM 0 HB2 LEU A 264 16.680 0.975 98.089 1.00 6.21 H new ATOM 0 HB3 LEU A 264 16.322 1.912 99.284 1.00 6.21 H new ATOM 0 HG LEU A 264 16.425 3.787 97.801 1.00 6.12 H new ATOM 0 HD11 LEU A 264 16.511 3.422 95.486 1.00 7.92 H new ATOM 0 HD12 LEU A 264 17.849 2.914 96.164 1.00 7.92 H new ATOM 0 HD13 LEU A 264 16.734 1.874 95.735 1.00 7.92 H new ATOM 0 HD21 LEU A 264 14.352 3.323 96.752 1.00 7.97 H new ATOM 0 HD22 LEU A 264 14.552 1.780 97.048 1.00 7.97 H new ATOM 0 HD23 LEU A 264 14.327 2.794 98.245 1.00 7.97 H new ATOM 2056 N LEU A 265 18.350 4.078 100.114 1.00 6.16 N ATOM 2057 CA LEU A 265 18.633 5.501 100.290 1.00 7.25 C ATOM 2058 C LEU A 265 20.123 5.756 100.088 1.00 7.91 C ATOM 2059 O LEU A 265 20.502 6.690 99.381 1.00 9.22 O ATOM 2060 CB LEU A 265 18.185 5.986 101.677 1.00 7.53 C ATOM 2061 CG LEU A 265 16.701 5.772 102.009 1.00 6.73 C ATOM 2062 CD1 LEU A 265 16.367 6.488 103.308 1.00 7.91 C ATOM 2063 CD2 LEU A 265 15.816 6.277 100.861 1.00 7.78 C ATOM 0 H LEU A 265 18.003 3.679 100.792 1.00 6.16 H new ATOM 0 HA LEU A 265 18.132 6.001 99.627 1.00 7.25 H new ATOM 0 HB2 LEU A 265 18.718 5.532 102.348 1.00 7.53 H new ATOM 0 HB3 LEU A 265 18.383 6.933 101.750 1.00 7.53 H new ATOM 0 HG LEU A 265 16.529 4.824 102.120 1.00 6.73 H new ATOM 0 HD11 LEU A 265 15.430 6.354 103.520 1.00 7.91 H new ATOM 0 HD12 LEU A 265 16.914 6.131 104.025 1.00 7.91 H new ATOM 0 HD13 LEU A 265 16.543 7.437 103.209 1.00 7.91 H new ATOM 0 HD21 LEU A 265 14.883 6.135 101.085 1.00 7.78 H new ATOM 0 HD22 LEU A 265 15.975 7.224 100.722 1.00 7.78 H new ATOM 0 HD23 LEU A 265 16.030 5.791 100.049 1.00 7.78 H new ATOM 2064 N LYS A 266 20.965 4.920 100.686 1.00 7.79 N ATOM 2065 CA LYS A 266 22.408 5.089 100.536 1.00 10.06 C ATOM 2066 C LYS A 266 22.855 4.868 99.088 1.00 10.50 C ATOM 2067 O LYS A 266 23.597 5.687 98.536 1.00 11.73 O ATOM 2068 CB LYS A 266 23.156 4.132 101.467 1.00 12.95 C ATOM 2069 CG LYS A 266 24.675 4.278 101.420 1.00 17.83 C ATOM 2070 CD LYS A 266 25.122 5.703 101.715 1.00 21.17 C ATOM 2071 CE LYS A 266 26.638 5.832 101.611 1.00 24.15 C ATOM 2072 NZ LYS A 266 27.099 7.248 101.696 1.00 26.61 N ATOM 0 H LYS A 266 20.726 4.256 101.177 1.00 7.79 H new ATOM 0 HA LYS A 266 22.622 6.004 100.778 1.00 10.06 H new ATOM 0 HB2 LYS A 266 22.854 4.280 102.377 1.00 12.95 H new ATOM 0 HB3 LYS A 266 22.921 3.220 101.235 1.00 12.95 H new ATOM 0 HG2 LYS A 266 25.077 3.674 102.064 1.00 17.83 H new ATOM 0 HG3 LYS A 266 24.997 4.014 100.544 1.00 17.83 H new ATOM 0 HD2 LYS A 266 24.698 6.314 101.092 1.00 21.17 H new ATOM 0 HD3 LYS A 266 24.832 5.959 102.605 1.00 21.17 H new ATOM 0 HE2 LYS A 266 27.053 5.317 102.321 1.00 24.15 H new ATOM 0 HE3 LYS A 266 26.935 5.448 100.771 1.00 24.15 H new ATOM 0 HZ1 LYS A 266 27.967 7.267 101.893 1.00 26.61 H new ATOM 0 HZ2 LYS A 266 26.964 7.652 100.915 1.00 26.61 H new ATOM 0 HZ3 LYS A 266 26.642 7.672 102.332 1.00 26.61 H new ATOM 2073 N MET A 267 22.397 3.784 98.463 1.00 8.24 N ATOM 2074 CA MET A 267 22.781 3.486 97.078 1.00 8.29 C ATOM 2075 C MET A 267 22.349 4.586 96.099 1.00 8.66 C ATOM 2076 O MET A 267 23.062 4.899 95.137 1.00 9.11 O ATOM 2077 CB MET A 267 22.158 2.155 96.626 1.00 9.31 C ATOM 2078 CG MET A 267 22.752 0.910 97.277 1.00 10.79 C ATOM 2079 SD MET A 267 21.850 -0.607 96.859 1.00 13.42 S ATOM 2080 CE MET A 267 22.328 -0.836 95.148 1.00 14.58 C ATOM 0 H MET A 267 21.865 3.209 98.819 1.00 8.24 H new ATOM 0 HA MET A 267 23.749 3.431 97.066 1.00 8.29 H new ATOM 0 HB2 MET A 267 21.207 2.179 96.814 1.00 9.31 H new ATOM 0 HB3 MET A 267 22.256 2.078 95.664 1.00 9.31 H new ATOM 0 HG2 MET A 267 23.677 0.817 97.001 1.00 10.79 H new ATOM 0 HG3 MET A 267 22.754 1.024 98.240 1.00 10.79 H new ATOM 0 HE1 MET A 267 21.954 -1.667 94.816 1.00 14.58 H new ATOM 0 HE2 MET A 267 21.994 -0.096 94.617 1.00 14.58 H new ATOM 0 HE3 MET A 267 23.295 -0.869 95.084 1.00 14.58 H new ATOM 2081 N SER A 268 21.179 5.172 96.337 1.00 7.64 N ATOM 2082 CA SER A 268 20.645 6.200 95.442 1.00 7.57 C ATOM 2083 C SER A 268 21.411 7.512 95.452 1.00 7.72 C ATOM 2084 O SER A 268 21.408 8.238 94.456 1.00 8.45 O ATOM 2085 CB SER A 268 19.177 6.496 95.783 1.00 7.83 C ATOM 2086 OG SER A 268 19.072 7.296 96.955 1.00 8.06 O ATOM 0 H SER A 268 20.677 4.990 97.011 1.00 7.64 H new ATOM 0 HA SER A 268 20.737 5.825 94.552 1.00 7.57 H new ATOM 0 HB2 SER A 268 18.755 6.952 95.038 1.00 7.83 H new ATOM 0 HB3 SER A 268 18.698 5.663 95.913 1.00 7.83 H new ATOM 0 HG SER A 268 19.565 6.978 97.556 1.00 8.06 H new ATOM 2087 N GLY A 269 22.037 7.824 96.581 1.00 7.50 N ATOM 2088 CA GLY A 269 22.774 9.065 96.699 1.00 7.07 C ATOM 2089 C GLY A 269 21.912 10.318 96.811 1.00 7.15 C ATOM 2090 O GLY A 269 22.452 11.417 96.689 1.00 7.53 O ATOM 0 H GLY A 269 22.045 7.330 97.285 1.00 7.50 H new ATOM 0 HA2 GLY A 269 23.347 9.012 97.480 1.00 7.07 H new ATOM 0 HA3 GLY A 269 23.354 9.156 95.927 1.00 7.07 H new ATOM 2091 N ILE A 270 20.602 10.191 97.054 1.00 6.39 N ATOM 2092 CA ILE A 270 19.774 11.396 97.154 1.00 6.20 C ATOM 2093 C ILE A 270 19.989 12.117 98.482 1.00 5.59 C ATOM 2094 O ILE A 270 20.550 11.555 99.432 1.00 7.01 O ATOM 2095 CB ILE A 270 18.244 11.113 96.936 1.00 6.31 C ATOM 2096 CG1 ILE A 270 17.634 10.368 98.133 1.00 6.18 C ATOM 2097 CG2 ILE A 270 18.039 10.344 95.625 1.00 6.33 C ATOM 2098 CD1 ILE A 270 16.104 10.296 98.067 1.00 6.81 C ATOM 0 H ILE A 270 20.187 9.445 97.160 1.00 6.39 H new ATOM 0 HA ILE A 270 20.066 11.974 96.431 1.00 6.20 H new ATOM 0 HB ILE A 270 17.778 11.961 96.870 1.00 6.31 H new ATOM 0 HG12 ILE A 270 17.995 9.468 98.168 1.00 6.18 H new ATOM 0 HG13 ILE A 270 17.898 10.812 98.954 1.00 6.18 H new ATOM 0 HG21 ILE A 270 17.093 10.172 95.495 1.00 6.33 H new ATOM 0 HG22 ILE A 270 18.376 10.872 94.884 1.00 6.33 H new ATOM 0 HG23 ILE A 270 18.518 9.501 95.666 1.00 6.33 H new ATOM 0 HD11 ILE A 270 15.769 9.818 98.842 1.00 6.81 H new ATOM 0 HD12 ILE A 270 15.738 11.194 98.058 1.00 6.81 H new ATOM 0 HD13 ILE A 270 15.836 9.830 97.259 1.00 6.81 H new ATOM 2099 N ASN A 271 19.569 13.378 98.519 1.00 5.46 N ATOM 2100 CA ASN A 271 19.707 14.236 99.692 1.00 5.53 C ATOM 2101 C ASN A 271 18.412 14.323 100.487 1.00 4.57 C ATOM 2102 O ASN A 271 17.327 14.157 99.934 1.00 5.76 O ATOM 2103 CB ASN A 271 20.098 15.648 99.244 1.00 5.52 C ATOM 2104 CG ASN A 271 21.345 15.657 98.418 1.00 6.69 C ATOM 2105 OD1 ASN A 271 22.436 15.475 98.939 1.00 7.58 O ATOM 2106 ND2 ASN A 271 21.194 15.845 97.110 1.00 9.28 N ATOM 0 H ASN A 271 19.189 13.766 97.852 1.00 5.46 H new ATOM 0 HA ASN A 271 20.391 13.849 100.260 1.00 5.53 H new ATOM 0 HB2 ASN A 271 19.371 16.036 98.732 1.00 5.52 H new ATOM 0 HB3 ASN A 271 20.226 16.209 100.025 1.00 5.52 H new ATOM 0 HD21 ASN A 271 21.881 15.842 96.593 1.00 9.28 H new ATOM 0 HD22 ASN A 271 20.409 15.970 96.781 1.00 9.28 H new ATOM 2107 N PHE A 272 18.540 14.626 101.780 1.00 4.92 N ATOM 2108 CA PHE A 272 17.396 14.772 102.675 1.00 4.80 C ATOM 2109 C PHE A 272 17.442 16.087 103.428 1.00 4.94 C ATOM 2110 O PHE A 272 18.501 16.506 103.913 1.00 5.71 O ATOM 2111 CB PHE A 272 17.378 13.623 103.695 1.00 5.17 C ATOM 2112 CG PHE A 272 17.122 12.290 103.073 1.00 5.46 C ATOM 2113 CD1 PHE A 272 15.830 11.799 102.972 1.00 7.50 C ATOM 2114 CD2 PHE A 272 18.164 11.570 102.494 1.00 6.31 C ATOM 2115 CE1 PHE A 272 15.574 10.600 102.288 1.00 8.53 C ATOM 2116 CE2 PHE A 272 17.917 10.374 101.807 1.00 7.61 C ATOM 2117 CZ PHE A 272 16.620 9.895 101.707 1.00 8.79 C ATOM 0 H PHE A 272 19.300 14.753 102.163 1.00 4.92 H new ATOM 0 HA PHE A 272 16.595 14.752 102.128 1.00 4.80 H new ATOM 0 HB2 PHE A 272 18.228 13.598 104.161 1.00 5.17 H new ATOM 0 HB3 PHE A 272 16.695 13.800 104.361 1.00 5.17 H new ATOM 0 HD1 PHE A 272 15.127 12.268 103.360 1.00 7.50 H new ATOM 0 HD2 PHE A 272 19.035 11.887 102.564 1.00 6.31 H new ATOM 0 HE1 PHE A 272 14.704 10.278 102.224 1.00 8.53 H new ATOM 0 HE2 PHE A 272 18.620 9.904 101.420 1.00 7.61 H new ATOM 0 HZ PHE A 272 16.450 9.102 101.251 1.00 8.79 H new ATOM 2118 N VAL A 273 16.289 16.735 103.520 1.00 4.87 N ATOM 2119 CA VAL A 273 16.163 17.962 104.289 1.00 5.15 C ATOM 2120 C VAL A 273 15.157 17.733 105.416 1.00 5.11 C ATOM 2121 O VAL A 273 14.047 17.242 105.180 1.00 5.22 O ATOM 2122 CB VAL A 273 15.640 19.156 103.445 1.00 4.87 C ATOM 2123 CG1 VAL A 273 15.465 20.388 104.334 1.00 7.19 C ATOM 2124 CG2 VAL A 273 16.609 19.474 102.312 1.00 6.47 C ATOM 0 H VAL A 273 15.562 16.477 103.140 1.00 4.87 H new ATOM 0 HA VAL A 273 17.049 18.182 104.616 1.00 5.15 H new ATOM 0 HB VAL A 273 14.782 18.911 103.064 1.00 4.87 H new ATOM 0 HG11 VAL A 273 15.138 21.129 103.800 1.00 7.19 H new ATOM 0 HG12 VAL A 273 14.827 20.191 105.038 1.00 7.19 H new ATOM 0 HG13 VAL A 273 16.318 20.626 104.729 1.00 7.19 H new ATOM 0 HG21 VAL A 273 16.269 20.221 101.795 1.00 6.47 H new ATOM 0 HG22 VAL A 273 17.475 19.706 102.682 1.00 6.47 H new ATOM 0 HG23 VAL A 273 16.701 18.698 101.737 1.00 6.47 H new ATOM 2125 N ALA A 274 15.564 18.069 106.638 1.00 4.69 N ATOM 2126 CA ALA A 274 14.676 18.027 107.806 1.00 4.97 C ATOM 2127 C ALA A 274 14.451 19.506 108.155 1.00 4.71 C ATOM 2128 O ALA A 274 15.357 20.317 107.994 1.00 5.63 O ATOM 2129 CB ALA A 274 15.341 17.302 108.969 1.00 5.34 C ATOM 0 H ALA A 274 16.364 18.329 106.817 1.00 4.69 H new ATOM 0 HA ALA A 274 13.850 17.551 107.626 1.00 4.97 H new ATOM 0 HB1 ALA A 274 14.738 17.286 109.728 1.00 5.34 H new ATOM 0 HB2 ALA A 274 15.552 16.393 108.705 1.00 5.34 H new ATOM 0 HB3 ALA A 274 16.157 17.765 109.215 1.00 5.34 H new ATOM 2130 N ASN A 275 13.259 19.861 108.626 1.00 4.88 N ATOM 2131 CA ASN A 275 12.928 21.264 108.950 1.00 5.03 C ATOM 2132 C ASN A 275 12.451 21.273 110.388 1.00 4.56 C ATOM 2133 O ASN A 275 11.256 21.385 110.667 1.00 5.14 O ATOM 2134 CB ASN A 275 11.847 21.731 107.974 1.00 5.96 C ATOM 2135 CG ASN A 275 12.366 21.760 106.550 1.00 6.66 C ATOM 2136 OD1 ASN A 275 11.815 20.911 105.683 1.00 8.07 O flip ATOM 2137 ND2 ASN A 275 13.287 22.504 106.247 1.00 11.49 N flip ATOM 0 H ASN A 275 12.618 19.306 108.769 1.00 4.88 H new ATOM 0 HA ASN A 275 13.682 21.868 108.863 1.00 5.03 H new ATOM 0 HB2 ASN A 275 11.081 21.139 108.029 1.00 5.96 H new ATOM 0 HB3 ASN A 275 11.540 22.616 108.227 1.00 5.96 H new ATOM 0 HD21 ASN A 275 13.618 23.039 106.833 1.00 11.49 H new ATOM 0 HD22 ASN A 275 13.604 22.492 105.448 1.00 11.49 H new ATOM 2138 N PRO A 276 13.405 21.215 111.336 1.00 5.07 N ATOM 2139 CA PRO A 276 13.092 21.164 112.769 1.00 5.45 C ATOM 2140 C PRO A 276 12.077 22.086 113.409 1.00 4.62 C ATOM 2141 O PRO A 276 11.240 21.621 114.186 1.00 4.70 O ATOM 2142 CB PRO A 276 14.465 21.288 113.442 1.00 7.07 C ATOM 2143 CG PRO A 276 15.437 20.832 112.410 1.00 9.05 C ATOM 2144 CD PRO A 276 14.860 21.348 111.112 1.00 5.53 C ATOM 0 HA PRO A 276 12.595 20.341 112.899 1.00 5.45 H new ATOM 0 HB2 PRO A 276 14.643 22.202 113.713 1.00 7.07 H new ATOM 0 HB3 PRO A 276 14.516 20.740 114.241 1.00 7.07 H new ATOM 0 HG2 PRO A 276 16.323 21.192 112.573 1.00 9.05 H new ATOM 0 HG3 PRO A 276 15.520 19.866 112.403 1.00 9.05 H new ATOM 0 HD2 PRO A 276 15.117 22.268 110.943 1.00 5.53 H new ATOM 0 HD3 PRO A 276 15.158 20.825 110.351 1.00 5.53 H new ATOM 2145 N LEU A 277 12.152 23.384 113.123 1.00 5.05 N ATOM 2146 CA LEU A 277 11.223 24.332 113.735 1.00 5.24 C ATOM 2147 C LEU A 277 9.787 24.084 113.304 1.00 4.95 C ATOM 2148 O LEU A 277 8.867 24.147 114.134 1.00 5.84 O ATOM 2149 CB LEU A 277 11.618 25.774 113.392 1.00 5.92 C ATOM 2150 CG LEU A 277 13.001 26.236 113.857 1.00 5.35 C ATOM 2151 CD1 LEU A 277 13.242 27.621 113.284 1.00 6.72 C ATOM 2152 CD2 LEU A 277 13.106 26.255 115.390 1.00 7.23 C ATOM 0 H LEU A 277 12.725 23.733 112.585 1.00 5.05 H new ATOM 0 HA LEU A 277 11.277 24.199 114.694 1.00 5.24 H new ATOM 0 HB2 LEU A 277 11.571 25.880 112.429 1.00 5.92 H new ATOM 0 HB3 LEU A 277 10.955 26.369 113.776 1.00 5.92 H new ATOM 0 HG LEU A 277 13.676 25.615 113.541 1.00 5.35 H new ATOM 0 HD11 LEU A 277 14.114 27.940 113.564 1.00 6.72 H new ATOM 0 HD12 LEU A 277 13.208 27.581 112.315 1.00 6.72 H new ATOM 0 HD13 LEU A 277 12.558 28.228 113.606 1.00 6.72 H new ATOM 0 HD21 LEU A 277 13.992 26.551 115.650 1.00 7.23 H new ATOM 0 HD22 LEU A 277 12.443 26.863 115.752 1.00 7.23 H new ATOM 0 HD23 LEU A 277 12.949 25.363 115.736 1.00 7.23 H new ATOM 2153 N VAL A 278 9.595 23.800 112.017 1.00 5.21 N ATOM 2154 CA VAL A 278 8.253 23.555 111.503 1.00 6.03 C ATOM 2155 C VAL A 278 7.789 22.129 111.813 1.00 4.89 C ATOM 2156 O VAL A 278 6.633 21.923 112.202 1.00 5.49 O ATOM 2157 CB VAL A 278 8.190 23.847 109.980 1.00 6.23 C ATOM 2158 CG1 VAL A 278 6.870 23.358 109.385 1.00 8.85 C ATOM 2159 CG2 VAL A 278 8.299 25.363 109.754 1.00 9.80 C ATOM 0 H VAL A 278 10.223 23.745 111.432 1.00 5.21 H new ATOM 0 HA VAL A 278 7.644 24.162 111.953 1.00 6.03 H new ATOM 0 HB VAL A 278 8.922 23.381 109.547 1.00 6.23 H new ATOM 0 HG11 VAL A 278 6.852 23.550 108.434 1.00 8.85 H new ATOM 0 HG12 VAL A 278 6.788 22.401 109.522 1.00 8.85 H new ATOM 0 HG13 VAL A 278 6.131 23.812 109.820 1.00 8.85 H new ATOM 0 HG21 VAL A 278 8.260 25.552 108.803 1.00 9.80 H new ATOM 0 HG22 VAL A 278 7.565 25.811 110.203 1.00 9.80 H new ATOM 0 HG23 VAL A 278 9.141 25.684 110.113 1.00 9.80 H new ATOM 2160 N ASN A 279 8.678 21.150 111.684 1.00 4.82 N ATOM 2161 CA ASN A 279 8.271 19.773 111.947 1.00 4.61 C ATOM 2162 C ASN A 279 7.804 19.549 113.389 1.00 5.19 C ATOM 2163 O ASN A 279 6.812 18.860 113.610 1.00 5.03 O ATOM 2164 CB ASN A 279 9.403 18.777 111.635 1.00 5.08 C ATOM 2165 CG ASN A 279 9.801 18.735 110.152 1.00 4.95 C ATOM 2166 OD1 ASN A 279 11.025 18.325 109.914 1.00 8.12 O flip ATOM 2167 ND2 ASN A 279 9.006 19.033 109.233 1.00 3.91 N flip ATOM 0 H ASN A 279 9.499 21.255 111.452 1.00 4.82 H new ATOM 0 HA ASN A 279 7.519 19.614 111.355 1.00 4.61 H new ATOM 0 HB2 ASN A 279 10.182 19.010 112.164 1.00 5.08 H new ATOM 0 HB3 ASN A 279 9.127 17.889 111.912 1.00 5.08 H new ATOM 0 HD21 ASN A 279 8.210 19.299 109.422 1.00 3.91 H new ATOM 0 HD22 ASN A 279 9.255 18.972 108.412 1.00 3.91 H new ATOM 2168 N ILE A 280 8.496 20.119 114.373 1.00 4.66 N ATOM 2169 CA ILE A 280 8.069 19.899 115.756 1.00 4.91 C ATOM 2170 C ILE A 280 6.697 20.545 116.009 1.00 4.81 C ATOM 2171 O ILE A 280 5.925 20.084 116.852 1.00 5.54 O ATOM 2172 CB ILE A 280 9.150 20.430 116.771 1.00 4.87 C ATOM 2173 CG1 ILE A 280 8.869 19.906 118.186 1.00 5.92 C ATOM 2174 CG2 ILE A 280 9.201 21.952 116.753 1.00 6.00 C ATOM 2175 CD1 ILE A 280 8.990 18.389 118.323 1.00 7.56 C ATOM 0 H ILE A 280 9.189 20.618 114.271 1.00 4.66 H new ATOM 0 HA ILE A 280 7.979 18.944 115.899 1.00 4.91 H new ATOM 0 HB ILE A 280 10.018 20.097 116.495 1.00 4.87 H new ATOM 0 HG12 ILE A 280 9.485 20.327 118.805 1.00 5.92 H new ATOM 0 HG13 ILE A 280 7.975 20.175 118.449 1.00 5.92 H new ATOM 0 HG21 ILE A 280 9.871 22.261 117.383 1.00 6.00 H new ATOM 0 HG22 ILE A 280 9.431 22.258 115.862 1.00 6.00 H new ATOM 0 HG23 ILE A 280 8.334 22.308 117.003 1.00 6.00 H new ATOM 0 HD11 ILE A 280 8.800 18.130 119.238 1.00 7.56 H new ATOM 0 HD12 ILE A 280 8.356 17.959 117.728 1.00 7.56 H new ATOM 0 HD13 ILE A 280 9.890 18.114 118.090 1.00 7.56 H new ATOM 2176 N HIS A 281 6.386 21.583 115.239 1.00 5.63 N ATOM 2177 CA HIS A 281 5.126 22.312 115.363 1.00 6.38 C ATOM 2178 C HIS A 281 3.966 21.628 114.622 1.00 6.48 C ATOM 2179 O HIS A 281 2.903 21.411 115.219 1.00 7.39 O ATOM 2180 CB HIS A 281 5.388 23.765 114.893 1.00 6.94 C ATOM 2181 CG HIS A 281 4.176 24.544 114.481 1.00 7.13 C ATOM 2182 ND1 HIS A 281 3.065 24.713 115.281 1.00 7.46 N ATOM 2183 CD2 HIS A 281 3.952 25.279 113.365 1.00 8.09 C ATOM 2184 CE1 HIS A 281 2.210 25.520 114.674 1.00 7.00 C ATOM 2185 NE2 HIS A 281 2.725 25.876 113.510 1.00 8.15 N ATOM 0 H HIS A 281 6.905 21.887 114.624 1.00 5.63 H new ATOM 0 HA HIS A 281 4.832 22.319 116.287 1.00 6.38 H new ATOM 0 HB2 HIS A 281 5.832 24.244 115.610 1.00 6.94 H new ATOM 0 HB3 HIS A 281 6.005 23.739 114.145 1.00 6.94 H new ATOM 0 HD2 HIS A 281 4.524 25.363 112.636 1.00 8.09 H new ATOM 0 HE1 HIS A 281 1.386 25.791 115.010 1.00 7.00 H new ATOM 0 HE2 HIS A 281 2.352 26.397 112.937 1.00 8.15 H new ATOM 2186 N LEU A 282 4.173 21.231 113.365 1.00 5.90 N ATOM 2187 CA LEU A 282 3.108 20.602 112.563 1.00 7.13 C ATOM 2188 C LEU A 282 2.908 19.107 112.726 1.00 6.70 C ATOM 2189 O LEU A 282 1.829 18.592 112.418 1.00 7.45 O ATOM 2190 CB LEU A 282 3.332 20.838 111.070 1.00 9.08 C ATOM 2191 CG LEU A 282 3.515 22.256 110.551 1.00 10.35 C ATOM 2192 CD1 LEU A 282 3.621 22.211 109.024 1.00 11.79 C ATOM 2193 CD2 LEU A 282 2.356 23.126 111.007 1.00 10.44 C ATOM 0 H LEU A 282 4.923 21.315 112.953 1.00 5.90 H new ATOM 0 HA LEU A 282 2.315 21.037 112.913 1.00 7.13 H new ATOM 0 HB2 LEU A 282 4.117 20.331 110.811 1.00 9.08 H new ATOM 0 HB3 LEU A 282 2.577 20.452 110.599 1.00 9.08 H new ATOM 0 HG LEU A 282 4.329 22.645 110.907 1.00 10.35 H new ATOM 0 HD11 LEU A 282 3.738 23.111 108.681 1.00 11.79 H new ATOM 0 HD12 LEU A 282 4.382 21.666 108.768 1.00 11.79 H new ATOM 0 HD13 LEU A 282 2.810 21.827 108.654 1.00 11.79 H new ATOM 0 HD21 LEU A 282 2.478 24.029 110.673 1.00 10.44 H new ATOM 0 HD22 LEU A 282 1.524 22.764 110.663 1.00 10.44 H new ATOM 0 HD23 LEU A 282 2.325 23.142 111.976 1.00 10.44 H new ATOM 2194 N GLN A 283 3.949 18.393 113.136 1.00 5.74 N ATOM 2195 CA GLN A 283 3.827 16.950 113.305 1.00 5.71 C ATOM 2196 C GLN A 283 3.332 16.642 114.709 1.00 5.98 C ATOM 2197 O GLN A 283 3.441 17.474 115.611 1.00 6.81 O ATOM 2198 CB GLN A 283 5.169 16.255 113.034 1.00 5.65 C ATOM 2199 CG GLN A 283 5.764 16.538 111.636 1.00 7.49 C ATOM 2200 CD GLN A 283 4.789 16.283 110.496 1.00 9.76 C ATOM 2201 OE1 GLN A 283 4.473 17.195 109.724 1.00 13.68 O ATOM 2202 NE2 GLN A 283 4.296 15.051 110.387 1.00 8.66 N ATOM 0 H GLN A 283 4.724 18.718 113.319 1.00 5.74 H new ATOM 0 HA GLN A 283 3.184 16.610 112.663 1.00 5.71 H new ATOM 0 HB2 GLN A 283 5.808 16.535 113.708 1.00 5.65 H new ATOM 0 HB3 GLN A 283 5.051 15.298 113.136 1.00 5.65 H new ATOM 0 HG2 GLN A 283 6.059 17.461 111.599 1.00 7.49 H new ATOM 0 HG3 GLN A 283 6.550 15.984 111.509 1.00 7.49 H new ATOM 0 HE21 GLN A 283 4.538 14.440 110.942 1.00 8.66 H new ATOM 0 HE22 GLN A 283 3.736 14.866 109.762 1.00 8.66 H new ATOM 2203 N GLY A 284 2.767 15.452 114.878 1.00 5.86 N ATOM 2204 CA GLY A 284 2.225 15.034 116.163 1.00 6.66 C ATOM 2205 C GLY A 284 0.892 15.672 116.523 1.00 6.28 C ATOM 2206 O GLY A 284 0.377 15.457 117.621 1.00 7.34 O ATOM 0 H GLY A 284 2.688 14.867 114.253 1.00 5.86 H new ATOM 0 HA2 GLY A 284 2.118 14.070 116.158 1.00 6.66 H new ATOM 0 HA3 GLY A 284 2.869 15.245 116.857 1.00 6.66 H new ATOM 2207 N ARG A 285 0.312 16.426 115.594 1.00 6.82 N ATOM 2208 CA ARG A 285 -0.948 17.119 115.840 1.00 6.63 C ATOM 2209 C ARG A 285 -2.180 16.227 115.902 1.00 7.76 C ATOM 2210 O ARG A 285 -3.240 16.675 116.350 1.00 9.65 O ATOM 2211 CB ARG A 285 -1.152 18.216 114.784 1.00 7.39 C ATOM 2212 CG ARG A 285 -0.191 19.387 114.935 1.00 7.92 C ATOM 2213 CD ARG A 285 -0.641 20.323 116.055 1.00 9.64 C ATOM 2214 NE ARG A 285 0.247 21.481 116.175 1.00 8.27 N ATOM 2215 CZ ARG A 285 -0.008 22.552 116.920 1.00 8.50 C ATOM 2216 NH1 ARG A 285 -1.132 22.629 117.627 1.00 10.59 N ATOM 2217 NH2 ARG A 285 0.853 23.560 116.949 1.00 8.87 N ATOM 0 H ARG A 285 0.636 16.550 114.807 1.00 6.82 H new ATOM 0 HA ARG A 285 -0.862 17.497 116.729 1.00 6.63 H new ATOM 0 HB2 ARG A 285 -1.044 17.830 113.901 1.00 7.39 H new ATOM 0 HB3 ARG A 285 -2.063 18.545 114.840 1.00 7.39 H new ATOM 0 HG2 ARG A 285 0.701 19.056 115.124 1.00 7.92 H new ATOM 0 HG3 ARG A 285 -0.140 19.878 114.100 1.00 7.92 H new ATOM 0 HD2 ARG A 285 -1.547 20.625 115.882 1.00 9.64 H new ATOM 0 HD3 ARG A 285 -0.659 19.839 116.895 1.00 9.64 H new ATOM 0 HE ARG A 285 0.985 21.467 115.733 1.00 8.27 H new ATOM 0 HH11 ARG A 285 -1.699 21.983 117.604 1.00 10.59 H new ATOM 0 HH12 ARG A 285 -1.291 23.325 118.107 1.00 10.59 H new ATOM 0 HH21 ARG A 285 1.577 23.521 116.486 1.00 8.87 H new ATOM 0 HH22 ARG A 285 0.688 24.253 117.431 1.00 8.87 H new ATOM 2218 N PHE A 286 -2.054 14.974 115.476 1.00 7.81 N ATOM 2219 CA PHE A 286 -3.195 14.060 115.526 1.00 8.72 C ATOM 2220 C PHE A 286 -3.077 13.062 116.674 1.00 10.84 C ATOM 2221 O PHE A 286 -3.970 12.236 116.899 1.00 12.78 O ATOM 2222 CB PHE A 286 -3.384 13.374 114.171 1.00 9.27 C ATOM 2223 CG PHE A 286 -3.658 14.348 113.062 1.00 9.17 C ATOM 2224 CD1 PHE A 286 -2.614 14.899 112.323 1.00 10.03 C ATOM 2225 CD2 PHE A 286 -4.950 14.799 112.833 1.00 10.23 C ATOM 2226 CE1 PHE A 286 -2.858 15.896 111.373 1.00 10.46 C ATOM 2227 CE2 PHE A 286 -5.200 15.795 111.885 1.00 10.43 C ATOM 2228 CZ PHE A 286 -4.150 16.342 111.157 1.00 10.46 C ATOM 0 H PHE A 286 -1.330 14.636 115.159 1.00 7.81 H new ATOM 0 HA PHE A 286 -3.994 14.580 115.708 1.00 8.72 H new ATOM 0 HB2 PHE A 286 -2.588 12.862 113.958 1.00 9.27 H new ATOM 0 HB3 PHE A 286 -4.119 12.743 114.232 1.00 9.27 H new ATOM 0 HD1 PHE A 286 -1.744 14.600 112.463 1.00 10.03 H new ATOM 0 HD2 PHE A 286 -5.657 14.435 113.315 1.00 10.23 H new ATOM 0 HE1 PHE A 286 -2.153 16.259 110.887 1.00 10.46 H new ATOM 0 HE2 PHE A 286 -6.070 16.092 111.741 1.00 10.43 H new ATOM 0 HZ PHE A 286 -4.315 17.006 110.527 1.00 10.46 H new ATOM 2229 N ASP A 287 -1.970 13.147 117.407 1.00 8.82 N ATOM 2230 CA ASP A 287 -1.765 12.323 118.597 1.00 9.45 C ATOM 2231 C ASP A 287 -2.395 13.099 119.762 1.00 10.24 C ATOM 2232 O ASP A 287 -2.584 14.311 119.677 1.00 11.83 O ATOM 2233 CB ASP A 287 -0.272 12.196 118.947 1.00 7.88 C ATOM 2234 CG ASP A 287 0.484 11.267 118.037 1.00 8.74 C ATOM 2235 OD1 ASP A 287 -0.133 10.340 117.466 1.00 10.46 O ATOM 2236 OD2 ASP A 287 1.721 11.454 117.929 1.00 7.79 O ATOM 0 H ASP A 287 -1.319 13.681 117.230 1.00 8.82 H new ATOM 0 HA ASP A 287 -2.140 11.442 118.443 1.00 9.45 H new ATOM 0 HB2 ASP A 287 0.137 13.075 118.911 1.00 7.88 H new ATOM 0 HB3 ASP A 287 -0.188 11.881 119.861 1.00 7.88 H new ATOM 2237 N THR A 288 -2.739 12.403 120.836 1.00 11.73 N ATOM 2238 CA THR A 288 -3.199 13.093 122.034 1.00 13.04 C ATOM 2239 C THR A 288 -1.923 12.996 122.880 1.00 12.29 C ATOM 2240 O THR A 288 -1.036 13.836 122.741 1.00 14.42 O ATOM 2241 CB THR A 288 -4.410 12.394 122.715 1.00 14.04 C ATOM 2242 OG1 THR A 288 -4.156 10.999 122.882 1.00 14.37 O ATOM 2243 CG2 THR A 288 -5.672 12.594 121.870 1.00 16.19 C ATOM 0 H THR A 288 -2.715 11.545 120.894 1.00 11.73 H new ATOM 0 HA THR A 288 -3.535 13.990 121.882 1.00 13.04 H new ATOM 0 HB THR A 288 -4.543 12.792 123.590 1.00 14.04 H new ATOM 0 HG1 THR A 288 -4.319 10.777 123.676 1.00 14.37 H new ATOM 0 HG21 THR A 288 -6.423 12.156 122.300 1.00 16.19 H new ATOM 0 HG22 THR A 288 -5.857 13.542 121.784 1.00 16.19 H new ATOM 0 HG23 THR A 288 -5.536 12.211 120.989 1.00 16.19 H new ATOM 2244 N TYR A 289 -1.808 11.959 123.706 1.00 11.39 N ATOM 2245 CA TYR A 289 -0.613 11.729 124.530 1.00 10.75 C ATOM 2246 C TYR A 289 -0.391 10.222 124.647 1.00 11.58 C ATOM 2247 O TYR A 289 -1.342 9.479 124.898 1.00 13.92 O ATOM 2248 CB TYR A 289 -0.804 12.318 125.928 1.00 12.55 C ATOM 2249 CG TYR A 289 -0.592 13.805 126.010 1.00 14.06 C ATOM 2250 CD1 TYR A 289 0.696 14.343 126.050 1.00 16.40 C ATOM 2251 CD2 TYR A 289 -1.675 14.676 126.079 1.00 16.24 C ATOM 2252 CE1 TYR A 289 0.897 15.711 126.165 1.00 16.83 C ATOM 2253 CE2 TYR A 289 -1.489 16.047 126.191 1.00 17.13 C ATOM 2254 CZ TYR A 289 -0.200 16.559 126.237 1.00 18.58 C ATOM 2255 OH TYR A 289 -0.016 17.915 126.372 1.00 20.58 O ATOM 0 H TYR A 289 -2.421 11.364 123.808 1.00 11.39 H new ATOM 0 HA TYR A 289 0.152 12.158 124.115 1.00 10.75 H new ATOM 0 HB2 TYR A 289 -1.701 12.113 126.234 1.00 12.55 H new ATOM 0 HB3 TYR A 289 -0.190 11.881 126.538 1.00 12.55 H new ATOM 0 HD1 TYR A 289 1.431 13.775 125.999 1.00 16.40 H new ATOM 0 HD2 TYR A 289 -2.539 14.333 126.050 1.00 16.24 H new ATOM 0 HE1 TYR A 289 1.760 16.057 126.194 1.00 16.83 H new ATOM 0 HE2 TYR A 289 -2.222 16.618 126.235 1.00 17.13 H new ATOM 0 HH TYR A 289 -0.763 18.298 126.401 1.00 20.58 H new ATOM 2256 N PRO A 290 0.851 9.738 124.451 1.00 9.83 N ATOM 2257 CA PRO A 290 2.067 10.495 124.122 1.00 8.79 C ATOM 2258 C PRO A 290 1.999 11.105 122.730 1.00 7.80 C ATOM 2259 O PRO A 290 1.196 10.688 121.887 1.00 9.09 O ATOM 2260 CB PRO A 290 3.171 9.448 124.254 1.00 9.35 C ATOM 2261 CG PRO A 290 2.474 8.171 123.868 1.00 12.87 C ATOM 2262 CD PRO A 290 1.161 8.305 124.609 1.00 11.04 C ATOM 0 HA PRO A 290 2.210 11.260 124.701 1.00 8.79 H new ATOM 0 HB2 PRO A 290 3.920 9.640 123.668 1.00 9.35 H new ATOM 0 HB3 PRO A 290 3.521 9.407 125.158 1.00 9.35 H new ATOM 0 HG2 PRO A 290 2.346 8.101 122.909 1.00 12.87 H new ATOM 0 HG3 PRO A 290 2.971 7.386 124.146 1.00 12.87 H new ATOM 0 HD2 PRO A 290 0.471 7.742 124.226 1.00 11.04 H new ATOM 0 HD3 PRO A 290 1.246 8.054 125.542 1.00 11.04 H new ATOM 2263 N LYS A 291 2.851 12.091 122.487 1.00 7.12 N ATOM 2264 CA LYS A 291 2.877 12.814 121.220 1.00 8.06 C ATOM 2265 C LYS A 291 4.239 12.615 120.554 1.00 6.14 C ATOM 2266 O LYS A 291 5.280 12.899 121.157 1.00 6.51 O ATOM 2267 CB LYS A 291 2.654 14.300 121.507 1.00 10.65 C ATOM 2268 CG LYS A 291 1.998 15.103 120.402 1.00 16.34 C ATOM 2269 CD LYS A 291 1.792 16.562 120.833 1.00 18.25 C ATOM 2270 CE LYS A 291 1.050 16.709 122.178 1.00 19.94 C ATOM 2271 NZ LYS A 291 -0.439 16.509 122.141 1.00 19.83 N ATOM 0 H LYS A 291 3.436 12.363 123.056 1.00 7.12 H new ATOM 0 HA LYS A 291 2.183 12.484 120.628 1.00 8.06 H new ATOM 0 HB2 LYS A 291 2.109 14.378 122.306 1.00 10.65 H new ATOM 0 HB3 LYS A 291 3.512 14.704 121.709 1.00 10.65 H new ATOM 0 HG2 LYS A 291 2.549 15.072 119.604 1.00 16.34 H new ATOM 0 HG3 LYS A 291 1.143 14.706 120.172 1.00 16.34 H new ATOM 0 HD2 LYS A 291 2.656 16.997 120.900 1.00 18.25 H new ATOM 0 HD3 LYS A 291 1.293 17.028 120.144 1.00 18.25 H new ATOM 0 HE2 LYS A 291 1.427 16.073 122.805 1.00 19.94 H new ATOM 0 HE3 LYS A 291 1.230 17.595 122.530 1.00 19.94 H new ATOM 0 HZ1 LYS A 291 -0.825 17.036 122.745 1.00 19.83 H new ATOM 0 HZ2 LYS A 291 -0.746 16.713 121.331 1.00 19.83 H new ATOM 0 HZ3 LYS A 291 -0.629 15.659 122.325 1.00 19.83 H new ATOM 2272 N ARG A 292 4.248 12.138 119.312 1.00 5.77 N ATOM 2273 CA ARG A 292 5.516 11.911 118.624 1.00 5.14 C ATOM 2274 C ARG A 292 6.187 13.219 118.206 1.00 5.09 C ATOM 2275 O ARG A 292 5.531 14.248 118.013 1.00 5.48 O ATOM 2276 CB ARG A 292 5.305 11.010 117.398 1.00 5.09 C ATOM 2277 CG ARG A 292 4.631 11.680 116.192 1.00 5.29 C ATOM 2278 CD ARG A 292 4.042 10.641 115.225 1.00 6.49 C ATOM 2279 NE ARG A 292 2.895 9.975 115.842 1.00 7.37 N ATOM 2280 CZ ARG A 292 2.553 8.708 115.649 1.00 10.34 C ATOM 2281 NH1 ARG A 292 3.260 7.923 114.839 1.00 12.67 N ATOM 2282 NH2 ARG A 292 1.501 8.219 116.294 1.00 12.03 N ATOM 0 H ARG A 292 3.545 11.942 118.857 1.00 5.77 H new ATOM 0 HA ARG A 292 6.108 11.467 119.251 1.00 5.14 H new ATOM 0 HB2 ARG A 292 6.167 10.666 117.117 1.00 5.09 H new ATOM 0 HB3 ARG A 292 4.769 10.247 117.665 1.00 5.09 H new ATOM 0 HG2 ARG A 292 3.927 12.271 116.501 1.00 5.29 H new ATOM 0 HG3 ARG A 292 5.278 12.230 115.723 1.00 5.29 H new ATOM 0 HD2 ARG A 292 3.769 11.074 114.401 1.00 6.49 H new ATOM 0 HD3 ARG A 292 4.718 9.986 114.991 1.00 6.49 H new ATOM 0 HE ARG A 292 2.404 10.442 116.372 1.00 7.37 H new ATOM 0 HH11 ARG A 292 3.950 8.236 114.432 1.00 12.67 H new ATOM 0 HH12 ARG A 292 3.027 7.103 114.723 1.00 12.67 H new ATOM 0 HH21 ARG A 292 1.052 8.722 116.828 1.00 12.03 H new ATOM 0 HH22 ARG A 292 1.268 7.399 116.178 1.00 12.03 H new ATOM 2283 N ARG A 293 7.509 13.167 118.077 1.00 5.52 N ATOM 2284 CA ARG A 293 8.297 14.334 117.670 1.00 5.55 C ATOM 2285 C ARG A 293 8.068 14.634 116.193 1.00 5.73 C ATOM 2286 O ARG A 293 7.846 15.782 115.817 1.00 6.33 O ATOM 2287 CB ARG A 293 9.774 14.080 117.962 1.00 5.72 C ATOM 2288 CG ARG A 293 10.042 13.984 119.459 1.00 6.41 C ATOM 2289 CD ARG A 293 11.408 13.399 119.793 1.00 6.14 C ATOM 2290 NE ARG A 293 11.452 13.178 121.241 1.00 6.47 N ATOM 2291 CZ ARG A 293 12.396 13.619 122.070 1.00 4.95 C ATOM 2292 NH1 ARG A 293 13.437 14.307 121.619 1.00 5.34 N ATOM 2293 NH2 ARG A 293 12.249 13.425 123.376 1.00 6.18 N ATOM 0 H ARG A 293 7.976 12.459 118.221 1.00 5.52 H new ATOM 0 HA ARG A 293 8.013 15.111 118.177 1.00 5.55 H new ATOM 0 HB2 ARG A 293 10.053 13.258 117.529 1.00 5.72 H new ATOM 0 HB3 ARG A 293 10.307 14.796 117.582 1.00 5.72 H new ATOM 0 HG2 ARG A 293 9.972 14.869 119.851 1.00 6.41 H new ATOM 0 HG3 ARG A 293 9.354 13.437 119.869 1.00 6.41 H new ATOM 0 HD2 ARG A 293 11.548 12.566 119.317 1.00 6.14 H new ATOM 0 HD3 ARG A 293 12.114 14.004 119.519 1.00 6.14 H new ATOM 0 HE ARG A 293 10.810 12.722 121.587 1.00 6.47 H new ATOM 0 HH11 ARG A 293 13.510 14.475 120.779 1.00 5.34 H new ATOM 0 HH12 ARG A 293 14.039 14.585 122.167 1.00 5.34 H new ATOM 0 HH21 ARG A 293 11.552 13.020 123.675 1.00 6.18 H new ATOM 0 HH22 ARG A 293 12.851 13.705 123.923 1.00 6.18 H new ATOM 2294 N GLY A 294 8.153 13.613 115.344 1.00 6.00 N ATOM 2295 CA GLY A 294 7.861 13.818 113.936 1.00 6.36 C ATOM 2296 C GLY A 294 8.945 14.315 113.006 1.00 7.05 C ATOM 2297 O GLY A 294 8.629 14.764 111.896 1.00 7.55 O ATOM 0 H GLY A 294 8.374 12.810 115.560 1.00 6.00 H new ATOM 0 HA2 GLY A 294 7.541 12.974 113.581 1.00 6.36 H new ATOM 0 HA3 GLY A 294 7.124 14.446 113.882 1.00 6.36 H new ATOM 2298 N ILE A 295 10.206 14.284 113.427 1.00 7.76 N ATOM 2299 CA ILE A 295 11.286 14.683 112.527 1.00 7.42 C ATOM 2300 C ILE A 295 11.807 13.379 111.907 1.00 6.14 C ATOM 2301 O ILE A 295 11.740 12.314 112.522 1.00 6.73 O ATOM 2302 CB ILE A 295 12.439 15.441 113.272 1.00 7.52 C ATOM 2303 CG1 ILE A 295 11.937 16.803 113.778 1.00 9.23 C ATOM 2304 CG2 ILE A 295 13.611 15.701 112.321 1.00 8.98 C ATOM 2305 CD1 ILE A 295 13.031 17.670 114.423 1.00 11.16 C ATOM 0 H ILE A 295 10.455 14.041 114.213 1.00 7.76 H new ATOM 0 HA ILE A 295 10.959 15.305 111.858 1.00 7.42 H new ATOM 0 HB ILE A 295 12.726 14.887 114.014 1.00 7.52 H new ATOM 0 HG12 ILE A 295 11.547 17.290 113.036 1.00 9.23 H new ATOM 0 HG13 ILE A 295 11.229 16.657 114.425 1.00 9.23 H new ATOM 0 HG21 ILE A 295 14.315 16.170 112.796 1.00 8.98 H new ATOM 0 HG22 ILE A 295 13.952 14.856 111.989 1.00 8.98 H new ATOM 0 HG23 ILE A 295 13.309 16.242 111.575 1.00 8.98 H new ATOM 0 HD11 ILE A 295 12.646 18.510 114.718 1.00 11.16 H new ATOM 0 HD12 ILE A 295 13.408 17.202 115.185 1.00 11.16 H new ATOM 0 HD13 ILE A 295 13.730 17.845 113.774 1.00 11.16 H new ATOM 2306 N THR A 296 12.291 13.453 110.672 1.00 5.52 N ATOM 2307 CA THR A 296 12.814 12.266 110.013 1.00 5.64 C ATOM 2308 C THR A 296 14.027 11.700 110.773 1.00 5.38 C ATOM 2309 O THR A 296 14.521 12.310 111.731 1.00 5.80 O ATOM 2310 CB THR A 296 13.145 12.556 108.532 1.00 5.06 C ATOM 2311 OG1 THR A 296 13.372 11.309 107.863 1.00 5.90 O ATOM 2312 CG2 THR A 296 14.361 13.472 108.390 1.00 6.16 C ATOM 0 H THR A 296 12.325 14.173 110.204 1.00 5.52 H new ATOM 0 HA THR A 296 12.124 11.584 110.026 1.00 5.64 H new ATOM 0 HB THR A 296 12.396 13.021 108.128 1.00 5.06 H new ATOM 0 HG1 THR A 296 13.168 11.385 107.052 1.00 5.90 H new ATOM 0 HG21 THR A 296 14.538 13.631 107.450 1.00 6.16 H new ATOM 0 HG22 THR A 296 14.184 14.317 108.833 1.00 6.16 H new ATOM 0 HG23 THR A 296 15.134 13.050 108.797 1.00 6.16 H new ATOM 2313 N ARG A 297 14.508 10.538 110.344 1.00 5.62 N ATOM 2314 CA ARG A 297 15.593 9.839 111.049 1.00 5.66 C ATOM 2315 C ARG A 297 16.990 10.377 110.807 1.00 6.61 C ATOM 2316 O ARG A 297 17.877 9.679 110.307 1.00 7.05 O ATOM 2317 CB ARG A 297 15.511 8.348 110.718 1.00 7.10 C ATOM 2318 CG ARG A 297 14.167 7.751 111.084 1.00 7.55 C ATOM 2319 CD ARG A 297 14.155 6.231 110.961 1.00 10.05 C ATOM 2320 NE ARG A 297 12.811 5.730 111.236 1.00 10.41 N ATOM 2321 CZ ARG A 297 12.526 4.594 111.865 1.00 12.19 C ATOM 2322 NH1 ARG A 297 11.259 4.257 112.050 1.00 12.30 N ATOM 2323 NH2 ARG A 297 13.492 3.806 112.315 1.00 14.77 N ATOM 0 H ARG A 297 14.221 10.131 109.643 1.00 5.62 H new ATOM 0 HA ARG A 297 15.449 9.999 111.995 1.00 5.66 H new ATOM 0 HB2 ARG A 297 15.672 8.220 109.770 1.00 7.10 H new ATOM 0 HB3 ARG A 297 16.213 7.875 111.192 1.00 7.10 H new ATOM 0 HG2 ARG A 297 13.941 8.001 111.994 1.00 7.55 H new ATOM 0 HG3 ARG A 297 13.482 8.125 110.508 1.00 7.55 H new ATOM 0 HD2 ARG A 297 14.433 5.967 110.070 1.00 10.05 H new ATOM 0 HD3 ARG A 297 14.789 5.842 111.583 1.00 10.05 H new ATOM 0 HE ARG A 297 12.149 6.210 110.969 1.00 10.41 H new ATOM 0 HH11 ARG A 297 10.631 4.771 111.764 1.00 12.30 H new ATOM 0 HH12 ARG A 297 11.064 3.524 112.456 1.00 12.30 H new ATOM 0 HH21 ARG A 297 14.315 4.027 112.202 1.00 14.77 H new ATOM 0 HH22 ARG A 297 13.296 3.073 112.720 1.00 14.77 H new ATOM 2324 N VAL A 298 17.178 11.631 111.205 1.00 6.06 N ATOM 2325 CA VAL A 298 18.439 12.345 111.029 1.00 6.86 C ATOM 2326 C VAL A 298 19.648 11.634 111.643 1.00 5.86 C ATOM 2327 O VAL A 298 20.683 11.475 110.985 1.00 6.49 O ATOM 2328 CB VAL A 298 18.324 13.778 111.620 1.00 5.82 C ATOM 2329 CG1 VAL A 298 19.654 14.535 111.441 1.00 7.24 C ATOM 2330 CG2 VAL A 298 17.164 14.529 110.947 1.00 6.49 C ATOM 0 H VAL A 298 16.568 12.098 111.591 1.00 6.06 H new ATOM 0 HA VAL A 298 18.596 12.378 110.072 1.00 6.86 H new ATOM 0 HB VAL A 298 18.138 13.719 112.570 1.00 5.82 H new ATOM 0 HG11 VAL A 298 19.571 15.427 111.813 1.00 7.24 H new ATOM 0 HG12 VAL A 298 20.363 14.058 111.901 1.00 7.24 H new ATOM 0 HG13 VAL A 298 19.867 14.597 110.497 1.00 7.24 H new ATOM 0 HG21 VAL A 298 17.097 15.422 111.320 1.00 6.49 H new ATOM 0 HG22 VAL A 298 17.327 14.589 109.993 1.00 6.49 H new ATOM 0 HG23 VAL A 298 16.335 14.051 111.103 1.00 6.49 H new ATOM 2331 N LYS A 299 19.530 11.213 112.900 1.00 7.01 N ATOM 2332 CA LYS A 299 20.640 10.545 113.572 1.00 7.68 C ATOM 2333 C LYS A 299 21.081 9.294 112.804 1.00 6.73 C ATOM 2334 O LYS A 299 22.276 9.085 112.569 1.00 8.14 O ATOM 2335 CB LYS A 299 20.240 10.181 115.009 1.00 8.87 C ATOM 2336 CG LYS A 299 21.323 9.424 115.776 1.00 9.87 C ATOM 2337 CD LYS A 299 20.896 9.096 117.202 1.00 12.67 C ATOM 2338 CE LYS A 299 20.877 10.327 118.091 1.00 12.26 C ATOM 2339 NZ LYS A 299 20.537 9.961 119.513 1.00 13.22 N ATOM 0 H LYS A 299 18.821 11.304 113.378 1.00 7.01 H new ATOM 0 HA LYS A 299 21.393 11.156 113.598 1.00 7.68 H new ATOM 0 HB2 LYS A 299 20.022 10.994 115.491 1.00 8.87 H new ATOM 0 HB3 LYS A 299 19.435 9.641 114.985 1.00 8.87 H new ATOM 0 HG2 LYS A 299 21.535 8.602 115.306 1.00 9.87 H new ATOM 0 HG3 LYS A 299 22.134 9.956 115.797 1.00 9.87 H new ATOM 0 HD2 LYS A 299 20.013 8.694 117.189 1.00 12.67 H new ATOM 0 HD3 LYS A 299 21.502 8.438 117.576 1.00 12.67 H new ATOM 0 HE2 LYS A 299 21.743 10.763 118.064 1.00 12.26 H new ATOM 0 HE3 LYS A 299 20.228 10.964 117.753 1.00 12.26 H new ATOM 0 HZ1 LYS A 299 20.616 10.680 120.032 1.00 13.22 H new ATOM 0 HZ2 LYS A 299 19.700 9.659 119.550 1.00 13.22 H new ATOM 0 HZ3 LYS A 299 21.093 9.327 119.798 1.00 13.22 H new ATOM 2340 N GLU A 300 20.119 8.466 112.413 1.00 6.98 N ATOM 2341 CA GLU A 300 20.444 7.247 111.675 1.00 7.36 C ATOM 2342 C GLU A 300 21.016 7.562 110.290 1.00 7.28 C ATOM 2343 O GLU A 300 21.913 6.864 109.815 1.00 8.03 O ATOM 2344 CB GLU A 300 19.208 6.350 111.572 1.00 9.01 C ATOM 2345 CG GLU A 300 18.728 5.786 112.919 1.00 12.97 C ATOM 2346 CD GLU A 300 18.230 6.859 113.898 1.00 16.38 C ATOM 2347 OE1 GLU A 300 17.645 7.887 113.465 1.00 17.73 O ATOM 2348 OE2 GLU A 300 18.411 6.653 115.120 1.00 19.93 O ATOM 0 H GLU A 300 19.281 8.588 112.562 1.00 6.98 H new ATOM 0 HA GLU A 300 21.133 6.771 112.165 1.00 7.36 H new ATOM 0 HB2 GLU A 300 18.486 6.856 111.168 1.00 9.01 H new ATOM 0 HB3 GLU A 300 19.405 5.611 110.975 1.00 9.01 H new ATOM 0 HG2 GLU A 300 18.013 5.151 112.758 1.00 12.97 H new ATOM 0 HG3 GLU A 300 19.456 5.296 113.332 1.00 12.97 H new ATOM 2349 N MET A 301 20.510 8.604 109.629 1.00 6.96 N ATOM 2350 CA MET A 301 21.057 8.983 108.331 1.00 7.28 C ATOM 2351 C MET A 301 22.536 9.347 108.482 1.00 7.28 C ATOM 2352 O MET A 301 23.376 8.905 107.696 1.00 7.24 O ATOM 2353 CB MET A 301 20.279 10.166 107.749 1.00 7.22 C ATOM 2354 CG MET A 301 18.913 9.774 107.216 1.00 7.07 C ATOM 2355 SD MET A 301 17.950 11.239 106.775 1.00 7.04 S ATOM 2356 CE MET A 301 16.384 10.469 106.257 1.00 7.82 C ATOM 0 H MET A 301 19.862 9.095 109.910 1.00 6.96 H new ATOM 0 HA MET A 301 20.974 8.232 107.723 1.00 7.28 H new ATOM 0 HB2 MET A 301 20.171 10.844 108.434 1.00 7.22 H new ATOM 0 HB3 MET A 301 20.797 10.566 107.033 1.00 7.22 H new ATOM 0 HG2 MET A 301 19.016 9.204 106.438 1.00 7.07 H new ATOM 0 HG3 MET A 301 18.436 9.258 107.885 1.00 7.07 H new ATOM 0 HE1 MET A 301 15.758 11.159 105.987 1.00 7.82 H new ATOM 0 HE2 MET A 301 16.548 9.872 105.511 1.00 7.82 H new ATOM 0 HE3 MET A 301 16.010 9.966 106.997 1.00 7.82 H new ATOM 2357 N LEU A 302 22.861 10.143 109.495 1.00 7.51 N ATOM 2358 CA LEU A 302 24.248 10.531 109.722 1.00 8.67 C ATOM 2359 C LEU A 302 25.117 9.304 109.991 1.00 9.32 C ATOM 2360 O LEU A 302 26.224 9.195 109.464 1.00 9.62 O ATOM 2361 CB LEU A 302 24.340 11.511 110.898 1.00 8.80 C ATOM 2362 CG LEU A 302 23.767 12.908 110.644 1.00 7.50 C ATOM 2363 CD1 LEU A 302 23.724 13.666 111.963 1.00 9.89 C ATOM 2364 CD2 LEU A 302 24.623 13.645 109.607 1.00 9.90 C ATOM 0 H LEU A 302 22.298 10.467 110.059 1.00 7.51 H new ATOM 0 HA LEU A 302 24.576 10.969 108.921 1.00 8.67 H new ATOM 0 HB2 LEU A 302 23.878 11.123 111.658 1.00 8.80 H new ATOM 0 HB3 LEU A 302 25.272 11.603 111.149 1.00 8.80 H new ATOM 0 HG LEU A 302 22.867 12.842 110.289 1.00 7.50 H new ATOM 0 HD11 LEU A 302 23.362 14.554 111.815 1.00 9.89 H new ATOM 0 HD12 LEU A 302 23.161 13.189 112.592 1.00 9.89 H new ATOM 0 HD13 LEU A 302 24.621 13.739 112.324 1.00 9.89 H new ATOM 0 HD21 LEU A 302 24.254 14.528 109.452 1.00 9.90 H new ATOM 0 HD22 LEU A 302 25.531 13.728 109.937 1.00 9.90 H new ATOM 0 HD23 LEU A 302 24.626 13.145 108.776 1.00 9.90 H new ATOM 2365 N GLU A 303 24.619 8.372 110.796 1.00 8.82 N ATOM 2366 CA GLU A 303 25.387 7.168 111.099 1.00 10.68 C ATOM 2367 C GLU A 303 25.608 6.304 109.855 1.00 10.51 C ATOM 2368 O GLU A 303 26.624 5.611 109.748 1.00 12.30 O ATOM 2369 CB GLU A 303 24.675 6.381 112.211 1.00 14.30 C ATOM 2370 CG GLU A 303 24.780 7.108 113.554 1.00 20.08 C ATOM 2371 CD GLU A 303 23.891 6.549 114.654 1.00 23.84 C ATOM 2372 OE1 GLU A 303 24.016 7.036 115.802 1.00 26.73 O ATOM 2373 OE2 GLU A 303 23.071 5.647 114.384 1.00 25.74 O ATOM 0 H GLU A 303 23.848 8.415 111.174 1.00 8.82 H new ATOM 0 HA GLU A 303 26.268 7.430 111.409 1.00 10.68 H new ATOM 0 HB2 GLU A 303 23.741 6.259 111.978 1.00 14.30 H new ATOM 0 HB3 GLU A 303 25.066 5.497 112.287 1.00 14.30 H new ATOM 0 HG2 GLU A 303 25.702 7.076 113.853 1.00 20.08 H new ATOM 0 HG3 GLU A 303 24.558 8.043 113.420 1.00 20.08 H new ATOM 2374 N SER A 304 24.680 6.368 108.904 1.00 9.63 N ATOM 2375 CA SER A 304 24.766 5.580 107.672 1.00 9.58 C ATOM 2376 C SER A 304 25.442 6.308 106.510 1.00 10.04 C ATOM 2377 O SER A 304 25.550 5.764 105.414 1.00 11.30 O ATOM 2378 CB SER A 304 23.367 5.139 107.233 1.00 11.11 C ATOM 2379 OG SER A 304 22.799 4.246 108.178 1.00 14.10 O ATOM 0 H SER A 304 23.982 6.868 108.953 1.00 9.63 H new ATOM 0 HA SER A 304 25.324 4.816 107.888 1.00 9.58 H new ATOM 0 HB2 SER A 304 22.795 5.916 107.132 1.00 11.11 H new ATOM 0 HB3 SER A 304 23.417 4.709 106.365 1.00 11.11 H new ATOM 0 HG SER A 304 21.962 4.262 108.110 1.00 14.10 H new ATOM 2380 N GLY A 305 25.896 7.535 106.743 1.00 9.38 N ATOM 2381 CA GLY A 305 26.545 8.287 105.683 1.00 10.37 C ATOM 2382 C GLY A 305 25.609 8.824 104.609 1.00 10.83 C ATOM 2383 O GLY A 305 26.034 9.074 103.479 1.00 11.42 O ATOM 0 H GLY A 305 25.838 7.943 107.498 1.00 9.38 H new ATOM 0 HA2 GLY A 305 27.022 9.033 106.079 1.00 10.37 H new ATOM 0 HA3 GLY A 305 27.208 7.718 105.261 1.00 10.37 H new ATOM 2384 N ILE A 306 24.333 8.992 104.952 1.00 8.95 N ATOM 2385 CA ILE A 306 23.322 9.523 104.037 1.00 9.28 C ATOM 2386 C ILE A 306 23.298 11.036 104.253 1.00 8.45 C ATOM 2387 O ILE A 306 23.204 11.499 105.393 1.00 8.73 O ATOM 2388 CB ILE A 306 21.936 8.912 104.360 1.00 7.28 C ATOM 2389 CG1 ILE A 306 21.922 7.429 103.965 1.00 8.67 C ATOM 2390 CG2 ILE A 306 20.831 9.682 103.637 1.00 9.37 C ATOM 2391 CD1 ILE A 306 20.746 6.647 104.537 1.00 9.49 C ATOM 0 H ILE A 306 24.026 8.799 105.732 1.00 8.95 H new ATOM 0 HA ILE A 306 23.530 9.303 103.115 1.00 9.28 H new ATOM 0 HB ILE A 306 21.771 8.981 105.313 1.00 7.28 H new ATOM 0 HG12 ILE A 306 21.904 7.362 102.998 1.00 8.67 H new ATOM 0 HG13 ILE A 306 22.748 7.017 104.262 1.00 8.67 H new ATOM 0 HG21 ILE A 306 19.970 9.288 103.849 1.00 9.37 H new ATOM 0 HG22 ILE A 306 20.841 10.609 103.923 1.00 9.37 H new ATOM 0 HG23 ILE A 306 20.979 9.638 102.679 1.00 9.37 H new ATOM 0 HD11 ILE A 306 20.801 5.723 104.248 1.00 9.49 H new ATOM 0 HD12 ILE A 306 20.773 6.685 105.506 1.00 9.49 H new ATOM 0 HD13 ILE A 306 19.915 7.035 104.221 1.00 9.49 H new ATOM 2392 N ASN A 307 23.388 11.814 103.175 1.00 7.15 N ATOM 2393 CA ASN A 307 23.402 13.261 103.333 1.00 6.98 C ATOM 2394 C ASN A 307 22.068 13.845 103.793 1.00 6.39 C ATOM 2395 O ASN A 307 21.051 13.723 103.109 1.00 7.60 O ATOM 2396 CB ASN A 307 23.845 13.956 102.044 1.00 7.30 C ATOM 2397 CG ASN A 307 24.127 15.429 102.267 1.00 6.49 C ATOM 2398 OD1 ASN A 307 24.947 15.780 103.112 1.00 8.88 O ATOM 2399 ND2 ASN A 307 23.445 16.294 101.530 1.00 7.16 N ATOM 0 H ASN A 307 23.441 11.531 102.365 1.00 7.15 H new ATOM 0 HA ASN A 307 24.046 13.432 104.038 1.00 6.98 H new ATOM 0 HB2 ASN A 307 24.642 13.523 101.700 1.00 7.30 H new ATOM 0 HB3 ASN A 307 23.155 13.857 101.370 1.00 7.30 H new ATOM 0 HD21 ASN A 307 23.569 17.139 101.634 1.00 7.16 H new ATOM 0 HD22 ASN A 307 22.879 16.011 100.948 1.00 7.16 H new ATOM 2400 N VAL A 308 22.093 14.477 104.963 1.00 5.99 N ATOM 2401 CA VAL A 308 20.911 15.104 105.545 1.00 5.69 C ATOM 2402 C VAL A 308 21.328 16.492 106.044 1.00 5.06 C ATOM 2403 O VAL A 308 22.476 16.702 106.468 1.00 6.14 O ATOM 2404 CB VAL A 308 20.295 14.203 106.681 1.00 5.77 C ATOM 2405 CG1 VAL A 308 21.315 13.950 107.789 1.00 7.92 C ATOM 2406 CG2 VAL A 308 19.013 14.827 107.226 1.00 6.63 C ATOM 0 H VAL A 308 22.801 14.554 105.444 1.00 5.99 H new ATOM 0 HA VAL A 308 20.207 15.202 104.885 1.00 5.69 H new ATOM 0 HB VAL A 308 20.064 13.342 106.299 1.00 5.77 H new ATOM 0 HG11 VAL A 308 20.915 13.394 108.476 1.00 7.92 H new ATOM 0 HG12 VAL A 308 22.090 13.499 107.419 1.00 7.92 H new ATOM 0 HG13 VAL A 308 21.589 14.796 108.176 1.00 7.92 H new ATOM 0 HG21 VAL A 308 18.648 14.260 107.923 1.00 6.63 H new ATOM 0 HG22 VAL A 308 19.210 15.703 107.592 1.00 6.63 H new ATOM 0 HG23 VAL A 308 18.365 14.915 106.509 1.00 6.63 H new ATOM 2407 N CYS A 309 20.400 17.443 105.974 1.00 4.94 N ATOM 2408 CA CYS A 309 20.674 18.826 106.365 1.00 5.61 C ATOM 2409 C CYS A 309 19.386 19.473 106.880 1.00 5.40 C ATOM 2410 O CYS A 309 18.299 18.884 106.766 1.00 5.67 O ATOM 2411 CB CYS A 309 21.233 19.612 105.164 1.00 7.09 C ATOM 2412 SG CYS A 309 20.079 19.803 103.791 1.00 6.29 S ATOM 0 H CYS A 309 19.596 17.307 105.700 1.00 4.94 H new ATOM 0 HA CYS A 309 21.337 18.838 107.073 1.00 5.61 H new ATOM 0 HB2 CYS A 309 21.506 20.492 105.467 1.00 7.09 H new ATOM 0 HB3 CYS A 309 22.030 19.163 104.841 1.00 7.09 H new ATOM 0 HG CYS A 309 19.102 20.389 104.168 1.00 6.29 H new ATOM 2413 N PHE A 310 19.510 20.681 107.429 1.00 5.85 N ATOM 2414 CA PHE A 310 18.373 21.384 108.027 1.00 5.29 C ATOM 2415 C PHE A 310 17.944 22.669 107.332 1.00 5.89 C ATOM 2416 O PHE A 310 18.779 23.502 106.968 1.00 6.90 O ATOM 2417 CB PHE A 310 18.680 21.796 109.483 1.00 6.40 C ATOM 2418 CG PHE A 310 18.814 20.659 110.472 1.00 5.69 C ATOM 2419 CD1 PHE A 310 18.251 19.406 110.252 1.00 7.86 C ATOM 2420 CD2 PHE A 310 19.437 20.898 111.695 1.00 7.04 C ATOM 2421 CE1 PHE A 310 18.302 18.406 111.240 1.00 8.31 C ATOM 2422 CE2 PHE A 310 19.492 19.904 112.694 1.00 7.63 C ATOM 2423 CZ PHE A 310 18.922 18.660 112.465 1.00 6.15 C ATOM 0 H PHE A 310 20.252 21.115 107.466 1.00 5.85 H new ATOM 0 HA PHE A 310 17.658 20.734 107.946 1.00 5.29 H new ATOM 0 HB2 PHE A 310 19.504 22.308 109.490 1.00 6.40 H new ATOM 0 HB3 PHE A 310 17.976 22.388 109.790 1.00 6.40 H new ATOM 0 HD1 PHE A 310 17.835 19.227 109.440 1.00 7.86 H new ATOM 0 HD2 PHE A 310 19.824 21.728 111.856 1.00 7.04 H new ATOM 0 HE1 PHE A 310 17.922 17.573 111.077 1.00 8.31 H new ATOM 0 HE2 PHE A 310 19.910 20.082 113.505 1.00 7.63 H new ATOM 0 HZ PHE A 310 18.953 18.002 113.121 1.00 6.15 H new ATOM 2424 N GLY A 311 16.631 22.842 107.193 1.00 5.05 N ATOM 2425 CA GLY A 311 16.083 24.072 106.637 1.00 5.54 C ATOM 2426 C GLY A 311 15.166 24.749 107.659 1.00 4.73 C ATOM 2427 O GLY A 311 14.713 24.107 108.626 1.00 5.39 O ATOM 0 H GLY A 311 16.041 22.257 107.416 1.00 5.05 H new ATOM 0 HA2 GLY A 311 16.803 24.673 106.390 1.00 5.54 H new ATOM 0 HA3 GLY A 311 15.587 23.876 105.827 1.00 5.54 H new ATOM 2428 N HIS A 312 14.901 26.046 107.467 1.00 4.88 N ATOM 2429 CA HIS A 312 14.009 26.812 108.352 1.00 4.47 C ATOM 2430 C HIS A 312 12.557 26.603 107.921 1.00 5.04 C ATOM 2431 O HIS A 312 11.643 26.650 108.755 1.00 5.11 O ATOM 2432 CB HIS A 312 14.358 28.323 108.298 1.00 5.64 C ATOM 2433 CG HIS A 312 13.872 29.134 109.471 1.00 5.50 C ATOM 2434 ND1 HIS A 312 12.536 29.284 109.793 1.00 5.53 N ATOM 2435 CD2 HIS A 312 14.555 29.896 110.362 1.00 5.27 C ATOM 2436 CE1 HIS A 312 12.423 30.102 110.828 1.00 5.71 C ATOM 2437 NE2 HIS A 312 13.634 30.489 111.191 1.00 5.57 N ATOM 0 H HIS A 312 15.232 26.507 106.821 1.00 4.88 H new ATOM 0 HA HIS A 312 14.127 26.498 109.262 1.00 4.47 H new ATOM 0 HB2 HIS A 312 15.321 28.416 108.235 1.00 5.64 H new ATOM 0 HB3 HIS A 312 13.983 28.698 107.486 1.00 5.64 H new ATOM 0 HD1 HIS A 312 11.881 28.905 109.385 1.00 5.53 H new ATOM 0 HD2 HIS A 312 15.478 29.998 110.404 1.00 5.27 H new ATOM 0 HE1 HIS A 312 11.626 30.361 111.232 1.00 5.71 H new ATOM 2438 N ASP A 313 12.369 26.381 106.616 1.00 5.44 N ATOM 2439 CA ASP A 313 11.082 26.150 105.967 1.00 6.08 C ATOM 2440 C ASP A 313 10.193 27.391 105.856 1.00 5.71 C ATOM 2441 O ASP A 313 9.938 27.862 104.746 1.00 6.43 O ATOM 2442 CB ASP A 313 10.322 24.997 106.650 1.00 7.59 C ATOM 2443 CG ASP A 313 9.266 24.366 105.738 1.00 9.28 C ATOM 2444 OD1 ASP A 313 9.123 24.792 104.568 1.00 10.56 O ATOM 2445 OD2 ASP A 313 8.586 23.419 106.189 1.00 8.91 O ATOM 0 H ASP A 313 13.025 26.361 106.060 1.00 5.44 H new ATOM 0 HA ASP A 313 11.298 25.903 105.054 1.00 6.08 H new ATOM 0 HB2 ASP A 313 10.955 24.316 106.926 1.00 7.59 H new ATOM 0 HB3 ASP A 313 9.893 25.328 107.454 1.00 7.59 H new ATOM 2446 N SER A 314 9.752 27.929 106.989 1.00 6.48 N ATOM 2447 CA SER A 314 8.856 29.080 107.001 1.00 6.74 C ATOM 2448 C SER A 314 9.289 30.153 107.981 1.00 6.36 C ATOM 2449 O SER A 314 9.828 29.844 109.046 1.00 6.34 O ATOM 2450 CB SER A 314 7.449 28.618 107.388 1.00 8.52 C ATOM 2451 OG SER A 314 6.945 27.676 106.447 1.00 10.54 O ATOM 0 H SER A 314 9.963 27.638 107.770 1.00 6.48 H new ATOM 0 HA SER A 314 8.875 29.463 106.110 1.00 6.74 H new ATOM 0 HB2 SER A 314 7.468 28.219 108.272 1.00 8.52 H new ATOM 0 HB3 SER A 314 6.855 29.383 107.435 1.00 8.52 H new ATOM 0 HG SER A 314 6.449 28.069 105.895 1.00 10.54 H new ATOM 2452 N VAL A 315 9.051 31.412 107.613 1.00 6.04 N ATOM 2453 CA VAL A 315 9.349 32.554 108.477 1.00 7.04 C ATOM 2454 C VAL A 315 8.077 33.407 108.489 1.00 9.99 C ATOM 2455 O VAL A 315 7.749 34.066 107.500 1.00 9.53 O ATOM 2456 CB VAL A 315 10.568 33.368 107.968 1.00 6.68 C ATOM 2457 CG1 VAL A 315 10.739 34.647 108.796 1.00 9.99 C ATOM 2458 CG2 VAL A 315 11.832 32.513 108.080 1.00 8.33 C ATOM 0 H VAL A 315 8.711 31.628 106.853 1.00 6.04 H new ATOM 0 HA VAL A 315 9.592 32.260 109.369 1.00 7.04 H new ATOM 0 HB VAL A 315 10.418 33.613 107.042 1.00 6.68 H new ATOM 0 HG11 VAL A 315 11.504 35.146 108.468 1.00 9.99 H new ATOM 0 HG12 VAL A 315 9.940 35.192 108.718 1.00 9.99 H new ATOM 0 HG13 VAL A 315 10.881 34.414 109.727 1.00 9.99 H new ATOM 0 HG21 VAL A 315 12.595 33.020 107.762 1.00 8.33 H new ATOM 0 HG22 VAL A 315 11.973 32.264 109.007 1.00 8.33 H new ATOM 0 HG23 VAL A 315 11.730 31.712 107.542 1.00 8.33 H new ATOM 2459 N PHE A 316 7.347 33.347 109.604 1.00 10.80 N ATOM 2460 CA PHE A 316 6.068 34.046 109.812 1.00 13.09 C ATOM 2461 C PHE A 316 5.061 33.851 108.676 1.00 12.43 C ATOM 2462 O PHE A 316 4.692 34.804 107.974 1.00 12.21 O ATOM 2463 CB PHE A 316 6.296 35.538 110.067 1.00 13.55 C ATOM 2464 CG PHE A 316 5.121 36.220 110.727 1.00 14.41 C ATOM 2465 CD1 PHE A 316 4.287 37.077 110.007 1.00 13.80 C ATOM 2466 CD2 PHE A 316 4.826 35.971 112.066 1.00 15.02 C ATOM 2467 CE1 PHE A 316 3.173 37.676 110.614 1.00 15.18 C ATOM 2468 CE2 PHE A 316 3.719 36.561 112.684 1.00 15.26 C ATOM 2469 CZ PHE A 316 2.889 37.417 111.954 1.00 15.95 C ATOM 0 H PHE A 316 7.589 32.883 110.286 1.00 10.80 H new ATOM 0 HA PHE A 316 5.673 33.637 110.598 1.00 13.09 H new ATOM 0 HB2 PHE A 316 7.081 35.647 110.626 1.00 13.55 H new ATOM 0 HB3 PHE A 316 6.485 35.978 109.224 1.00 13.55 H new ATOM 0 HD1 PHE A 316 4.472 37.253 109.113 1.00 13.80 H new ATOM 0 HD2 PHE A 316 5.375 35.403 112.557 1.00 15.02 H new ATOM 0 HE1 PHE A 316 2.625 38.245 110.123 1.00 15.18 H new ATOM 0 HE2 PHE A 316 3.535 36.384 113.578 1.00 15.26 H new ATOM 0 HZ PHE A 316 2.151 37.812 112.360 1.00 15.95 H new ATOM 2470 N ASP A 317 4.611 32.611 108.489 1.00 13.31 N ATOM 2471 CA ASP A 317 3.658 32.295 107.426 1.00 13.59 C ATOM 2472 C ASP A 317 2.604 31.283 107.932 1.00 12.13 C ATOM 2473 O ASP A 317 2.580 30.976 109.125 1.00 12.06 O ATOM 2474 CB ASP A 317 4.430 31.823 106.167 1.00 12.21 C ATOM 2475 CG ASP A 317 4.894 30.382 106.226 1.00 11.53 C ATOM 2476 OD1 ASP A 317 5.592 29.962 105.277 1.00 12.86 O ATOM 2477 OD2 ASP A 317 4.563 29.651 107.188 1.00 12.10 O ATOM 0 H ASP A 317 4.846 31.937 108.968 1.00 13.31 H new ATOM 0 HA ASP A 317 3.159 33.086 107.168 1.00 13.59 H new ATOM 0 HB2 ASP A 317 3.861 31.937 105.390 1.00 12.21 H new ATOM 0 HB3 ASP A 317 5.202 32.396 106.040 1.00 12.21 H new ATOM 2478 N PRO A 318 1.717 30.762 107.054 1.00 11.90 N ATOM 2479 CA PRO A 318 0.695 29.805 107.515 1.00 12.01 C ATOM 2480 C PRO A 318 1.164 28.589 108.310 1.00 12.21 C ATOM 2481 O PRO A 318 0.409 28.056 109.134 1.00 13.18 O ATOM 2482 CB PRO A 318 -0.001 29.388 106.222 1.00 12.99 C ATOM 2483 CG PRO A 318 0.106 30.614 105.381 1.00 13.71 C ATOM 2484 CD PRO A 318 1.529 31.064 105.622 1.00 13.18 C ATOM 0 HA PRO A 318 0.132 30.239 108.175 1.00 12.01 H new ATOM 0 HB2 PRO A 318 0.435 28.627 105.807 1.00 12.99 H new ATOM 0 HB3 PRO A 318 -0.925 29.136 106.375 1.00 12.99 H new ATOM 0 HG2 PRO A 318 -0.057 30.423 104.444 1.00 13.71 H new ATOM 0 HG3 PRO A 318 -0.535 31.291 105.648 1.00 13.71 H new ATOM 0 HD2 PRO A 318 2.160 30.582 105.065 1.00 13.18 H new ATOM 0 HD3 PRO A 318 1.647 32.008 105.433 1.00 13.18 H new ATOM 2485 N TRP A 319 2.396 28.147 108.063 1.00 11.17 N ATOM 2486 CA TRP A 319 2.933 26.983 108.737 1.00 11.12 C ATOM 2487 C TRP A 319 3.876 27.293 109.904 1.00 11.68 C ATOM 2488 O TRP A 319 4.333 26.355 110.557 1.00 12.06 O ATOM 2489 CB TRP A 319 3.642 26.095 107.705 1.00 11.54 C ATOM 2490 CG TRP A 319 2.745 25.684 106.564 1.00 10.71 C ATOM 2491 CD1 TRP A 319 1.873 24.628 106.540 1.00 11.75 C ATOM 2492 CD2 TRP A 319 2.588 26.361 105.312 1.00 9.96 C ATOM 2493 NE1 TRP A 319 1.182 24.609 105.348 1.00 10.40 N ATOM 2494 CE2 TRP A 319 1.602 25.662 104.577 1.00 10.75 C ATOM 2495 CE3 TRP A 319 3.187 27.495 104.736 1.00 11.37 C ATOM 2496 CZ2 TRP A 319 1.199 26.059 103.292 1.00 11.59 C ATOM 2497 CZ3 TRP A 319 2.787 27.891 103.458 1.00 11.67 C ATOM 2498 CH2 TRP A 319 1.800 27.171 102.752 1.00 12.57 C ATOM 0 H TRP A 319 2.936 28.515 107.503 1.00 11.17 H new ATOM 0 HA TRP A 319 2.178 26.526 109.139 1.00 11.12 H new ATOM 0 HB2 TRP A 319 4.410 26.570 107.351 1.00 11.54 H new ATOM 0 HB3 TRP A 319 3.979 25.300 108.147 1.00 11.54 H new ATOM 0 HD1 TRP A 319 1.763 24.013 107.229 1.00 11.75 H new ATOM 0 HE1 TRP A 319 0.585 24.031 105.124 1.00 10.40 H new ATOM 0 HE3 TRP A 319 3.838 27.973 105.198 1.00 11.37 H new ATOM 0 HZ2 TRP A 319 0.549 25.587 102.823 1.00 11.59 H new ATOM 0 HZ3 TRP A 319 3.176 28.639 103.067 1.00 11.67 H new ATOM 0 HH2 TRP A 319 1.551 27.455 101.902 1.00 12.57 H new ATOM 2499 N TYR A 320 4.165 28.573 110.180 1.00 9.76 N ATOM 2500 CA TYR A 320 5.094 28.913 111.275 1.00 8.72 C ATOM 2501 C TYR A 320 5.021 30.384 111.660 1.00 9.23 C ATOM 2502 O TYR A 320 5.457 31.260 110.913 1.00 9.19 O ATOM 2503 CB TYR A 320 6.523 28.571 110.860 1.00 7.22 C ATOM 2504 CG TYR A 320 7.500 28.578 112.009 1.00 6.27 C ATOM 2505 CD1 TYR A 320 8.518 29.525 112.083 1.00 5.69 C ATOM 2506 CD2 TYR A 320 7.410 27.626 113.022 1.00 7.02 C ATOM 2507 CE1 TYR A 320 9.425 29.524 113.140 1.00 5.24 C ATOM 2508 CE2 TYR A 320 8.309 27.615 114.085 1.00 6.35 C ATOM 2509 CZ TYR A 320 9.312 28.565 114.137 1.00 5.67 C ATOM 2510 OH TYR A 320 10.199 28.569 115.185 1.00 6.13 O ATOM 0 H TYR A 320 3.842 29.248 109.756 1.00 9.76 H new ATOM 0 HA TYR A 320 4.831 28.392 112.050 1.00 8.72 H new ATOM 0 HB2 TYR A 320 6.531 27.695 110.443 1.00 7.22 H new ATOM 0 HB3 TYR A 320 6.819 29.207 110.189 1.00 7.22 H new ATOM 0 HD1 TYR A 320 8.594 30.169 111.416 1.00 5.69 H new ATOM 0 HD2 TYR A 320 6.737 26.986 112.988 1.00 7.02 H new ATOM 0 HE1 TYR A 320 10.101 30.161 113.177 1.00 5.24 H new ATOM 0 HE2 TYR A 320 8.235 26.974 114.755 1.00 6.35 H new ATOM 0 HH TYR A 320 10.015 27.940 115.710 1.00 6.13 H new ATOM 2511 N PRO A 321 4.528 30.672 112.872 1.00 10.10 N ATOM 2512 CA PRO A 321 4.377 32.035 113.374 1.00 10.38 C ATOM 2513 C PRO A 321 5.602 32.755 113.901 1.00 11.04 C ATOM 2514 O PRO A 321 5.484 33.891 114.355 1.00 14.23 O ATOM 2515 CB PRO A 321 3.324 31.863 114.466 1.00 11.73 C ATOM 2516 CG PRO A 321 3.731 30.552 115.070 1.00 11.58 C ATOM 2517 CD PRO A 321 4.024 29.690 113.852 1.00 10.70 C ATOM 0 HA PRO A 321 4.149 32.621 112.636 1.00 10.38 H new ATOM 0 HB2 PRO A 321 3.347 32.586 115.113 1.00 11.73 H new ATOM 0 HB3 PRO A 321 2.424 31.835 114.104 1.00 11.73 H new ATOM 0 HG2 PRO A 321 4.511 30.646 115.640 1.00 11.58 H new ATOM 0 HG3 PRO A 321 3.024 30.173 115.616 1.00 11.58 H new ATOM 0 HD2 PRO A 321 4.682 29.004 114.046 1.00 10.70 H new ATOM 0 HD3 PRO A 321 3.228 29.237 113.531 1.00 10.70 H new ATOM 2518 N LEU A 322 6.774 32.125 113.839 1.00 9.09 N ATOM 2519 CA LEU A 322 7.989 32.733 114.376 1.00 7.96 C ATOM 2520 C LEU A 322 9.134 32.815 113.364 1.00 7.23 C ATOM 2521 O LEU A 322 8.900 32.722 112.159 1.00 7.93 O ATOM 2522 CB LEU A 322 8.427 31.928 115.614 1.00 7.32 C ATOM 2523 CG LEU A 322 7.449 31.981 116.792 1.00 6.63 C ATOM 2524 CD1 LEU A 322 7.854 30.973 117.855 1.00 8.17 C ATOM 2525 CD2 LEU A 322 7.440 33.392 117.379 1.00 7.73 C ATOM 0 H LEU A 322 6.886 31.347 113.491 1.00 9.09 H new ATOM 0 HA LEU A 322 7.781 33.651 114.610 1.00 7.96 H new ATOM 0 HB2 LEU A 322 8.552 31.002 115.355 1.00 7.32 H new ATOM 0 HB3 LEU A 322 9.290 32.258 115.911 1.00 7.32 H new ATOM 0 HG LEU A 322 6.558 31.758 116.480 1.00 6.63 H new ATOM 0 HD11 LEU A 322 7.229 31.015 118.596 1.00 8.17 H new ATOM 0 HD12 LEU A 322 7.845 30.081 117.475 1.00 8.17 H new ATOM 0 HD13 LEU A 322 8.747 31.180 118.174 1.00 8.17 H new ATOM 0 HD21 LEU A 322 6.821 33.428 118.125 1.00 7.73 H new ATOM 0 HD22 LEU A 322 8.331 33.620 117.687 1.00 7.73 H new ATOM 0 HD23 LEU A 322 7.162 34.024 116.698 1.00 7.73 H new ATOM 2526 N GLY A 323 10.351 33.012 113.875 1.00 7.12 N ATOM 2527 CA GLY A 323 11.551 33.056 113.052 1.00 7.75 C ATOM 2528 C GLY A 323 12.234 34.379 112.745 1.00 7.25 C ATOM 2529 O GLY A 323 11.589 35.429 112.638 1.00 8.54 O ATOM 0 H GLY A 323 10.500 33.124 114.715 1.00 7.12 H new ATOM 0 HA2 GLY A 323 12.210 32.487 113.478 1.00 7.75 H new ATOM 0 HA3 GLY A 323 11.329 32.645 112.202 1.00 7.75 H new ATOM 2530 N THR A 324 13.562 34.318 112.649 1.00 6.80 N ATOM 2531 CA THR A 324 14.382 35.459 112.229 1.00 6.22 C ATOM 2532 C THR A 324 15.340 34.941 111.135 1.00 7.05 C ATOM 2533 O THR A 324 16.355 35.566 110.831 1.00 7.11 O ATOM 2534 CB THR A 324 15.194 36.094 113.385 1.00 7.23 C ATOM 2535 OG1 THR A 324 15.961 35.082 114.047 1.00 7.85 O ATOM 2536 CG2 THR A 324 14.275 36.803 114.364 1.00 7.71 C ATOM 0 H THR A 324 14.017 33.610 112.826 1.00 6.80 H new ATOM 0 HA THR A 324 13.797 36.162 111.905 1.00 6.22 H new ATOM 0 HB THR A 324 15.800 36.757 113.017 1.00 7.23 H new ATOM 0 HG1 THR A 324 16.777 35.277 114.006 1.00 7.85 H new ATOM 0 HG21 THR A 324 14.802 37.193 115.079 1.00 7.71 H new ATOM 0 HG22 THR A 324 13.789 37.504 113.902 1.00 7.71 H new ATOM 0 HG23 THR A 324 13.646 36.166 114.737 1.00 7.71 H new ATOM 2537 N ALA A 325 14.986 33.800 110.533 1.00 6.78 N ATOM 2538 CA ALA A 325 15.780 33.160 109.472 1.00 6.55 C ATOM 2539 C ALA A 325 17.202 32.851 109.945 1.00 7.72 C ATOM 2540 O ALA A 325 18.167 33.013 109.201 1.00 9.14 O ATOM 2541 CB ALA A 325 15.821 34.056 108.216 1.00 6.66 C ATOM 0 H ALA A 325 14.268 33.369 110.731 1.00 6.78 H new ATOM 0 HA ALA A 325 15.350 32.320 109.249 1.00 6.55 H new ATOM 0 HB1 ALA A 325 16.347 33.622 107.526 1.00 6.66 H new ATOM 0 HB2 ALA A 325 14.918 34.200 107.891 1.00 6.66 H new ATOM 0 HB3 ALA A 325 16.224 34.910 108.440 1.00 6.66 H new ATOM 2542 N ASN A 326 17.311 32.359 111.177 1.00 6.96 N ATOM 2543 CA ASN A 326 18.599 32.071 111.810 1.00 7.30 C ATOM 2544 C ASN A 326 18.934 30.572 111.791 1.00 6.25 C ATOM 2545 O ASN A 326 18.288 29.771 112.482 1.00 6.38 O ATOM 2546 CB ASN A 326 18.530 32.599 113.248 1.00 9.07 C ATOM 2547 CG ASN A 326 19.851 32.530 113.965 1.00 13.44 C ATOM 2548 OD1 ASN A 326 20.437 31.461 114.114 1.00 13.18 O ATOM 2549 ND2 ASN A 326 20.331 33.681 114.422 1.00 17.46 N ATOM 0 H ASN A 326 16.633 32.181 111.675 1.00 6.96 H new ATOM 0 HA ASN A 326 19.309 32.508 111.315 1.00 7.30 H new ATOM 0 HB2 ASN A 326 18.223 33.519 113.235 1.00 9.07 H new ATOM 0 HB3 ASN A 326 17.872 32.087 113.744 1.00 9.07 H new ATOM 0 HD21 ASN A 326 21.081 33.698 114.842 1.00 17.46 H new ATOM 0 HD22 ASN A 326 19.891 34.410 114.298 1.00 17.46 H new ATOM 2550 N MET A 327 19.964 30.189 111.034 1.00 5.90 N ATOM 2551 CA MET A 327 20.289 28.767 110.923 1.00 5.70 C ATOM 2552 C MET A 327 20.822 28.120 112.204 1.00 5.42 C ATOM 2553 O MET A 327 20.559 26.933 112.440 1.00 5.20 O ATOM 2554 CB MET A 327 21.244 28.514 109.750 1.00 5.64 C ATOM 2555 CG MET A 327 20.732 29.034 108.387 1.00 6.48 C ATOM 2556 SD MET A 327 18.968 28.724 108.014 1.00 6.99 S ATOM 2557 CE MET A 327 18.929 26.940 107.836 1.00 7.12 C ATOM 0 H MET A 327 20.474 30.720 110.589 1.00 5.90 H new ATOM 0 HA MET A 327 19.439 28.331 110.755 1.00 5.70 H new ATOM 0 HB2 MET A 327 22.096 28.934 109.945 1.00 5.64 H new ATOM 0 HB3 MET A 327 21.407 27.560 109.680 1.00 5.64 H new ATOM 0 HG2 MET A 327 20.888 29.991 108.348 1.00 6.48 H new ATOM 0 HG3 MET A 327 21.267 28.630 107.686 1.00 6.48 H new ATOM 0 HE1 MET A 327 18.025 26.655 107.633 1.00 7.12 H new ATOM 0 HE2 MET A 327 19.521 26.673 107.116 1.00 7.12 H new ATOM 0 HE3 MET A 327 19.220 26.526 108.663 1.00 7.12 H new ATOM 2558 N LEU A 328 21.556 28.862 113.035 1.00 5.69 N ATOM 2559 CA LEU A 328 22.025 28.284 114.302 1.00 5.78 C ATOM 2560 C LEU A 328 20.830 27.963 115.211 1.00 5.71 C ATOM 2561 O LEU A 328 20.902 27.048 116.038 1.00 5.68 O ATOM 2562 CB LEU A 328 23.006 29.223 115.024 1.00 5.85 C ATOM 2563 CG LEU A 328 24.445 29.210 114.473 1.00 6.85 C ATOM 2564 CD1 LEU A 328 25.270 30.293 115.183 1.00 8.28 C ATOM 2565 CD2 LEU A 328 25.095 27.835 114.676 1.00 8.30 C ATOM 0 H LEU A 328 21.789 29.678 112.893 1.00 5.69 H new ATOM 0 HA LEU A 328 22.500 27.463 114.096 1.00 5.78 H new ATOM 0 HB2 LEU A 328 22.663 30.129 114.973 1.00 5.85 H new ATOM 0 HB3 LEU A 328 23.031 28.982 115.963 1.00 5.85 H new ATOM 0 HG LEU A 328 24.418 29.392 113.521 1.00 6.85 H new ATOM 0 HD11 LEU A 328 26.177 30.287 114.838 1.00 8.28 H new ATOM 0 HD12 LEU A 328 24.869 31.162 115.024 1.00 8.28 H new ATOM 0 HD13 LEU A 328 25.286 30.115 116.136 1.00 8.28 H new ATOM 0 HD21 LEU A 328 25.998 27.849 114.323 1.00 8.30 H new ATOM 0 HD22 LEU A 328 25.121 27.626 115.623 1.00 8.30 H new ATOM 0 HD23 LEU A 328 24.577 27.160 114.211 1.00 8.30 H new ATOM 2566 N GLN A 329 19.735 28.709 115.063 1.00 5.47 N ATOM 2567 CA GLN A 329 18.531 28.468 115.856 1.00 5.15 C ATOM 2568 C GLN A 329 17.822 27.205 115.337 1.00 5.27 C ATOM 2569 O GLN A 329 17.312 26.397 116.126 1.00 5.16 O ATOM 2570 CB GLN A 329 17.617 29.683 115.778 1.00 5.66 C ATOM 2571 CG GLN A 329 16.423 29.637 116.705 1.00 7.12 C ATOM 2572 CD GLN A 329 15.629 30.905 116.589 1.00 7.18 C ATOM 2573 OE1 GLN A 329 14.759 31.028 115.734 1.00 7.73 O ATOM 2574 NE2 GLN A 329 15.952 31.880 117.426 1.00 8.06 N ATOM 0 H GLN A 329 19.670 29.362 114.507 1.00 5.47 H new ATOM 0 HA GLN A 329 18.768 28.326 116.786 1.00 5.15 H new ATOM 0 HB2 GLN A 329 18.137 30.477 115.979 1.00 5.66 H new ATOM 0 HB3 GLN A 329 17.300 29.776 114.866 1.00 5.66 H new ATOM 0 HG2 GLN A 329 15.863 28.876 116.485 1.00 7.12 H new ATOM 0 HG3 GLN A 329 16.720 29.516 117.620 1.00 7.12 H new ATOM 0 HE21 GLN A 329 16.568 31.756 118.013 1.00 8.06 H new ATOM 0 HE22 GLN A 329 15.545 32.637 117.382 1.00 8.06 H new ATOM 2575 N VAL A 330 17.788 27.038 114.018 1.00 4.73 N ATOM 2576 CA VAL A 330 17.214 25.843 113.406 1.00 5.56 C ATOM 2577 C VAL A 330 18.035 24.638 113.897 1.00 5.13 C ATOM 2578 O VAL A 330 17.478 23.624 114.323 1.00 5.39 O ATOM 2579 CB VAL A 330 17.299 25.915 111.856 1.00 5.73 C ATOM 2580 CG1 VAL A 330 16.821 24.600 111.246 1.00 6.55 C ATOM 2581 CG2 VAL A 330 16.446 27.070 111.330 1.00 6.19 C ATOM 0 H VAL A 330 18.095 27.611 113.455 1.00 4.73 H new ATOM 0 HA VAL A 330 16.279 25.765 113.653 1.00 5.56 H new ATOM 0 HB VAL A 330 18.223 26.067 111.603 1.00 5.73 H new ATOM 0 HG11 VAL A 330 16.877 24.652 110.279 1.00 6.55 H new ATOM 0 HG12 VAL A 330 17.381 23.874 111.563 1.00 6.55 H new ATOM 0 HG13 VAL A 330 15.901 24.437 111.508 1.00 6.55 H new ATOM 0 HG21 VAL A 330 16.508 27.104 110.363 1.00 6.19 H new ATOM 0 HG22 VAL A 330 15.521 26.934 111.590 1.00 6.19 H new ATOM 0 HG23 VAL A 330 16.767 27.906 111.703 1.00 6.19 H new ATOM 2582 N LEU A 331 19.364 24.756 113.835 1.00 4.72 N ATOM 2583 CA LEU A 331 20.255 23.684 114.271 1.00 4.80 C ATOM 2584 C LEU A 331 20.011 23.321 115.741 1.00 4.15 C ATOM 2585 O LEU A 331 19.902 22.142 116.087 1.00 4.69 O ATOM 2586 CB LEU A 331 21.714 24.101 114.046 1.00 5.40 C ATOM 2587 CG LEU A 331 22.768 23.104 114.544 1.00 5.19 C ATOM 2588 CD1 LEU A 331 22.614 21.757 113.845 1.00 5.78 C ATOM 2589 CD2 LEU A 331 24.164 23.674 114.284 1.00 6.50 C ATOM 0 H LEU A 331 19.769 25.455 113.541 1.00 4.72 H new ATOM 0 HA LEU A 331 20.068 22.892 113.743 1.00 4.80 H new ATOM 0 HB2 LEU A 331 21.850 24.245 113.097 1.00 5.40 H new ATOM 0 HB3 LEU A 331 21.863 24.952 114.486 1.00 5.40 H new ATOM 0 HG LEU A 331 22.644 22.965 115.496 1.00 5.19 H new ATOM 0 HD11 LEU A 331 23.289 21.143 114.174 1.00 5.78 H new ATOM 0 HD12 LEU A 331 21.732 21.396 114.028 1.00 5.78 H new ATOM 0 HD13 LEU A 331 22.723 21.874 112.888 1.00 5.78 H new ATOM 0 HD21 LEU A 331 24.834 23.046 114.598 1.00 6.50 H new ATOM 0 HD22 LEU A 331 24.281 23.822 113.333 1.00 6.50 H new ATOM 0 HD23 LEU A 331 24.263 24.515 114.757 1.00 6.50 H new ATOM 2590 N HIS A 332 19.914 24.330 116.599 1.00 5.09 N ATOM 2591 CA HIS A 332 19.659 24.113 118.020 1.00 5.20 C ATOM 2592 C HIS A 332 18.398 23.255 118.218 1.00 5.68 C ATOM 2593 O HIS A 332 18.412 22.274 118.972 1.00 4.99 O ATOM 2594 CB HIS A 332 19.545 25.489 118.699 1.00 6.04 C ATOM 2595 CG HIS A 332 19.178 25.446 120.147 1.00 5.40 C ATOM 2596 ND1 HIS A 332 17.875 25.316 120.581 1.00 6.29 N ATOM 2597 CD2 HIS A 332 19.934 25.603 121.260 1.00 6.76 C ATOM 2598 CE1 HIS A 332 17.843 25.402 121.900 1.00 6.40 C ATOM 2599 NE2 HIS A 332 19.079 25.578 122.338 1.00 6.53 N ATOM 0 H HIS A 332 19.994 25.157 116.376 1.00 5.09 H new ATOM 0 HA HIS A 332 20.388 23.621 118.429 1.00 5.20 H new ATOM 0 HB2 HIS A 332 20.392 25.952 118.607 1.00 6.04 H new ATOM 0 HB3 HIS A 332 18.881 26.015 118.226 1.00 6.04 H new ATOM 0 HD2 HIS A 332 20.858 25.708 121.290 1.00 6.76 H new ATOM 0 HE1 HIS A 332 17.081 25.348 122.430 1.00 6.40 H new ATOM 0 HE2 HIS A 332 19.310 25.663 123.162 1.00 6.53 H new ATOM 2600 N MET A 333 17.311 23.598 117.538 1.00 5.24 N ATOM 2601 CA MET A 333 16.084 22.817 117.699 1.00 4.40 C ATOM 2602 C MET A 333 16.281 21.382 117.218 1.00 4.43 C ATOM 2603 O MET A 333 15.874 20.430 117.889 1.00 5.37 O ATOM 2604 CB MET A 333 14.927 23.466 116.929 1.00 5.63 C ATOM 2605 CG MET A 333 13.590 22.742 117.077 1.00 5.74 C ATOM 2606 SD MET A 333 12.940 22.675 118.772 1.00 5.31 S ATOM 2607 CE MET A 333 12.634 24.457 119.079 1.00 6.56 C ATOM 0 H MET A 333 17.258 24.260 116.992 1.00 5.24 H new ATOM 0 HA MET A 333 15.867 22.800 118.644 1.00 4.40 H new ATOM 0 HB2 MET A 333 14.823 24.381 117.233 1.00 5.63 H new ATOM 0 HB3 MET A 333 15.160 23.505 115.988 1.00 5.63 H new ATOM 0 HG2 MET A 333 12.936 23.180 116.511 1.00 5.74 H new ATOM 0 HG3 MET A 333 13.690 21.835 116.747 1.00 5.74 H new ATOM 0 HE1 MET A 333 12.092 24.560 119.877 1.00 6.56 H new ATOM 0 HE2 MET A 333 13.480 24.914 119.202 1.00 6.56 H new ATOM 0 HE3 MET A 333 12.167 24.841 118.320 1.00 6.56 H new ATOM 2608 N GLY A 334 16.905 21.217 116.054 1.00 4.36 N ATOM 2609 CA GLY A 334 17.126 19.880 115.515 1.00 5.00 C ATOM 2610 C GLY A 334 17.979 18.992 116.404 1.00 4.59 C ATOM 2611 O GLY A 334 17.697 17.802 116.566 1.00 5.69 O ATOM 0 H GLY A 334 17.205 21.859 115.566 1.00 4.36 H new ATOM 0 HA2 GLY A 334 16.267 19.452 115.374 1.00 5.00 H new ATOM 0 HA3 GLY A 334 17.551 19.957 114.646 1.00 5.00 H new ATOM 2612 N LEU A 335 19.032 19.549 116.991 1.00 4.82 N ATOM 2613 CA LEU A 335 19.885 18.733 117.857 1.00 4.68 C ATOM 2614 C LEU A 335 19.119 18.229 119.075 1.00 4.98 C ATOM 2615 O LEU A 335 19.323 17.088 119.514 1.00 5.54 O ATOM 2616 CB LEU A 335 21.120 19.522 118.299 1.00 5.14 C ATOM 2617 CG LEU A 335 22.086 19.946 117.186 1.00 5.65 C ATOM 2618 CD1 LEU A 335 23.121 20.906 117.769 1.00 6.80 C ATOM 2619 CD2 LEU A 335 22.760 18.726 116.569 1.00 6.80 C ATOM 0 H LEU A 335 19.268 20.372 116.907 1.00 4.82 H new ATOM 0 HA LEU A 335 20.174 17.963 117.342 1.00 4.68 H new ATOM 0 HB2 LEU A 335 20.822 20.319 118.764 1.00 5.14 H new ATOM 0 HB3 LEU A 335 21.611 18.986 118.941 1.00 5.14 H new ATOM 0 HG LEU A 335 21.594 20.396 116.481 1.00 5.65 H new ATOM 0 HD11 LEU A 335 23.737 21.180 117.072 1.00 6.80 H new ATOM 0 HD12 LEU A 335 22.672 21.687 118.128 1.00 6.80 H new ATOM 0 HD13 LEU A 335 23.612 20.461 118.478 1.00 6.80 H new ATOM 0 HD21 LEU A 335 23.367 19.011 115.868 1.00 6.80 H new ATOM 0 HD22 LEU A 335 23.257 18.250 117.253 1.00 6.80 H new ATOM 0 HD23 LEU A 335 22.085 18.139 116.193 1.00 6.80 H new ATOM 2620 N HIS A 336 18.234 19.061 119.622 1.00 4.78 N ATOM 2621 CA HIS A 336 17.437 18.671 120.781 1.00 5.20 C ATOM 2622 C HIS A 336 16.385 17.621 120.428 1.00 5.06 C ATOM 2623 O HIS A 336 16.303 16.557 121.053 1.00 5.44 O ATOM 2624 CB HIS A 336 16.722 19.887 121.391 1.00 5.67 C ATOM 2625 CG HIS A 336 17.609 20.770 122.220 1.00 5.10 C ATOM 2626 ND1 HIS A 336 18.512 21.655 121.666 1.00 5.92 N ATOM 2627 CD2 HIS A 336 17.729 20.903 123.563 1.00 5.32 C ATOM 2628 CE1 HIS A 336 19.151 22.293 122.635 1.00 6.15 C ATOM 2629 NE2 HIS A 336 18.695 21.854 123.795 1.00 6.15 N ATOM 0 H HIS A 336 18.081 19.857 119.335 1.00 4.78 H new ATOM 0 HA HIS A 336 18.058 18.292 121.423 1.00 5.20 H new ATOM 0 HB2 HIS A 336 16.335 20.415 120.675 1.00 5.67 H new ATOM 0 HB3 HIS A 336 15.987 19.575 121.942 1.00 5.67 H new ATOM 0 HD1 HIS A 336 18.640 21.774 120.824 1.00 5.92 H new ATOM 0 HD2 HIS A 336 17.247 20.438 124.208 1.00 5.32 H new ATOM 0 HE1 HIS A 336 19.809 22.940 122.519 1.00 6.15 H new ATOM 2630 N VAL A 337 15.582 17.902 119.410 1.00 5.10 N ATOM 2631 CA VAL A 337 14.516 16.976 119.063 1.00 6.13 C ATOM 2632 C VAL A 337 15.023 15.633 118.538 1.00 6.18 C ATOM 2633 O VAL A 337 14.424 14.587 118.827 1.00 7.60 O ATOM 2634 CB VAL A 337 13.540 17.629 118.073 1.00 5.93 C ATOM 2635 CG1 VAL A 337 12.483 16.632 117.652 1.00 9.49 C ATOM 2636 CG2 VAL A 337 12.893 18.850 118.725 1.00 6.01 C ATOM 0 H VAL A 337 15.635 18.606 118.919 1.00 5.10 H new ATOM 0 HA VAL A 337 14.044 16.775 119.886 1.00 6.13 H new ATOM 0 HB VAL A 337 14.025 17.913 117.283 1.00 5.93 H new ATOM 0 HG11 VAL A 337 11.872 17.053 117.027 1.00 9.49 H new ATOM 0 HG12 VAL A 337 12.907 15.871 117.226 1.00 9.49 H new ATOM 0 HG13 VAL A 337 11.991 16.332 118.433 1.00 9.49 H new ATOM 0 HG21 VAL A 337 12.277 19.262 118.100 1.00 6.01 H new ATOM 0 HG22 VAL A 337 12.410 18.575 119.520 1.00 6.01 H new ATOM 0 HG23 VAL A 337 13.581 19.489 118.970 1.00 6.01 H new ATOM 2637 N CYS A 338 16.137 15.654 117.806 1.00 5.49 N ATOM 2638 CA CYS A 338 16.728 14.427 117.260 1.00 6.17 C ATOM 2639 C CYS A 338 17.680 13.754 118.251 1.00 6.68 C ATOM 2640 O CYS A 338 18.260 12.707 117.949 1.00 7.88 O ATOM 2641 CB CYS A 338 17.496 14.734 115.965 1.00 6.19 C ATOM 2642 SG CYS A 338 16.484 15.404 114.637 1.00 7.94 S ATOM 0 H CYS A 338 16.569 16.372 117.612 1.00 5.49 H new ATOM 0 HA CYS A 338 15.994 13.819 117.079 1.00 6.17 H new ATOM 0 HB2 CYS A 338 18.205 15.365 116.165 1.00 6.19 H new ATOM 0 HB3 CYS A 338 17.920 13.919 115.653 1.00 6.19 H new ATOM 0 HG CYS A 338 17.171 15.611 113.675 1.00 7.94 H new ATOM 2643 N GLN A 339 17.863 14.360 119.419 1.00 6.72 N ATOM 2644 CA GLN A 339 18.748 13.823 120.447 1.00 7.03 C ATOM 2645 C GLN A 339 20.193 13.598 119.989 1.00 7.24 C ATOM 2646 O GLN A 339 20.829 12.582 120.301 1.00 8.62 O ATOM 2647 CB GLN A 339 18.131 12.550 121.062 1.00 6.84 C ATOM 2648 CG GLN A 339 16.861 12.902 121.856 1.00 7.25 C ATOM 2649 CD GLN A 339 16.127 11.714 122.423 1.00 7.76 C ATOM 2650 OE1 GLN A 339 16.175 10.607 121.875 1.00 11.33 O ATOM 2651 NE2 GLN A 339 15.408 11.943 123.517 1.00 7.75 N ATOM 0 H GLN A 339 17.477 15.096 119.639 1.00 6.72 H new ATOM 0 HA GLN A 339 18.820 14.507 121.131 1.00 7.03 H new ATOM 0 HB2 GLN A 339 17.916 11.916 120.360 1.00 6.84 H new ATOM 0 HB3 GLN A 339 18.776 12.120 121.645 1.00 6.84 H new ATOM 0 HG2 GLN A 339 17.103 13.496 122.584 1.00 7.25 H new ATOM 0 HG3 GLN A 339 16.258 13.394 121.277 1.00 7.25 H new ATOM 0 HE21 GLN A 339 15.400 12.727 123.870 1.00 7.75 H new ATOM 0 HE22 GLN A 339 14.951 11.307 123.872 1.00 7.75 H new ATOM 2652 N LEU A 340 20.702 14.577 119.242 1.00 6.97 N ATOM 2653 CA LEU A 340 22.092 14.587 118.773 1.00 6.68 C ATOM 2654 C LEU A 340 22.760 15.507 119.791 1.00 7.18 C ATOM 2655 O LEU A 340 23.233 16.608 119.476 1.00 7.69 O ATOM 2656 CB LEU A 340 22.159 15.163 117.356 1.00 7.00 C ATOM 2657 CG LEU A 340 21.705 14.181 116.265 1.00 7.98 C ATOM 2658 CD1 LEU A 340 21.351 14.920 114.975 1.00 9.19 C ATOM 2659 CD2 LEU A 340 22.823 13.162 116.025 1.00 8.91 C ATOM 0 H LEU A 340 20.247 15.262 118.990 1.00 6.97 H new ATOM 0 HA LEU A 340 22.511 13.714 118.718 1.00 6.68 H new ATOM 0 HB2 LEU A 340 21.606 15.959 117.313 1.00 7.00 H new ATOM 0 HB3 LEU A 340 23.070 15.440 117.171 1.00 7.00 H new ATOM 0 HG LEU A 340 20.904 13.719 116.558 1.00 7.98 H new ATOM 0 HD11 LEU A 340 21.068 14.281 114.303 1.00 9.19 H new ATOM 0 HD12 LEU A 340 20.631 15.547 115.148 1.00 9.19 H new ATOM 0 HD13 LEU A 340 22.129 15.403 114.654 1.00 9.19 H new ATOM 0 HD21 LEU A 340 22.548 12.536 115.337 1.00 8.91 H new ATOM 0 HD22 LEU A 340 23.626 13.624 115.738 1.00 8.91 H new ATOM 0 HD23 LEU A 340 23.004 12.680 116.847 1.00 8.91 H new ATOM 2660 N MET A 341 22.803 15.029 121.032 1.00 7.18 N ATOM 2661 CA MET A 341 23.295 15.831 122.136 1.00 7.55 C ATOM 2662 C MET A 341 24.640 15.454 122.731 1.00 8.27 C ATOM 2663 O MET A 341 25.012 15.973 123.782 1.00 9.18 O ATOM 2664 CB MET A 341 22.204 15.879 123.215 1.00 7.99 C ATOM 2665 CG MET A 341 20.902 16.562 122.727 1.00 7.93 C ATOM 2666 SD MET A 341 21.011 18.368 122.533 1.00 7.76 S ATOM 2667 CE MET A 341 20.989 18.843 124.268 1.00 8.58 C ATOM 0 H MET A 341 22.549 14.237 121.252 1.00 7.18 H new ATOM 0 HA MET A 341 23.481 16.705 121.757 1.00 7.55 H new ATOM 0 HB2 MET A 341 22.001 14.975 123.503 1.00 7.99 H new ATOM 0 HB3 MET A 341 22.542 16.355 123.990 1.00 7.99 H new ATOM 0 HG2 MET A 341 20.648 16.173 121.876 1.00 7.93 H new ATOM 0 HG3 MET A 341 20.191 16.360 123.355 1.00 7.93 H new ATOM 0 HE1 MET A 341 20.380 19.588 124.392 1.00 8.58 H new ATOM 0 HE2 MET A 341 20.694 18.092 124.806 1.00 8.58 H new ATOM 0 HE3 MET A 341 21.881 19.106 124.543 1.00 8.58 H new ATOM 2668 N GLY A 342 25.361 14.556 122.064 1.00 8.58 N ATOM 2669 CA GLY A 342 26.701 14.225 122.526 1.00 9.67 C ATOM 2670 C GLY A 342 27.571 15.421 122.154 1.00 9.26 C ATOM 2671 O GLY A 342 27.244 16.160 121.216 1.00 9.04 O ATOM 0 H GLY A 342 25.100 14.138 121.360 1.00 8.58 H new ATOM 0 HA2 GLY A 342 26.711 14.071 123.484 1.00 9.67 H new ATOM 0 HA3 GLY A 342 27.025 13.414 122.104 1.00 9.67 H new ATOM 2672 N TYR A 343 28.681 15.631 122.855 1.00 9.67 N ATOM 2673 CA TYR A 343 29.534 16.775 122.556 1.00 8.91 C ATOM 2674 C TYR A 343 29.953 16.828 121.081 1.00 8.90 C ATOM 2675 O TYR A 343 29.828 17.873 120.422 1.00 8.21 O ATOM 2676 CB TYR A 343 30.787 16.769 123.445 1.00 10.69 C ATOM 2677 CG TYR A 343 31.683 17.948 123.173 1.00 12.94 C ATOM 2678 CD1 TYR A 343 31.466 19.174 123.795 1.00 14.86 C ATOM 2679 CD2 TYR A 343 32.706 17.856 122.231 1.00 14.91 C ATOM 2680 CE1 TYR A 343 32.245 20.283 123.482 1.00 16.10 C ATOM 2681 CE2 TYR A 343 33.488 18.956 121.910 1.00 16.93 C ATOM 2682 CZ TYR A 343 33.250 20.164 122.537 1.00 16.55 C ATOM 2683 OH TYR A 343 34.014 21.257 122.203 1.00 20.85 O ATOM 0 H TYR A 343 28.955 15.131 123.499 1.00 9.67 H new ATOM 0 HA TYR A 343 29.005 17.567 122.742 1.00 8.91 H new ATOM 0 HB2 TYR A 343 30.520 16.776 124.378 1.00 10.69 H new ATOM 0 HB3 TYR A 343 31.282 15.948 123.298 1.00 10.69 H new ATOM 0 HD1 TYR A 343 30.790 19.253 124.429 1.00 14.86 H new ATOM 0 HD2 TYR A 343 32.867 17.043 121.810 1.00 14.91 H new ATOM 0 HE1 TYR A 343 32.092 21.098 123.904 1.00 16.10 H new ATOM 0 HE2 TYR A 343 34.166 18.881 121.278 1.00 16.93 H new ATOM 0 HH TYR A 343 33.851 21.886 122.735 1.00 20.85 H new ATOM 2684 N GLY A 344 30.446 15.710 120.561 1.00 8.49 N ATOM 2685 CA GLY A 344 30.874 15.668 119.173 1.00 8.65 C ATOM 2686 C GLY A 344 29.735 15.879 118.192 1.00 8.57 C ATOM 2687 O GLY A 344 29.918 16.516 117.149 1.00 8.92 O ATOM 0 H GLY A 344 30.540 14.972 120.992 1.00 8.49 H new ATOM 0 HA2 GLY A 344 31.549 16.349 119.028 1.00 8.65 H new ATOM 0 HA3 GLY A 344 31.292 14.811 118.995 1.00 8.65 H new ATOM 2688 N GLN A 345 28.559 15.343 118.515 1.00 7.65 N ATOM 2689 CA GLN A 345 27.391 15.494 117.649 1.00 8.14 C ATOM 2690 C GLN A 345 26.990 16.966 117.562 1.00 7.66 C ATOM 2691 O GLN A 345 26.655 17.471 116.485 1.00 7.93 O ATOM 2692 CB GLN A 345 26.227 14.660 118.188 1.00 8.92 C ATOM 2693 CG GLN A 345 26.498 13.163 118.147 1.00 11.27 C ATOM 2694 CD GLN A 345 25.400 12.341 118.785 1.00 11.72 C ATOM 2695 OE1 GLN A 345 24.824 12.727 119.796 1.00 12.78 O ATOM 2696 NE2 GLN A 345 25.126 11.176 118.206 1.00 14.92 N ATOM 0 H GLN A 345 28.417 14.888 119.231 1.00 7.65 H new ATOM 0 HA GLN A 345 27.616 15.179 116.760 1.00 8.14 H new ATOM 0 HB2 GLN A 345 26.042 14.925 119.103 1.00 8.92 H new ATOM 0 HB3 GLN A 345 25.430 14.854 117.670 1.00 8.92 H new ATOM 0 HG2 GLN A 345 26.607 12.885 117.224 1.00 11.27 H new ATOM 0 HG3 GLN A 345 27.336 12.979 118.600 1.00 11.27 H new ATOM 0 HE21 GLN A 345 25.551 10.938 117.497 1.00 14.92 H new ATOM 0 HE22 GLN A 345 24.524 10.661 118.540 1.00 14.92 H new ATOM 2697 N ILE A 346 27.032 17.658 118.696 1.00 6.17 N ATOM 2698 CA ILE A 346 26.686 19.074 118.715 1.00 6.99 C ATOM 2699 C ILE A 346 27.752 19.877 117.961 1.00 7.35 C ATOM 2700 O ILE A 346 27.429 20.724 117.130 1.00 7.87 O ATOM 2701 CB ILE A 346 26.576 19.607 120.161 1.00 6.34 C ATOM 2702 CG1 ILE A 346 25.394 18.941 120.884 1.00 6.86 C ATOM 2703 CG2 ILE A 346 26.444 21.132 120.142 1.00 7.23 C ATOM 2704 CD1 ILE A 346 25.425 19.142 122.397 1.00 7.63 C ATOM 0 H ILE A 346 27.256 17.330 119.459 1.00 6.17 H new ATOM 0 HA ILE A 346 25.823 19.177 118.283 1.00 6.99 H new ATOM 0 HB ILE A 346 27.382 19.383 120.652 1.00 6.34 H new ATOM 0 HG12 ILE A 346 24.564 19.300 120.533 1.00 6.86 H new ATOM 0 HG13 ILE A 346 25.397 17.991 120.690 1.00 6.86 H new ATOM 0 HG21 ILE A 346 26.375 21.462 121.051 1.00 7.23 H new ATOM 0 HG22 ILE A 346 27.225 21.519 119.716 1.00 7.23 H new ATOM 0 HG23 ILE A 346 25.648 21.382 119.647 1.00 7.23 H new ATOM 0 HD11 ILE A 346 24.659 18.702 122.798 1.00 7.63 H new ATOM 0 HD12 ILE A 346 26.241 18.761 122.758 1.00 7.63 H new ATOM 0 HD13 ILE A 346 25.395 20.090 122.598 1.00 7.63 H new ATOM 2705 N ASN A 347 29.023 19.593 118.240 1.00 8.46 N ATOM 2706 CA ASN A 347 30.118 20.305 117.592 1.00 9.10 C ATOM 2707 C ASN A 347 30.085 20.131 116.074 1.00 8.90 C ATOM 2708 O ASN A 347 30.325 21.088 115.329 1.00 10.68 O ATOM 2709 CB ASN A 347 31.455 19.808 118.147 1.00 10.08 C ATOM 2710 CG ASN A 347 32.615 20.680 117.730 1.00 11.75 C ATOM 2711 OD1 ASN A 347 32.645 21.872 118.021 1.00 11.45 O ATOM 2712 ND2 ASN A 347 33.586 20.085 117.044 1.00 13.75 N ATOM 0 H ASN A 347 29.271 18.991 118.802 1.00 8.46 H new ATOM 0 HA ASN A 347 30.015 21.251 117.782 1.00 9.10 H new ATOM 0 HB2 ASN A 347 31.409 19.778 119.115 1.00 10.08 H new ATOM 0 HB3 ASN A 347 31.611 18.900 117.842 1.00 10.08 H new ATOM 0 HD21 ASN A 347 34.270 20.538 116.786 1.00 13.75 H new ATOM 0 HD22 ASN A 347 33.530 19.247 116.858 1.00 13.75 H new ATOM 2713 N ASP A 348 29.774 18.920 115.615 1.00 8.57 N ATOM 2714 CA ASP A 348 29.718 18.629 114.180 1.00 9.62 C ATOM 2715 C ASP A 348 28.408 19.120 113.559 1.00 9.18 C ATOM 2716 O ASP A 348 28.210 19.026 112.337 1.00 8.70 O ATOM 2717 CB ASP A 348 29.843 17.118 113.926 1.00 10.82 C ATOM 2718 CG ASP A 348 31.225 16.566 114.253 1.00 12.98 C ATOM 2719 OD1 ASP A 348 32.174 17.356 114.433 1.00 14.14 O ATOM 2720 OD2 ASP A 348 31.348 15.325 114.317 1.00 15.53 O ATOM 0 H ASP A 348 29.591 18.249 116.120 1.00 8.57 H new ATOM 0 HA ASP A 348 30.461 19.097 113.768 1.00 9.62 H new ATOM 0 HB2 ASP A 348 29.180 16.651 114.458 1.00 10.82 H new ATOM 0 HB3 ASP A 348 29.640 16.935 112.995 1.00 10.82 H new ATOM 2721 N GLY A 349 27.523 19.642 114.406 1.00 8.56 N ATOM 2722 CA GLY A 349 26.227 20.127 113.958 1.00 8.98 C ATOM 2723 C GLY A 349 26.289 21.143 112.840 1.00 7.53 C ATOM 2724 O GLY A 349 25.388 21.190 111.997 1.00 7.34 O ATOM 0 H GLY A 349 27.659 19.723 115.251 1.00 8.56 H new ATOM 0 HA2 GLY A 349 25.696 19.371 113.663 1.00 8.98 H new ATOM 0 HA3 GLY A 349 25.764 20.522 114.713 1.00 8.98 H new ATOM 2725 N LEU A 350 27.336 21.969 112.828 1.00 8.03 N ATOM 2726 CA LEU A 350 27.490 22.972 111.778 1.00 7.66 C ATOM 2727 C LEU A 350 27.424 22.363 110.385 1.00 6.76 C ATOM 2728 O LEU A 350 27.031 23.042 109.442 1.00 7.36 O ATOM 2729 CB LEU A 350 28.816 23.734 111.907 1.00 10.03 C ATOM 2730 CG LEU A 350 29.024 24.694 113.076 1.00 11.14 C ATOM 2731 CD1 LEU A 350 30.350 25.428 112.848 1.00 10.52 C ATOM 2732 CD2 LEU A 350 27.879 25.691 113.172 1.00 11.92 C ATOM 0 H LEU A 350 27.964 21.964 113.416 1.00 8.03 H new ATOM 0 HA LEU A 350 26.748 23.585 111.895 1.00 7.66 H new ATOM 0 HB2 LEU A 350 29.527 23.075 111.943 1.00 10.03 H new ATOM 0 HB3 LEU A 350 28.940 24.241 111.089 1.00 10.03 H new ATOM 0 HG LEU A 350 29.047 24.199 113.910 1.00 11.14 H new ATOM 0 HD11 LEU A 350 30.508 26.046 113.578 1.00 10.52 H new ATOM 0 HD12 LEU A 350 31.074 24.784 112.809 1.00 10.52 H new ATOM 0 HD13 LEU A 350 30.309 25.919 112.012 1.00 10.52 H new ATOM 0 HD21 LEU A 350 28.032 26.289 113.920 1.00 11.92 H new ATOM 0 HD22 LEU A 350 27.829 26.206 112.352 1.00 11.92 H new ATOM 0 HD23 LEU A 350 27.045 25.214 113.306 1.00 11.92 H new ATOM 2733 N ASN A 351 27.816 21.101 110.230 1.00 7.49 N ATOM 2734 CA ASN A 351 27.755 20.491 108.900 1.00 7.42 C ATOM 2735 C ASN A 351 26.327 20.457 108.359 1.00 7.22 C ATOM 2736 O ASN A 351 26.122 20.529 107.144 1.00 7.37 O ATOM 2737 CB ASN A 351 28.292 19.058 108.909 1.00 8.72 C ATOM 2738 CG ASN A 351 29.783 18.989 109.134 1.00 12.25 C ATOM 2739 OD1 ASN A 351 30.530 19.872 108.715 1.00 16.50 O ATOM 2740 ND2 ASN A 351 30.229 17.916 109.777 1.00 15.30 N ATOM 0 H ASN A 351 28.112 20.593 110.858 1.00 7.49 H new ATOM 0 HA ASN A 351 28.309 21.045 108.328 1.00 7.42 H new ATOM 0 HB2 ASN A 351 27.841 18.553 109.604 1.00 8.72 H new ATOM 0 HB3 ASN A 351 28.077 18.632 108.064 1.00 8.72 H new ATOM 0 HD21 ASN A 351 31.072 17.817 109.916 1.00 15.30 H new ATOM 0 HD22 ASN A 351 29.675 17.320 110.055 1.00 15.30 H new ATOM 2741 N LEU A 352 25.351 20.342 109.262 1.00 6.60 N ATOM 2742 CA LEU A 352 23.938 20.275 108.886 1.00 6.17 C ATOM 2743 C LEU A 352 23.399 21.578 108.317 1.00 6.47 C ATOM 2744 O LEU A 352 22.323 21.585 107.713 1.00 5.80 O ATOM 2745 CB LEU A 352 23.090 19.848 110.098 1.00 6.59 C ATOM 2746 CG LEU A 352 23.360 18.437 110.643 1.00 7.75 C ATOM 2747 CD1 LEU A 352 22.788 18.292 112.057 1.00 7.21 C ATOM 2748 CD2 LEU A 352 22.723 17.413 109.707 1.00 10.49 C ATOM 0 H LEU A 352 25.490 20.301 110.110 1.00 6.60 H new ATOM 0 HA LEU A 352 23.875 19.615 108.178 1.00 6.17 H new ATOM 0 HB2 LEU A 352 23.236 20.486 110.814 1.00 6.59 H new ATOM 0 HB3 LEU A 352 22.153 19.907 109.852 1.00 6.59 H new ATOM 0 HG LEU A 352 24.317 18.286 110.688 1.00 7.75 H new ATOM 0 HD11 LEU A 352 22.966 17.398 112.388 1.00 7.21 H new ATOM 0 HD12 LEU A 352 23.206 18.942 112.643 1.00 7.21 H new ATOM 0 HD13 LEU A 352 21.830 18.444 112.036 1.00 7.21 H new ATOM 0 HD21 LEU A 352 22.889 16.519 110.044 1.00 10.49 H new ATOM 0 HD22 LEU A 352 21.767 17.568 109.660 1.00 10.49 H new ATOM 0 HD23 LEU A 352 23.108 17.501 108.821 1.00 10.49 H new ATOM 2749 N ILE A 353 24.125 22.675 108.520 1.00 5.16 N ATOM 2750 CA ILE A 353 23.699 23.969 107.998 1.00 5.72 C ATOM 2751 C ILE A 353 24.745 24.628 107.087 1.00 5.42 C ATOM 2752 O ILE A 353 24.602 25.802 106.708 1.00 6.29 O ATOM 2753 CB ILE A 353 23.259 24.944 109.133 1.00 5.34 C ATOM 2754 CG1 ILE A 353 24.361 25.114 110.182 1.00 5.35 C ATOM 2755 CG2 ILE A 353 21.956 24.431 109.782 1.00 5.64 C ATOM 2756 CD1 ILE A 353 24.016 26.130 111.258 1.00 5.74 C ATOM 0 H ILE A 353 24.866 22.691 108.957 1.00 5.16 H new ATOM 0 HA ILE A 353 22.924 23.781 107.446 1.00 5.72 H new ATOM 0 HB ILE A 353 23.096 25.817 108.743 1.00 5.34 H new ATOM 0 HG12 ILE A 353 24.536 24.256 110.600 1.00 5.35 H new ATOM 0 HG13 ILE A 353 25.180 25.386 109.740 1.00 5.35 H new ATOM 0 HG21 ILE A 353 21.684 25.039 110.487 1.00 5.64 H new ATOM 0 HG22 ILE A 353 21.257 24.382 109.111 1.00 5.64 H new ATOM 0 HG23 ILE A 353 22.106 23.549 110.156 1.00 5.64 H new ATOM 0 HD11 ILE A 353 24.749 26.193 111.890 1.00 5.74 H new ATOM 0 HD12 ILE A 353 23.867 26.997 110.849 1.00 5.74 H new ATOM 0 HD13 ILE A 353 23.212 25.849 111.723 1.00 5.74 H new ATOM 2757 N THR A 354 25.771 23.858 106.715 1.00 5.66 N ATOM 2758 CA THR A 354 26.808 24.339 105.800 1.00 6.26 C ATOM 2759 C THR A 354 27.057 23.302 104.696 1.00 5.74 C ATOM 2760 O THR A 354 26.291 23.228 103.742 1.00 6.74 O ATOM 2761 CB THR A 354 28.153 24.700 106.528 1.00 6.18 C ATOM 2762 OG1 THR A 354 28.618 23.585 107.305 1.00 6.50 O ATOM 2763 CG2 THR A 354 27.961 25.929 107.431 1.00 7.18 C ATOM 0 H THR A 354 25.884 23.049 106.984 1.00 5.66 H new ATOM 0 HA THR A 354 26.478 25.163 105.408 1.00 6.26 H new ATOM 0 HB THR A 354 28.819 24.909 105.854 1.00 6.18 H new ATOM 0 HG1 THR A 354 28.105 23.466 107.960 1.00 6.50 H new ATOM 0 HG21 THR A 354 28.798 26.140 107.873 1.00 7.18 H new ATOM 0 HG22 THR A 354 27.681 26.686 106.893 1.00 7.18 H new ATOM 0 HG23 THR A 354 27.283 25.738 108.098 1.00 7.18 H new ATOM 2764 N HIS A 355 28.080 22.465 104.853 1.00 6.26 N ATOM 2765 CA HIS A 355 28.447 21.481 103.836 1.00 6.51 C ATOM 2766 C HIS A 355 27.353 20.536 103.354 1.00 6.00 C ATOM 2767 O HIS A 355 27.221 20.303 102.161 1.00 6.72 O ATOM 2768 CB HIS A 355 29.647 20.666 104.326 1.00 7.78 C ATOM 2769 CG HIS A 355 30.893 21.478 104.469 1.00 8.58 C ATOM 2770 ND1 HIS A 355 31.643 21.881 103.385 1.00 10.06 N ATOM 2771 CD2 HIS A 355 31.485 22.015 105.561 1.00 9.65 C ATOM 2772 CE1 HIS A 355 32.647 22.632 103.806 1.00 10.69 C ATOM 2773 NE2 HIS A 355 32.574 22.728 105.121 1.00 10.05 N ATOM 0 H HIS A 355 28.581 22.451 105.552 1.00 6.26 H new ATOM 0 HA HIS A 355 28.654 22.017 103.054 1.00 6.51 H new ATOM 0 HB2 HIS A 355 29.430 20.265 105.182 1.00 7.78 H new ATOM 0 HB3 HIS A 355 29.812 19.939 103.705 1.00 7.78 H new ATOM 0 HD1 HIS A 355 31.483 21.677 102.565 1.00 10.06 H new ATOM 0 HD2 HIS A 355 31.207 21.919 106.443 1.00 9.65 H new ATOM 0 HE1 HIS A 355 33.295 23.026 103.267 1.00 10.69 H new ATOM 2774 N HIS A 356 26.567 19.980 104.270 1.00 6.11 N ATOM 2775 CA HIS A 356 25.532 19.044 103.842 1.00 5.98 C ATOM 2776 C HIS A 356 24.469 19.758 103.016 1.00 6.41 C ATOM 2777 O HIS A 356 23.940 19.191 102.058 1.00 7.04 O ATOM 2778 CB HIS A 356 24.891 18.338 105.047 1.00 6.89 C ATOM 2779 CG HIS A 356 25.814 17.397 105.763 1.00 7.53 C ATOM 2780 ND1 HIS A 356 25.366 16.511 106.717 1.00 8.63 N ATOM 2781 CD2 HIS A 356 27.156 17.218 105.684 1.00 7.83 C ATOM 2782 CE1 HIS A 356 26.391 15.826 107.198 1.00 9.15 C ATOM 2783 NE2 HIS A 356 27.490 16.236 106.589 1.00 9.10 N ATOM 0 H HIS A 356 26.612 20.124 105.117 1.00 6.11 H new ATOM 0 HA HIS A 356 25.953 18.369 103.287 1.00 5.98 H new ATOM 0 HB2 HIS A 356 24.577 19.008 105.674 1.00 6.89 H new ATOM 0 HB3 HIS A 356 24.112 17.845 104.745 1.00 6.89 H new ATOM 0 HD1 HIS A 356 24.547 16.417 106.962 1.00 8.63 H new ATOM 0 HD2 HIS A 356 27.741 17.674 105.123 1.00 7.83 H new ATOM 0 HE1 HIS A 356 26.346 15.168 107.853 1.00 9.15 H new ATOM 0 HE2 HIS A 356 28.284 15.938 106.734 1.00 9.10 H new ATOM 2784 N SER A 357 24.174 21.007 103.370 1.00 5.99 N ATOM 2785 CA SER A 357 23.180 21.785 102.637 1.00 6.54 C ATOM 2786 C SER A 357 23.712 22.198 101.262 1.00 5.69 C ATOM 2787 O SER A 357 22.955 22.255 100.292 1.00 6.83 O ATOM 2788 CB SER A 357 22.777 23.004 103.455 1.00 6.31 C ATOM 2789 OG SER A 357 22.192 22.567 104.670 1.00 8.83 O ATOM 0 H SER A 357 24.538 21.421 104.030 1.00 5.99 H new ATOM 0 HA SER A 357 22.396 21.233 102.492 1.00 6.54 H new ATOM 0 HB2 SER A 357 23.552 23.558 103.636 1.00 6.31 H new ATOM 0 HB3 SER A 357 22.148 23.550 102.957 1.00 6.31 H new ATOM 0 HG SER A 357 22.061 23.228 105.172 1.00 8.83 H new ATOM 2790 N ALA A 358 25.010 22.487 101.178 1.00 6.51 N ATOM 2791 CA ALA A 358 25.619 22.832 99.890 1.00 6.88 C ATOM 2792 C ALA A 358 25.504 21.624 98.941 1.00 7.23 C ATOM 2793 O ALA A 358 25.227 21.779 97.747 1.00 8.11 O ATOM 2794 CB ALA A 358 27.079 23.219 100.087 1.00 7.54 C ATOM 0 H ALA A 358 25.552 22.490 101.846 1.00 6.51 H new ATOM 0 HA ALA A 358 25.155 23.590 99.502 1.00 6.88 H new ATOM 0 HB1 ALA A 358 27.473 23.445 99.230 1.00 7.54 H new ATOM 0 HB2 ALA A 358 27.134 23.985 100.680 1.00 7.54 H new ATOM 0 HB3 ALA A 358 27.562 22.474 100.477 1.00 7.54 H new ATOM 2795 N ARG A 359 25.713 20.415 99.467 1.00 8.04 N ATOM 2796 CA ARG A 359 25.591 19.210 98.648 1.00 8.59 C ATOM 2797 C ARG A 359 24.142 19.059 98.176 1.00 7.51 C ATOM 2798 O ARG A 359 23.886 18.715 97.017 1.00 8.21 O ATOM 2799 CB ARG A 359 26.027 17.970 99.443 1.00 9.46 C ATOM 2800 CG ARG A 359 25.961 16.665 98.665 1.00 11.45 C ATOM 2801 CD ARG A 359 26.595 15.539 99.471 1.00 15.58 C ATOM 2802 NE ARG A 359 26.486 14.251 98.799 1.00 18.16 N ATOM 2803 CZ ARG A 359 26.870 13.096 99.338 1.00 20.57 C ATOM 2804 NH1 ARG A 359 27.392 13.066 100.558 1.00 22.33 N ATOM 2805 NH2 ARG A 359 26.723 11.968 98.658 1.00 22.39 N ATOM 0 H ARG A 359 25.924 20.273 100.288 1.00 8.04 H new ATOM 0 HA ARG A 359 26.172 19.292 97.876 1.00 8.59 H new ATOM 0 HB2 ARG A 359 26.936 18.102 99.753 1.00 9.46 H new ATOM 0 HB3 ARG A 359 25.467 17.892 100.231 1.00 9.46 H new ATOM 0 HG2 ARG A 359 25.037 16.447 98.464 1.00 11.45 H new ATOM 0 HG3 ARG A 359 26.421 16.763 97.817 1.00 11.45 H new ATOM 0 HD2 ARG A 359 27.531 15.742 99.627 1.00 15.58 H new ATOM 0 HD3 ARG A 359 26.168 15.486 100.340 1.00 15.58 H new ATOM 0 HE ARG A 359 26.153 14.236 98.006 1.00 18.16 H new ATOM 0 HH11 ARG A 359 27.484 13.795 101.005 1.00 22.33 H new ATOM 0 HH12 ARG A 359 27.639 12.317 100.902 1.00 22.33 H new ATOM 0 HH21 ARG A 359 26.380 11.983 97.870 1.00 22.39 H new ATOM 0 HH22 ARG A 359 26.971 11.221 99.005 1.00 22.39 H new ATOM 2806 N THR A 360 23.193 19.328 99.073 1.00 6.89 N ATOM 2807 CA THR A 360 21.777 19.249 98.723 1.00 6.95 C ATOM 2808 C THR A 360 21.433 20.192 97.562 1.00 7.17 C ATOM 2809 O THR A 360 20.626 19.847 96.701 1.00 7.82 O ATOM 2810 CB THR A 360 20.919 19.554 99.964 1.00 6.78 C ATOM 2811 OG1 THR A 360 21.122 18.490 100.902 1.00 7.00 O ATOM 2812 CG2 THR A 360 19.435 19.640 99.626 1.00 7.48 C ATOM 0 H THR A 360 23.349 19.557 99.887 1.00 6.89 H new ATOM 0 HA THR A 360 21.582 18.348 98.422 1.00 6.95 H new ATOM 0 HB THR A 360 21.186 20.413 100.327 1.00 6.78 H new ATOM 0 HG1 THR A 360 20.870 18.736 101.664 1.00 7.00 H new ATOM 0 HG21 THR A 360 18.930 19.833 100.431 1.00 7.48 H new ATOM 0 HG22 THR A 360 19.291 20.347 98.978 1.00 7.48 H new ATOM 0 HG23 THR A 360 19.138 18.795 99.253 1.00 7.48 H new ATOM 2813 N LEU A 361 22.045 21.379 97.534 1.00 6.49 N ATOM 2814 CA LEU A 361 21.800 22.343 96.458 1.00 6.37 C ATOM 2815 C LEU A 361 22.693 22.101 95.238 1.00 6.33 C ATOM 2816 O LEU A 361 22.626 22.859 94.274 1.00 7.27 O ATOM 2817 CB LEU A 361 21.976 23.781 96.973 1.00 6.63 C ATOM 2818 CG LEU A 361 20.676 24.444 97.455 1.00 6.12 C ATOM 2819 CD1 LEU A 361 19.995 23.593 98.539 1.00 8.80 C ATOM 2820 CD2 LEU A 361 20.981 25.836 97.985 1.00 9.08 C ATOM 0 H LEU A 361 22.606 21.645 98.129 1.00 6.49 H new ATOM 0 HA LEU A 361 20.883 22.216 96.169 1.00 6.37 H new ATOM 0 HB2 LEU A 361 22.614 23.776 97.704 1.00 6.63 H new ATOM 0 HB3 LEU A 361 22.359 24.322 96.265 1.00 6.63 H new ATOM 0 HG LEU A 361 20.065 24.514 96.705 1.00 6.12 H new ATOM 0 HD11 LEU A 361 19.178 24.030 98.828 1.00 8.80 H new ATOM 0 HD12 LEU A 361 19.783 22.718 98.178 1.00 8.80 H new ATOM 0 HD13 LEU A 361 20.593 23.494 99.296 1.00 8.80 H new ATOM 0 HD21 LEU A 361 20.160 26.254 98.289 1.00 9.08 H new ATOM 0 HD22 LEU A 361 21.604 25.771 98.726 1.00 9.08 H new ATOM 0 HD23 LEU A 361 21.374 26.372 97.279 1.00 9.08 H new ATOM 2821 N ASN A 362 23.497 21.035 95.275 1.00 7.53 N ATOM 2822 CA ASN A 362 24.411 20.659 94.189 1.00 8.85 C ATOM 2823 C ASN A 362 25.373 21.799 93.837 1.00 9.09 C ATOM 2824 O ASN A 362 25.718 22.000 92.667 1.00 10.36 O ATOM 2825 CB ASN A 362 23.612 20.234 92.948 1.00 9.82 C ATOM 2826 CG ASN A 362 24.408 19.341 92.022 1.00 12.17 C ATOM 2827 OD1 ASN A 362 25.133 18.451 92.472 1.00 14.33 O ATOM 2828 ND2 ASN A 362 24.261 19.559 90.718 1.00 13.76 N ATOM 0 H ASN A 362 23.527 20.498 95.946 1.00 7.53 H new ATOM 0 HA ASN A 362 24.944 19.910 94.498 1.00 8.85 H new ATOM 0 HB2 ASN A 362 22.808 19.769 93.229 1.00 9.82 H new ATOM 0 HB3 ASN A 362 23.328 21.025 92.464 1.00 9.82 H new ATOM 0 HD21 ASN A 362 24.681 19.069 90.150 1.00 13.76 H new ATOM 0 HD22 ASN A 362 23.746 20.190 90.443 1.00 13.76 H new ATOM 2829 N LEU A 363 25.829 22.523 94.857 1.00 8.52 N ATOM 2830 CA LEU A 363 26.735 23.651 94.641 1.00 10.46 C ATOM 2831 C LEU A 363 28.106 23.200 94.161 1.00 12.13 C ATOM 2832 O LEU A 363 28.671 22.220 94.660 1.00 13.11 O ATOM 2833 CB LEU A 363 26.870 24.480 95.921 1.00 9.37 C ATOM 2834 CG LEU A 363 25.566 25.047 96.493 1.00 8.40 C ATOM 2835 CD1 LEU A 363 25.907 25.932 97.686 1.00 9.02 C ATOM 2836 CD2 LEU A 363 24.800 25.859 95.435 1.00 10.62 C ATOM 0 H LEU A 363 25.627 22.379 95.680 1.00 8.52 H new ATOM 0 HA LEU A 363 26.348 24.201 93.942 1.00 10.46 H new ATOM 0 HB2 LEU A 363 27.288 23.928 96.600 1.00 9.37 H new ATOM 0 HB3 LEU A 363 27.474 25.219 95.745 1.00 9.37 H new ATOM 0 HG LEU A 363 24.994 24.314 96.769 1.00 8.40 H new ATOM 0 HD11 LEU A 363 25.091 26.299 98.060 1.00 9.02 H new ATOM 0 HD12 LEU A 363 26.363 25.405 98.361 1.00 9.02 H new ATOM 0 HD13 LEU A 363 26.484 26.656 97.397 1.00 9.02 H new ATOM 0 HD21 LEU A 363 23.981 26.205 95.823 1.00 10.62 H new ATOM 0 HD22 LEU A 363 25.351 26.597 95.132 1.00 10.62 H new ATOM 0 HD23 LEU A 363 24.584 25.287 94.682 1.00 10.62 H new ATOM 2837 N GLN A 364 28.633 23.947 93.195 1.00 14.29 N ATOM 2838 CA GLN A 364 29.922 23.649 92.581 1.00 18.25 C ATOM 2839 C GLN A 364 31.079 24.534 93.040 1.00 18.60 C ATOM 2840 O GLN A 364 32.231 24.265 92.698 1.00 19.94 O ATOM 2841 CB GLN A 364 29.791 23.768 91.062 1.00 19.58 C ATOM 2842 CG GLN A 364 28.682 22.913 90.460 1.00 23.21 C ATOM 2843 CD GLN A 364 28.912 21.434 90.692 1.00 25.69 C ATOM 2844 OE1 GLN A 364 29.979 20.905 90.375 1.00 28.21 O ATOM 2845 NE2 GLN A 364 27.909 20.756 91.242 1.00 25.33 N ATOM 0 H GLN A 364 28.249 24.647 92.875 1.00 14.29 H new ATOM 0 HA GLN A 364 30.143 22.748 92.865 1.00 18.25 H new ATOM 0 HB2 GLN A 364 29.629 24.697 90.833 1.00 19.58 H new ATOM 0 HB3 GLN A 364 30.635 23.518 90.654 1.00 19.58 H new ATOM 0 HG2 GLN A 364 27.831 23.171 90.847 1.00 23.21 H new ATOM 0 HG3 GLN A 364 28.624 23.084 89.507 1.00 23.21 H new ATOM 0 HE21 GLN A 364 27.179 21.161 91.450 1.00 25.33 H new ATOM 0 HE22 GLN A 364 27.990 19.913 91.390 1.00 25.33 H new ATOM 2846 N ASP A 365 30.776 25.583 93.798 1.00 16.76 N ATOM 2847 CA ASP A 365 31.795 26.525 94.275 1.00 17.12 C ATOM 2848 C ASP A 365 31.463 26.815 95.734 1.00 15.82 C ATOM 2849 O ASP A 365 30.858 27.844 96.051 1.00 17.38 O ATOM 2850 CB ASP A 365 31.713 27.804 93.431 1.00 17.98 C ATOM 2851 CG ASP A 365 32.782 28.833 93.778 1.00 19.11 C ATOM 2852 OD1 ASP A 365 32.787 29.891 93.114 1.00 22.32 O ATOM 2853 OD2 ASP A 365 33.605 28.608 94.690 1.00 18.77 O ATOM 0 H ASP A 365 29.976 25.772 94.052 1.00 16.76 H new ATOM 0 HA ASP A 365 32.694 26.169 94.198 1.00 17.12 H new ATOM 0 HB2 ASP A 365 31.793 27.569 92.493 1.00 17.98 H new ATOM 0 HB3 ASP A 365 30.838 28.205 93.550 1.00 17.98 H new ATOM 2854 N TYR A 366 31.862 25.903 96.617 1.00 13.55 N ATOM 2855 CA TYR A 366 31.558 26.033 98.036 1.00 11.68 C ATOM 2856 C TYR A 366 32.613 25.374 98.911 1.00 11.15 C ATOM 2857 O TYR A 366 32.995 24.229 98.677 1.00 12.57 O ATOM 2858 CB TYR A 366 30.181 25.401 98.314 1.00 9.82 C ATOM 2859 CG TYR A 366 29.681 25.555 99.737 1.00 8.02 C ATOM 2860 CD1 TYR A 366 30.060 24.657 100.739 1.00 7.95 C ATOM 2861 CD2 TYR A 366 28.857 26.618 100.085 1.00 7.54 C ATOM 2862 CE1 TYR A 366 29.626 24.819 102.061 1.00 7.33 C ATOM 2863 CE2 TYR A 366 28.420 26.796 101.400 1.00 7.71 C ATOM 2864 CZ TYR A 366 28.814 25.891 102.385 1.00 6.25 C ATOM 2865 OH TYR A 366 28.425 26.079 103.694 1.00 7.38 O ATOM 0 H TYR A 366 32.312 25.199 96.412 1.00 13.55 H new ATOM 0 HA TYR A 366 31.549 26.977 98.257 1.00 11.68 H new ATOM 0 HB2 TYR A 366 29.531 25.797 97.712 1.00 9.82 H new ATOM 0 HB3 TYR A 366 30.225 24.456 98.102 1.00 9.82 H new ATOM 0 HD1 TYR A 366 30.610 23.939 100.524 1.00 7.95 H new ATOM 0 HD2 TYR A 366 28.591 27.223 99.430 1.00 7.54 H new ATOM 0 HE1 TYR A 366 29.882 24.210 102.716 1.00 7.33 H new ATOM 0 HE2 TYR A 366 27.870 27.514 101.617 1.00 7.71 H new ATOM 0 HH TYR A 366 27.939 26.762 103.747 1.00 7.38 H new ATOM 2866 N GLY A 367 33.068 26.103 99.926 1.00 10.30 N ATOM 2867 CA GLY A 367 34.062 25.570 100.840 1.00 11.50 C ATOM 2868 C GLY A 367 35.329 26.402 100.905 1.00 11.39 C ATOM 2869 O GLY A 367 35.673 27.103 99.950 1.00 12.70 O ATOM 0 H GLY A 367 32.813 26.906 100.099 1.00 10.30 H new ATOM 0 HA2 GLY A 367 33.676 25.511 101.728 1.00 11.50 H new ATOM 0 HA3 GLY A 367 34.290 24.667 100.569 1.00 11.50 H new ATOM 2870 N ILE A 368 36.020 26.330 102.037 1.00 11.96 N ATOM 2871 CA ILE A 368 37.268 27.070 102.209 1.00 12.92 C ATOM 2872 C ILE A 368 38.384 26.225 101.588 1.00 13.10 C ATOM 2873 O ILE A 368 38.995 25.391 102.255 1.00 13.94 O ATOM 2874 CB ILE A 368 37.568 27.320 103.708 1.00 12.45 C ATOM 2875 CG1 ILE A 368 36.342 27.933 104.394 1.00 15.60 C ATOM 2876 CG2 ILE A 368 38.772 28.245 103.858 1.00 14.30 C ATOM 2877 CD1 ILE A 368 35.849 29.199 103.750 1.00 14.66 C ATOM 0 H ILE A 368 35.785 25.860 102.718 1.00 11.96 H new ATOM 0 HA ILE A 368 37.202 27.937 101.779 1.00 12.92 H new ATOM 0 HB ILE A 368 37.773 26.472 104.132 1.00 12.45 H new ATOM 0 HG12 ILE A 368 35.624 27.281 104.395 1.00 15.60 H new ATOM 0 HG13 ILE A 368 36.560 28.117 105.321 1.00 15.60 H new ATOM 0 HG21 ILE A 368 38.950 28.394 104.800 1.00 14.30 H new ATOM 0 HG22 ILE A 368 39.548 27.836 103.443 1.00 14.30 H new ATOM 0 HG23 ILE A 368 38.584 29.093 103.427 1.00 14.30 H new ATOM 0 HD11 ILE A 368 35.076 29.529 104.234 1.00 14.66 H new ATOM 0 HD12 ILE A 368 36.552 29.867 103.770 1.00 14.66 H new ATOM 0 HD13 ILE A 368 35.601 29.019 102.830 1.00 14.66 H new ATOM 2878 N ALA A 369 38.615 26.437 100.296 1.00 13.64 N ATOM 2879 CA ALA A 369 39.633 25.702 99.551 1.00 14.65 C ATOM 2880 C ALA A 369 40.187 26.591 98.445 1.00 14.97 C ATOM 2881 O ALA A 369 39.472 27.424 97.885 1.00 15.54 O ATOM 2882 CB ALA A 369 39.027 24.441 98.946 1.00 15.12 C ATOM 0 H ALA A 369 38.184 27.013 99.825 1.00 13.64 H new ATOM 0 HA ALA A 369 40.350 25.447 100.152 1.00 14.65 H new ATOM 0 HB1 ALA A 369 39.709 23.958 98.453 1.00 15.12 H new ATOM 0 HB2 ALA A 369 38.680 23.876 99.654 1.00 15.12 H new ATOM 0 HB3 ALA A 369 38.306 24.685 98.345 1.00 15.12 H new ATOM 2883 N ALA A 370 41.467 26.408 98.131 1.00 16.92 N ATOM 2884 CA ALA A 370 42.122 27.192 97.090 1.00 16.98 C ATOM 2885 C ALA A 370 41.398 27.024 95.758 1.00 16.94 C ATOM 2886 O ALA A 370 41.038 25.912 95.373 1.00 18.62 O ATOM 2887 CB ALA A 370 43.582 26.760 96.952 1.00 18.46 C ATOM 0 H ALA A 370 41.976 25.830 98.513 1.00 16.92 H new ATOM 0 HA ALA A 370 42.091 28.128 97.341 1.00 16.98 H new ATOM 0 HB1 ALA A 370 44.011 27.285 96.258 1.00 18.46 H new ATOM 0 HB2 ALA A 370 44.042 26.900 97.794 1.00 18.46 H new ATOM 0 HB3 ALA A 370 43.621 25.820 96.716 1.00 18.46 H new ATOM 2888 N GLY A 371 41.182 28.135 95.063 1.00 17.28 N ATOM 2889 CA GLY A 371 40.509 28.087 93.781 1.00 16.82 C ATOM 2890 C GLY A 371 39.045 28.471 93.858 1.00 16.26 C ATOM 2891 O GLY A 371 38.460 28.895 92.861 1.00 17.39 O ATOM 0 H GLY A 371 41.418 28.922 95.318 1.00 17.28 H new ATOM 0 HA2 GLY A 371 40.961 28.682 93.163 1.00 16.82 H new ATOM 0 HA3 GLY A 371 40.583 27.191 93.417 1.00 16.82 H new ATOM 2892 N ASN A 372 38.452 28.318 95.041 1.00 15.96 N ATOM 2893 CA ASN A 372 37.046 28.650 95.245 1.00 14.89 C ATOM 2894 C ASN A 372 36.861 30.151 95.428 1.00 14.10 C ATOM 2895 O ASN A 372 37.804 30.865 95.779 1.00 13.88 O ATOM 2896 CB ASN A 372 36.502 27.932 96.489 1.00 15.21 C ATOM 2897 CG ASN A 372 36.250 26.455 96.254 1.00 15.76 C ATOM 2898 OD1 ASN A 372 36.506 25.929 95.169 1.00 17.03 O ATOM 2899 ND2 ASN A 372 35.737 25.774 97.277 1.00 15.39 N ATOM 0 H ASN A 372 38.851 28.021 95.742 1.00 15.96 H new ATOM 0 HA ASN A 372 36.560 28.361 94.457 1.00 14.89 H new ATOM 0 HB2 ASN A 372 37.133 28.036 97.219 1.00 15.21 H new ATOM 0 HB3 ASN A 372 35.675 28.357 96.766 1.00 15.21 H new ATOM 0 HD21 ASN A 372 35.572 24.934 97.195 1.00 15.39 H new ATOM 0 HD22 ASN A 372 35.571 26.174 98.020 1.00 15.39 H new ATOM 2900 N SER A 373 35.647 30.634 95.179 1.00 13.78 N ATOM 2901 CA SER A 373 35.350 32.047 95.380 1.00 13.30 C ATOM 2902 C SER A 373 35.536 32.335 96.866 1.00 12.40 C ATOM 2903 O SER A 373 35.311 31.459 97.712 1.00 12.24 O ATOM 2904 CB SER A 373 33.906 32.373 94.980 1.00 13.56 C ATOM 2905 OG SER A 373 33.708 32.201 93.589 1.00 16.68 O ATOM 0 H SER A 373 34.986 30.163 94.895 1.00 13.78 H new ATOM 0 HA SER A 373 35.938 32.589 94.831 1.00 13.30 H new ATOM 0 HB2 SER A 373 33.295 31.800 95.469 1.00 13.56 H new ATOM 0 HB3 SER A 373 33.698 33.287 95.228 1.00 13.56 H new ATOM 0 HG SER A 373 33.117 31.618 93.460 1.00 16.68 H new ATOM 2906 N ALA A 374 35.954 33.555 97.185 1.00 12.23 N ATOM 2907 CA ALA A 374 36.168 33.943 98.567 1.00 10.77 C ATOM 2908 C ALA A 374 34.838 34.290 99.231 1.00 10.88 C ATOM 2909 O ALA A 374 34.532 35.456 99.473 1.00 10.14 O ATOM 2910 CB ALA A 374 37.133 35.130 98.640 1.00 12.09 C ATOM 0 H ALA A 374 36.119 34.173 96.611 1.00 12.23 H new ATOM 0 HA ALA A 374 36.563 33.196 99.044 1.00 10.77 H new ATOM 0 HB1 ALA A 374 37.269 35.381 99.567 1.00 12.09 H new ATOM 0 HB2 ALA A 374 37.983 34.881 98.245 1.00 12.09 H new ATOM 0 HB3 ALA A 374 36.759 35.882 98.154 1.00 12.09 H new ATOM 2911 N ASN A 375 34.054 33.247 99.501 1.00 10.07 N ATOM 2912 CA ASN A 375 32.743 33.355 100.151 1.00 9.29 C ATOM 2913 C ASN A 375 32.916 32.615 101.476 1.00 8.71 C ATOM 2914 O ASN A 375 33.122 31.395 101.493 1.00 9.24 O ATOM 2915 CB ASN A 375 31.660 32.664 99.318 1.00 10.29 C ATOM 2916 CG ASN A 375 31.523 33.241 97.920 1.00 10.64 C ATOM 2917 OD1 ASN A 375 32.006 34.340 97.628 1.00 11.83 O ATOM 2918 ND2 ASN A 375 30.833 32.508 97.050 1.00 12.05 N ATOM 0 H ASN A 375 34.273 32.438 99.308 1.00 10.07 H new ATOM 0 HA ASN A 375 32.469 34.279 100.260 1.00 9.29 H new ATOM 0 HB2 ASN A 375 31.864 31.718 99.253 1.00 10.29 H new ATOM 0 HB3 ASN A 375 30.809 32.739 99.778 1.00 10.29 H new ATOM 0 HD21 ASN A 375 30.709 32.795 96.249 1.00 12.05 H new ATOM 0 HD22 ASN A 375 30.511 31.747 97.289 1.00 12.05 H new ATOM 2919 N LEU A 376 32.836 33.353 102.575 1.00 8.38 N ATOM 2920 CA LEU A 376 33.047 32.769 103.894 1.00 8.41 C ATOM 2921 C LEU A 376 32.478 33.673 104.977 1.00 8.07 C ATOM 2922 O LEU A 376 32.241 34.864 104.752 1.00 9.11 O ATOM 2923 CB LEU A 376 34.558 32.550 104.109 1.00 9.49 C ATOM 2924 CG LEU A 376 35.467 33.780 103.938 1.00 10.42 C ATOM 2925 CD1 LEU A 376 35.571 34.546 105.252 1.00 11.19 C ATOM 2926 CD2 LEU A 376 36.855 33.345 103.489 1.00 12.88 C ATOM 0 H LEU A 376 32.660 34.195 102.580 1.00 8.38 H new ATOM 0 HA LEU A 376 32.586 31.917 103.947 1.00 8.41 H new ATOM 0 HB2 LEU A 376 34.689 32.199 105.004 1.00 9.49 H new ATOM 0 HB3 LEU A 376 34.856 31.865 103.490 1.00 9.49 H new ATOM 0 HG LEU A 376 35.080 34.360 103.263 1.00 10.42 H new ATOM 0 HD11 LEU A 376 36.146 35.318 105.132 1.00 11.19 H new ATOM 0 HD12 LEU A 376 34.688 34.840 105.526 1.00 11.19 H new ATOM 0 HD13 LEU A 376 35.945 33.968 105.935 1.00 11.19 H new ATOM 0 HD21 LEU A 376 37.421 34.126 103.384 1.00 12.88 H new ATOM 0 HD22 LEU A 376 37.240 32.754 104.155 1.00 12.88 H new ATOM 0 HD23 LEU A 376 36.789 32.877 102.642 1.00 12.88 H new ATOM 2927 N ILE A 377 32.231 33.110 106.153 1.00 7.72 N ATOM 2928 CA ILE A 377 31.710 33.902 107.252 1.00 8.51 C ATOM 2929 C ILE A 377 32.554 33.620 108.486 1.00 7.57 C ATOM 2930 O ILE A 377 33.210 32.576 108.586 1.00 8.43 O ATOM 2931 CB ILE A 377 30.187 33.617 107.527 1.00 8.04 C ATOM 2932 CG1 ILE A 377 29.967 32.171 107.971 1.00 7.81 C ATOM 2933 CG2 ILE A 377 29.366 33.923 106.266 1.00 9.03 C ATOM 2934 CD1 ILE A 377 28.507 31.874 108.354 1.00 8.57 C ATOM 0 H ILE A 377 32.357 32.278 106.332 1.00 7.72 H new ATOM 0 HA ILE A 377 31.766 34.841 107.017 1.00 8.51 H new ATOM 0 HB ILE A 377 29.892 34.195 108.248 1.00 8.04 H new ATOM 0 HG12 ILE A 377 30.236 31.574 107.255 1.00 7.81 H new ATOM 0 HG13 ILE A 377 30.540 31.980 108.730 1.00 7.81 H new ATOM 0 HG21 ILE A 377 28.428 33.746 106.439 1.00 9.03 H new ATOM 0 HG22 ILE A 377 29.479 34.855 106.024 1.00 9.03 H new ATOM 0 HG23 ILE A 377 29.671 33.361 105.537 1.00 9.03 H new ATOM 0 HD11 ILE A 377 28.426 30.947 108.626 1.00 8.57 H new ATOM 0 HD12 ILE A 377 28.241 32.450 109.087 1.00 8.57 H new ATOM 0 HD13 ILE A 377 27.932 32.038 107.590 1.00 8.57 H new ATOM 2935 N ILE A 378 32.536 34.563 109.415 1.00 7.77 N ATOM 2936 CA ILE A 378 33.315 34.463 110.641 1.00 8.85 C ATOM 2937 C ILE A 378 32.382 34.498 111.843 1.00 8.44 C ATOM 2938 O ILE A 378 31.596 35.436 111.994 1.00 9.03 O ATOM 2939 CB ILE A 378 34.309 35.647 110.739 1.00 9.87 C ATOM 2940 CG1 ILE A 378 35.254 35.625 109.534 1.00 10.95 C ATOM 2941 CG2 ILE A 378 35.076 35.585 112.055 1.00 11.06 C ATOM 2942 CD1 ILE A 378 36.265 36.773 109.509 1.00 13.54 C ATOM 0 H ILE A 378 32.070 35.283 109.353 1.00 7.77 H new ATOM 0 HA ILE A 378 33.809 33.628 110.630 1.00 8.85 H new ATOM 0 HB ILE A 378 33.820 36.485 110.726 1.00 9.87 H new ATOM 0 HG12 ILE A 378 35.736 34.783 109.529 1.00 10.95 H new ATOM 0 HG13 ILE A 378 34.726 35.655 108.721 1.00 10.95 H new ATOM 0 HG21 ILE A 378 35.695 36.331 112.105 1.00 11.06 H new ATOM 0 HG22 ILE A 378 34.452 35.633 112.796 1.00 11.06 H new ATOM 0 HG23 ILE A 378 35.570 34.752 112.103 1.00 11.06 H new ATOM 0 HD11 ILE A 378 36.826 36.693 108.722 1.00 13.54 H new ATOM 0 HD12 ILE A 378 35.793 37.620 109.485 1.00 13.54 H new ATOM 0 HD13 ILE A 378 36.818 36.735 110.305 1.00 13.54 H new ATOM 2943 N LEU A 379 32.461 33.466 112.681 1.00 8.16 N ATOM 2944 CA LEU A 379 31.640 33.374 113.889 1.00 8.33 C ATOM 2945 C LEU A 379 32.541 33.667 115.085 1.00 8.55 C ATOM 2946 O LEU A 379 33.645 33.122 115.177 1.00 9.54 O ATOM 2947 CB LEU A 379 31.046 31.968 114.051 1.00 8.59 C ATOM 2948 CG LEU A 379 30.255 31.385 112.877 1.00 8.05 C ATOM 2949 CD1 LEU A 379 29.713 30.020 113.282 1.00 9.20 C ATOM 2950 CD2 LEU A 379 29.117 32.319 112.476 1.00 10.54 C ATOM 0 H LEU A 379 32.992 32.799 112.566 1.00 8.16 H new ATOM 0 HA LEU A 379 30.908 34.007 113.828 1.00 8.33 H new ATOM 0 HB2 LEU A 379 31.774 31.359 114.251 1.00 8.59 H new ATOM 0 HB3 LEU A 379 30.463 31.979 114.826 1.00 8.59 H new ATOM 0 HG LEU A 379 30.839 31.288 112.108 1.00 8.05 H new ATOM 0 HD11 LEU A 379 29.209 29.640 112.545 1.00 9.20 H new ATOM 0 HD12 LEU A 379 30.451 29.432 113.506 1.00 9.20 H new ATOM 0 HD13 LEU A 379 29.133 30.118 114.053 1.00 9.20 H new ATOM 0 HD21 LEU A 379 28.628 31.933 111.732 1.00 10.54 H new ATOM 0 HD22 LEU A 379 28.517 32.440 113.228 1.00 10.54 H new ATOM 0 HD23 LEU A 379 29.481 33.178 112.212 1.00 10.54 H new ATOM 2951 N PRO A 380 32.085 34.517 116.018 1.00 8.53 N ATOM 2952 CA PRO A 380 32.897 34.849 117.199 1.00 9.28 C ATOM 2953 C PRO A 380 32.778 33.734 118.241 1.00 7.36 C ATOM 2954 O PRO A 380 32.215 33.927 119.321 1.00 9.31 O ATOM 2955 CB PRO A 380 32.293 36.173 117.658 1.00 9.47 C ATOM 2956 CG PRO A 380 30.820 36.007 117.316 1.00 9.79 C ATOM 2957 CD PRO A 380 30.832 35.300 115.978 1.00 8.86 C ATOM 0 HA PRO A 380 33.849 34.929 117.033 1.00 9.28 H new ATOM 0 HB2 PRO A 380 32.428 36.320 118.607 1.00 9.47 H new ATOM 0 HB3 PRO A 380 32.687 36.929 117.195 1.00 9.47 H new ATOM 0 HG2 PRO A 380 30.356 35.485 117.989 1.00 9.79 H new ATOM 0 HG3 PRO A 380 30.369 36.864 117.261 1.00 9.79 H new ATOM 0 HD2 PRO A 380 30.056 34.728 115.868 1.00 8.86 H new ATOM 0 HD3 PRO A 380 30.827 35.930 115.240 1.00 8.86 H new ATOM 2958 N ALA A 381 33.309 32.567 117.893 1.00 8.95 N ATOM 2959 CA ALA A 381 33.230 31.384 118.743 1.00 8.76 C ATOM 2960 C ALA A 381 34.429 30.485 118.467 1.00 9.41 C ATOM 2961 O ALA A 381 35.037 30.566 117.401 1.00 10.64 O ATOM 2962 CB ALA A 381 31.925 30.632 118.451 1.00 9.41 C ATOM 0 H ALA A 381 33.728 32.438 117.153 1.00 8.95 H new ATOM 0 HA ALA A 381 33.239 31.647 119.677 1.00 8.76 H new ATOM 0 HB1 ALA A 381 31.871 29.845 119.016 1.00 9.41 H new ATOM 0 HB2 ALA A 381 31.169 31.212 118.633 1.00 9.41 H new ATOM 0 HB3 ALA A 381 31.908 30.363 117.519 1.00 9.41 H new ATOM 2963 N GLU A 382 34.740 29.601 119.410 1.00 10.67 N ATOM 2964 CA GLU A 382 35.903 28.723 119.283 1.00 11.56 C ATOM 2965 C GLU A 382 35.724 27.490 118.413 1.00 11.24 C ATOM 2966 O GLU A 382 36.694 26.961 117.870 1.00 12.34 O ATOM 2967 CB GLU A 382 36.374 28.285 120.673 1.00 15.82 C ATOM 2968 CG GLU A 382 36.682 29.442 121.600 1.00 22.55 C ATOM 2969 CD GLU A 382 37.232 28.992 122.940 1.00 26.21 C ATOM 2970 OE1 GLU A 382 37.429 29.861 123.816 1.00 29.73 O ATOM 2971 OE2 GLU A 382 37.471 27.777 123.115 1.00 28.68 O ATOM 0 H GLU A 382 34.290 29.492 120.134 1.00 10.67 H new ATOM 0 HA GLU A 382 36.563 29.265 118.823 1.00 11.56 H new ATOM 0 HB2 GLU A 382 35.690 27.729 121.078 1.00 15.82 H new ATOM 0 HB3 GLU A 382 37.168 27.735 120.579 1.00 15.82 H new ATOM 0 HG2 GLU A 382 37.324 30.031 121.173 1.00 22.55 H new ATOM 0 HG3 GLU A 382 35.874 29.959 121.744 1.00 22.55 H new ATOM 2972 N ASN A 383 34.483 27.036 118.280 1.00 10.15 N ATOM 2973 CA ASN A 383 34.176 25.845 117.502 1.00 10.21 C ATOM 2974 C ASN A 383 32.663 25.762 117.335 1.00 8.10 C ATOM 2975 O ASN A 383 31.934 26.637 117.817 1.00 8.04 O ATOM 2976 CB ASN A 383 34.703 24.590 118.222 1.00 10.54 C ATOM 2977 CG ASN A 383 34.350 24.573 119.703 1.00 12.67 C ATOM 2978 OD1 ASN A 383 33.207 24.805 120.080 1.00 10.46 O ATOM 2979 ND2 ASN A 383 35.340 24.301 120.549 1.00 16.17 N ATOM 0 H ASN A 383 33.796 27.410 118.638 1.00 10.15 H new ATOM 0 HA ASN A 383 34.604 25.895 116.633 1.00 10.21 H new ATOM 0 HB2 ASN A 383 34.336 23.799 117.796 1.00 10.54 H new ATOM 0 HB3 ASN A 383 35.667 24.545 118.122 1.00 10.54 H new ATOM 0 HD21 ASN A 383 35.190 24.283 121.396 1.00 16.17 H new ATOM 0 HD22 ASN A 383 36.130 24.143 120.249 1.00 16.17 H new ATOM 2980 N GLY A 384 32.205 24.717 116.655 1.00 8.08 N ATOM 2981 CA GLY A 384 30.776 24.539 116.426 1.00 7.79 C ATOM 2982 C GLY A 384 29.947 24.440 117.692 1.00 7.08 C ATOM 2983 O GLY A 384 28.840 24.983 117.766 1.00 7.27 O ATOM 0 H GLY A 384 32.703 24.102 116.319 1.00 8.08 H new ATOM 0 HA2 GLY A 384 30.449 25.283 115.896 1.00 7.79 H new ATOM 0 HA3 GLY A 384 30.641 23.735 115.900 1.00 7.79 H new ATOM 2984 N PHE A 385 30.472 23.731 118.682 1.00 7.25 N ATOM 2985 CA PHE A 385 29.775 23.579 119.950 1.00 7.29 C ATOM 2986 C PHE A 385 29.526 24.946 120.593 1.00 6.76 C ATOM 2987 O PHE A 385 28.404 25.264 121.008 1.00 7.19 O ATOM 2988 CB PHE A 385 30.609 22.701 120.898 1.00 7.40 C ATOM 2989 CG PHE A 385 30.035 22.590 122.284 1.00 7.03 C ATOM 2990 CD1 PHE A 385 29.095 21.609 122.596 1.00 8.37 C ATOM 2991 CD2 PHE A 385 30.407 23.494 123.269 1.00 8.68 C ATOM 2992 CE1 PHE A 385 28.537 21.540 123.875 1.00 9.00 C ATOM 2993 CE2 PHE A 385 29.855 23.436 124.554 1.00 9.68 C ATOM 2994 CZ PHE A 385 28.921 22.459 124.854 1.00 8.30 C ATOM 0 H PHE A 385 31.231 23.330 118.640 1.00 7.25 H new ATOM 0 HA PHE A 385 28.919 23.154 119.786 1.00 7.29 H new ATOM 0 HB2 PHE A 385 30.687 21.812 120.517 1.00 7.40 H new ATOM 0 HB3 PHE A 385 31.506 23.065 120.957 1.00 7.40 H new ATOM 0 HD1 PHE A 385 28.837 20.995 121.947 1.00 8.37 H new ATOM 0 HD2 PHE A 385 31.035 24.151 123.072 1.00 8.68 H new ATOM 0 HE1 PHE A 385 27.910 20.882 124.074 1.00 9.00 H new ATOM 0 HE2 PHE A 385 30.114 24.050 125.202 1.00 9.68 H new ATOM 0 HZ PHE A 385 28.550 22.415 125.706 1.00 8.30 H new ATOM 2995 N ASP A 386 30.585 25.744 120.690 1.00 7.58 N ATOM 2996 CA ASP A 386 30.530 27.063 121.300 1.00 6.91 C ATOM 2997 C ASP A 386 29.573 28.000 120.547 1.00 6.31 C ATOM 2998 O ASP A 386 28.781 28.716 121.163 1.00 6.73 O ATOM 2999 CB ASP A 386 31.966 27.622 121.359 1.00 8.26 C ATOM 3000 CG ASP A 386 32.076 28.930 122.129 1.00 8.43 C ATOM 3001 OD1 ASP A 386 31.443 29.085 123.189 1.00 8.32 O ATOM 3002 OD2 ASP A 386 32.841 29.809 121.674 1.00 10.30 O ATOM 0 H ASP A 386 31.365 25.529 120.399 1.00 7.58 H new ATOM 0 HA ASP A 386 30.173 26.996 122.199 1.00 6.91 H new ATOM 0 HB2 ASP A 386 32.546 26.962 121.771 1.00 8.26 H new ATOM 0 HB3 ASP A 386 32.290 27.759 120.455 1.00 8.26 H new ATOM 3003 N ALA A 387 29.636 27.980 119.217 1.00 6.66 N ATOM 3004 CA ALA A 387 28.772 28.824 118.389 1.00 6.94 C ATOM 3005 C ALA A 387 27.306 28.477 118.621 1.00 6.71 C ATOM 3006 O ALA A 387 26.453 29.359 118.750 1.00 7.74 O ATOM 3007 CB ALA A 387 29.122 28.640 116.910 1.00 7.34 C ATOM 0 H ALA A 387 30.176 27.481 118.771 1.00 6.66 H new ATOM 0 HA ALA A 387 28.915 29.750 118.638 1.00 6.94 H new ATOM 0 HB1 ALA A 387 28.546 29.202 116.369 1.00 7.34 H new ATOM 0 HB2 ALA A 387 30.048 28.890 116.763 1.00 7.34 H new ATOM 0 HB3 ALA A 387 28.995 27.711 116.660 1.00 7.34 H new ATOM 3008 N LEU A 388 27.029 27.179 118.690 1.00 6.52 N ATOM 3009 CA LEU A 388 25.672 26.678 118.900 1.00 6.91 C ATOM 3010 C LEU A 388 25.186 26.992 120.319 1.00 6.49 C ATOM 3011 O LEU A 388 24.084 27.522 120.508 1.00 7.45 O ATOM 3012 CB LEU A 388 25.648 25.163 118.627 1.00 7.14 C ATOM 3013 CG LEU A 388 24.335 24.355 118.635 1.00 6.98 C ATOM 3014 CD1 LEU A 388 23.830 24.166 120.063 1.00 7.53 C ATOM 3015 CD2 LEU A 388 23.283 25.046 117.761 1.00 7.15 C ATOM 0 H LEU A 388 27.623 26.562 118.616 1.00 6.52 H new ATOM 0 HA LEU A 388 25.067 27.121 118.285 1.00 6.91 H new ATOM 0 HB2 LEU A 388 26.054 25.029 117.757 1.00 7.14 H new ATOM 0 HB3 LEU A 388 26.235 24.751 119.281 1.00 7.14 H new ATOM 0 HG LEU A 388 24.506 23.476 118.263 1.00 6.98 H new ATOM 0 HD11 LEU A 388 23.005 23.657 120.050 1.00 7.53 H new ATOM 0 HD12 LEU A 388 24.496 23.688 120.581 1.00 7.53 H new ATOM 0 HD13 LEU A 388 23.668 25.033 120.466 1.00 7.53 H new ATOM 0 HD21 LEU A 388 22.462 24.530 117.773 1.00 7.15 H new ATOM 0 HD22 LEU A 388 23.110 25.936 118.105 1.00 7.15 H new ATOM 0 HD23 LEU A 388 23.610 25.110 116.850 1.00 7.15 H new ATOM 3016 N ARG A 389 26.013 26.707 121.322 1.00 6.73 N ATOM 3017 CA ARG A 389 25.604 26.955 122.695 1.00 6.48 C ATOM 3018 C ARG A 389 25.258 28.416 122.959 1.00 6.36 C ATOM 3019 O ARG A 389 24.250 28.720 123.595 1.00 6.80 O ATOM 3020 CB ARG A 389 26.691 26.509 123.689 1.00 6.08 C ATOM 3021 CG ARG A 389 26.248 26.663 125.147 1.00 5.86 C ATOM 3022 CD ARG A 389 27.300 26.152 126.139 1.00 7.71 C ATOM 3023 NE ARG A 389 28.504 26.988 126.189 1.00 7.67 N ATOM 3024 CZ ARG A 389 28.624 28.128 126.869 1.00 7.66 C ATOM 3025 NH1 ARG A 389 29.777 28.791 126.824 1.00 8.57 N ATOM 3026 NH2 ARG A 389 27.618 28.613 127.594 1.00 8.41 N ATOM 0 H ARG A 389 26.801 26.375 121.229 1.00 6.73 H new ATOM 0 HA ARG A 389 24.800 26.429 122.827 1.00 6.48 H new ATOM 0 HB2 ARG A 389 26.920 25.582 123.519 1.00 6.08 H new ATOM 0 HB3 ARG A 389 27.495 27.031 123.541 1.00 6.08 H new ATOM 0 HG2 ARG A 389 26.064 27.598 125.329 1.00 5.86 H new ATOM 0 HG3 ARG A 389 25.418 26.179 125.282 1.00 5.86 H new ATOM 0 HD2 ARG A 389 26.907 26.109 127.025 1.00 7.71 H new ATOM 0 HD3 ARG A 389 27.552 25.247 125.896 1.00 7.71 H new ATOM 0 HE ARG A 389 29.189 26.721 125.743 1.00 7.67 H new ATOM 0 HH11 ARG A 389 30.432 28.483 126.360 1.00 8.57 H new ATOM 0 HH12 ARG A 389 29.867 29.528 127.259 1.00 8.57 H new ATOM 0 HH21 ARG A 389 26.871 28.189 127.631 1.00 8.41 H new ATOM 0 HH22 ARG A 389 27.715 29.350 128.026 1.00 8.41 H new ATOM 3027 N ARG A 390 26.099 29.324 122.466 1.00 6.47 N ATOM 3028 CA ARG A 390 25.891 30.742 122.697 1.00 6.87 C ATOM 3029 C ARG A 390 25.051 31.463 121.646 1.00 7.27 C ATOM 3030 O ARG A 390 24.793 32.662 121.770 1.00 8.49 O ATOM 3031 CB ARG A 390 27.252 31.436 122.890 1.00 7.72 C ATOM 3032 CG ARG A 390 27.963 30.973 124.169 1.00 7.90 C ATOM 3033 CD ARG A 390 29.216 31.786 124.506 1.00 7.16 C ATOM 3034 NE ARG A 390 30.279 31.651 123.514 1.00 8.06 N ATOM 3035 CZ ARG A 390 30.652 32.614 122.672 1.00 7.97 C ATOM 3036 NH1 ARG A 390 31.636 32.387 121.815 1.00 8.81 N ATOM 3037 NH2 ARG A 390 30.045 33.793 122.688 1.00 9.93 N ATOM 0 H ARG A 390 26.794 29.135 121.996 1.00 6.47 H new ATOM 0 HA ARG A 390 25.358 30.802 123.505 1.00 6.87 H new ATOM 0 HB2 ARG A 390 27.818 31.254 122.123 1.00 7.72 H new ATOM 0 HB3 ARG A 390 27.121 32.397 122.924 1.00 7.72 H new ATOM 0 HG2 ARG A 390 27.342 31.028 124.912 1.00 7.90 H new ATOM 0 HG3 ARG A 390 28.209 30.040 124.073 1.00 7.90 H new ATOM 0 HD2 ARG A 390 28.974 32.722 124.586 1.00 7.16 H new ATOM 0 HD3 ARG A 390 29.553 31.505 125.371 1.00 7.16 H new ATOM 0 HE ARG A 390 30.693 30.898 123.470 1.00 8.06 H new ATOM 0 HH11 ARG A 390 32.029 31.622 121.805 1.00 8.81 H new ATOM 0 HH12 ARG A 390 31.882 33.004 121.269 1.00 8.81 H new ATOM 0 HH21 ARG A 390 29.406 33.940 123.244 1.00 9.93 H new ATOM 0 HH22 ARG A 390 30.290 34.410 122.142 1.00 9.93 H new ATOM 3038 N GLN A 391 24.612 30.732 120.628 1.00 7.11 N ATOM 3039 CA GLN A 391 23.781 31.295 119.553 1.00 6.87 C ATOM 3040 C GLN A 391 24.390 32.612 119.072 1.00 8.06 C ATOM 3041 O GLN A 391 23.724 33.656 119.026 1.00 8.97 O ATOM 3042 CB GLN A 391 22.340 31.502 120.058 1.00 7.30 C ATOM 3043 CG GLN A 391 21.611 30.182 120.346 1.00 7.08 C ATOM 3044 CD GLN A 391 21.204 29.470 119.068 1.00 7.58 C ATOM 3045 OE1 GLN A 391 20.280 29.904 118.374 1.00 7.97 O ATOM 3046 NE2 GLN A 391 21.894 28.388 118.741 1.00 6.90 N ATOM 0 H GLN A 391 24.784 29.895 120.535 1.00 7.11 H new ATOM 0 HA GLN A 391 23.753 30.678 118.805 1.00 6.87 H new ATOM 0 HB2 GLN A 391 22.360 32.038 120.866 1.00 7.30 H new ATOM 0 HB3 GLN A 391 21.840 32.005 119.396 1.00 7.30 H new ATOM 0 HG2 GLN A 391 22.186 29.603 120.869 1.00 7.08 H new ATOM 0 HG3 GLN A 391 20.823 30.359 120.883 1.00 7.08 H new ATOM 0 HE21 GLN A 391 22.532 28.115 119.249 1.00 6.90 H new ATOM 0 HE22 GLN A 391 21.704 27.959 118.020 1.00 6.90 H new ATOM 3047 N VAL A 392 25.661 32.540 118.690 1.00 8.40 N ATOM 3048 CA VAL A 392 26.396 33.725 118.261 1.00 8.58 C ATOM 3049 C VAL A 392 25.941 34.274 116.920 1.00 8.57 C ATOM 3050 O VAL A 392 25.431 33.540 116.075 1.00 8.32 O ATOM 3051 CB VAL A 392 27.923 33.442 118.158 1.00 8.90 C ATOM 3052 CG1 VAL A 392 28.460 32.946 119.501 1.00 9.31 C ATOM 3053 CG2 VAL A 392 28.201 32.424 117.051 1.00 8.84 C ATOM 0 H VAL A 392 26.118 31.811 118.672 1.00 8.40 H new ATOM 0 HA VAL A 392 26.210 34.386 118.946 1.00 8.58 H new ATOM 0 HB VAL A 392 28.381 34.267 117.933 1.00 8.90 H new ATOM 0 HG11 VAL A 392 29.411 32.773 119.425 1.00 9.31 H new ATOM 0 HG12 VAL A 392 28.308 33.622 120.180 1.00 9.31 H new ATOM 0 HG13 VAL A 392 28.002 32.128 119.751 1.00 9.31 H new ATOM 0 HG21 VAL A 392 29.155 32.257 116.997 1.00 8.84 H new ATOM 0 HG22 VAL A 392 27.738 31.595 117.250 1.00 8.84 H new ATOM 0 HG23 VAL A 392 27.886 32.774 116.203 1.00 8.84 H new ATOM 3054 N PRO A 393 26.093 35.592 116.719 1.00 8.07 N ATOM 3055 CA PRO A 393 25.703 36.212 115.450 1.00 8.61 C ATOM 3056 C PRO A 393 26.860 36.000 114.472 1.00 8.62 C ATOM 3057 O PRO A 393 27.888 35.415 114.823 1.00 9.74 O ATOM 3058 CB PRO A 393 25.546 37.685 115.825 1.00 9.82 C ATOM 3059 CG PRO A 393 26.627 37.863 116.867 1.00 10.47 C ATOM 3060 CD PRO A 393 26.457 36.613 117.721 1.00 10.03 C ATOM 0 HA PRO A 393 24.899 35.860 115.037 1.00 8.61 H new ATOM 0 HB2 PRO A 393 25.678 38.270 115.062 1.00 9.82 H new ATOM 0 HB3 PRO A 393 24.664 37.877 116.181 1.00 9.82 H new ATOM 0 HG2 PRO A 393 27.510 37.913 116.469 1.00 10.47 H new ATOM 0 HG3 PRO A 393 26.503 38.675 117.383 1.00 10.47 H new ATOM 0 HD2 PRO A 393 27.273 36.383 118.192 1.00 10.03 H new ATOM 0 HD3 PRO A 393 25.765 36.725 118.391 1.00 10.03 H new ATOM 3061 N VAL A 394 26.688 36.453 113.237 1.00 8.50 N ATOM 3062 CA VAL A 394 27.752 36.351 112.250 1.00 7.89 C ATOM 3063 C VAL A 394 28.542 37.661 112.354 1.00 9.13 C ATOM 3064 O VAL A 394 28.023 38.747 112.069 1.00 9.30 O ATOM 3065 CB VAL A 394 27.172 36.166 110.835 1.00 8.90 C ATOM 3066 CG1 VAL A 394 28.272 36.291 109.798 1.00 9.72 C ATOM 3067 CG2 VAL A 394 26.503 34.791 110.738 1.00 8.84 C ATOM 0 H VAL A 394 25.965 36.822 112.951 1.00 8.50 H new ATOM 0 HA VAL A 394 28.319 35.581 112.415 1.00 7.89 H new ATOM 0 HB VAL A 394 26.512 36.856 110.665 1.00 8.90 H new ATOM 0 HG11 VAL A 394 27.896 36.173 108.912 1.00 9.72 H new ATOM 0 HG12 VAL A 394 28.679 37.169 109.862 1.00 9.72 H new ATOM 0 HG13 VAL A 394 28.945 35.611 109.956 1.00 9.72 H new ATOM 0 HG21 VAL A 394 26.137 34.671 109.848 1.00 8.84 H new ATOM 0 HG22 VAL A 394 27.159 34.099 110.913 1.00 8.84 H new ATOM 0 HG23 VAL A 394 25.789 34.732 111.392 1.00 8.84 H new ATOM 3068 N ARG A 395 29.798 37.567 112.786 1.00 8.27 N ATOM 3069 CA ARG A 395 30.613 38.770 112.945 1.00 8.92 C ATOM 3070 C ARG A 395 30.872 39.452 111.602 1.00 9.10 C ATOM 3071 O ARG A 395 30.744 40.677 111.493 1.00 9.74 O ATOM 3072 CB ARG A 395 31.934 38.425 113.636 1.00 9.74 C ATOM 3073 CG ARG A 395 32.810 39.642 113.940 1.00 12.05 C ATOM 3074 CD ARG A 395 32.225 40.492 115.056 1.00 17.38 C ATOM 3075 NE ARG A 395 33.028 41.688 115.321 1.00 21.15 N ATOM 3076 CZ ARG A 395 32.949 42.819 114.623 1.00 22.78 C ATOM 3077 NH1 ARG A 395 32.099 42.928 113.608 1.00 23.64 N ATOM 3078 NH2 ARG A 395 33.731 43.843 114.935 1.00 25.02 N ATOM 0 H ARG A 395 30.192 36.830 112.989 1.00 8.27 H new ATOM 0 HA ARG A 395 30.120 39.394 113.501 1.00 8.92 H new ATOM 0 HB2 ARG A 395 31.743 37.959 114.465 1.00 9.74 H new ATOM 0 HB3 ARG A 395 32.432 37.811 113.074 1.00 9.74 H new ATOM 0 HG2 ARG A 395 33.699 39.346 114.190 1.00 12.05 H new ATOM 0 HG3 ARG A 395 32.905 40.181 113.139 1.00 12.05 H new ATOM 0 HD2 ARG A 395 31.322 40.757 114.819 1.00 17.38 H new ATOM 0 HD3 ARG A 395 32.162 39.961 115.865 1.00 17.38 H new ATOM 0 HE ARG A 395 33.589 41.658 115.972 1.00 21.15 H new ATOM 0 HH11 ARG A 395 31.594 42.265 113.397 1.00 23.64 H new ATOM 0 HH12 ARG A 395 32.054 43.662 113.162 1.00 23.64 H new ATOM 0 HH21 ARG A 395 34.288 43.776 115.587 1.00 25.02 H new ATOM 0 HH22 ARG A 395 33.682 44.574 114.485 1.00 25.02 H new ATOM 3079 N TYR A 396 31.245 38.660 110.602 1.00 8.70 N ATOM 3080 CA TYR A 396 31.476 39.159 109.248 1.00 8.65 C ATOM 3081 C TYR A 396 31.046 38.130 108.216 1.00 8.22 C ATOM 3082 O TYR A 396 31.263 36.933 108.402 1.00 8.65 O ATOM 3083 CB TYR A 396 32.964 39.433 108.975 1.00 11.13 C ATOM 3084 CG TYR A 396 33.584 40.555 109.769 1.00 13.37 C ATOM 3085 CD1 TYR A 396 34.422 40.292 110.853 1.00 15.69 C ATOM 3086 CD2 TYR A 396 33.342 41.884 109.427 1.00 15.14 C ATOM 3087 CE1 TYR A 396 35.009 41.337 111.579 1.00 17.86 C ATOM 3088 CE2 TYR A 396 33.925 42.931 110.143 1.00 17.79 C ATOM 3089 CZ TYR A 396 34.753 42.647 111.212 1.00 18.82 C ATOM 3090 OH TYR A 396 35.336 43.681 111.915 1.00 22.38 O ATOM 0 H TYR A 396 31.372 37.814 110.689 1.00 8.70 H new ATOM 0 HA TYR A 396 30.962 39.979 109.180 1.00 8.65 H new ATOM 0 HB2 TYR A 396 33.463 38.620 109.153 1.00 11.13 H new ATOM 0 HB3 TYR A 396 33.071 39.630 108.031 1.00 11.13 H new ATOM 0 HD1 TYR A 396 34.593 39.411 111.097 1.00 15.69 H new ATOM 0 HD2 TYR A 396 32.783 42.077 108.710 1.00 15.14 H new ATOM 0 HE1 TYR A 396 35.566 41.152 112.301 1.00 17.86 H new ATOM 0 HE2 TYR A 396 33.757 43.813 109.902 1.00 17.79 H new ATOM 0 HH TYR A 396 35.096 44.415 111.585 1.00 22.38 H new ATOM 3091 N SER A 397 30.441 38.608 107.133 1.00 8.33 N ATOM 3092 CA SER A 397 30.092 37.748 106.011 1.00 8.19 C ATOM 3093 C SER A 397 30.858 38.344 104.830 1.00 7.92 C ATOM 3094 O SER A 397 30.729 39.542 104.537 1.00 8.39 O ATOM 3095 CB SER A 397 28.592 37.758 105.714 1.00 8.23 C ATOM 3096 OG SER A 397 28.332 36.970 104.560 1.00 8.81 O ATOM 0 H SER A 397 30.223 39.433 107.029 1.00 8.33 H new ATOM 0 HA SER A 397 30.317 36.823 106.195 1.00 8.19 H new ATOM 0 HB2 SER A 397 28.100 37.409 106.473 1.00 8.23 H new ATOM 0 HB3 SER A 397 28.287 38.668 105.572 1.00 8.23 H new ATOM 0 HG SER A 397 27.533 37.075 104.323 1.00 8.81 H new ATOM 3097 N VAL A 398 31.657 37.508 104.180 1.00 7.73 N ATOM 3098 CA VAL A 398 32.487 37.910 103.049 1.00 8.76 C ATOM 3099 C VAL A 398 32.035 37.177 101.789 1.00 8.78 C ATOM 3100 O VAL A 398 31.841 35.962 101.801 1.00 9.14 O ATOM 3101 CB VAL A 398 33.977 37.585 103.355 1.00 9.22 C ATOM 3102 CG1 VAL A 398 34.846 37.862 102.131 1.00 11.64 C ATOM 3103 CG2 VAL A 398 34.452 38.412 104.554 1.00 10.44 C ATOM 0 H VAL A 398 31.735 36.677 104.386 1.00 7.73 H new ATOM 0 HA VAL A 398 32.395 38.865 102.904 1.00 8.76 H new ATOM 0 HB VAL A 398 34.057 36.643 103.574 1.00 9.22 H new ATOM 0 HG11 VAL A 398 35.771 37.655 102.337 1.00 11.64 H new ATOM 0 HG12 VAL A 398 34.549 37.310 101.391 1.00 11.64 H new ATOM 0 HG13 VAL A 398 34.771 38.798 101.886 1.00 11.64 H new ATOM 0 HG21 VAL A 398 35.381 38.206 104.741 1.00 10.44 H new ATOM 0 HG22 VAL A 398 34.365 39.356 104.351 1.00 10.44 H new ATOM 0 HG23 VAL A 398 33.911 38.197 105.330 1.00 10.44 H new ATOM 3104 N ARG A 399 31.855 37.916 100.698 1.00 9.55 N ATOM 3105 CA ARG A 399 31.435 37.308 99.444 1.00 9.68 C ATOM 3106 C ARG A 399 32.268 37.946 98.335 1.00 11.29 C ATOM 3107 O ARG A 399 32.342 39.177 98.235 1.00 11.31 O ATOM 3108 CB ARG A 399 29.943 37.552 99.207 1.00 10.98 C ATOM 3109 CG ARG A 399 29.383 36.845 97.987 1.00 12.13 C ATOM 3110 CD ARG A 399 27.869 37.006 97.963 1.00 12.77 C ATOM 3111 NE ARG A 399 27.249 36.546 96.721 1.00 15.20 N ATOM 3112 CZ ARG A 399 27.075 35.274 96.380 1.00 16.06 C ATOM 3113 NH1 ARG A 399 27.471 34.291 97.178 1.00 16.12 N ATOM 3114 NH2 ARG A 399 26.480 34.983 95.231 1.00 19.85 N ATOM 0 H ARG A 399 31.971 38.768 100.664 1.00 9.55 H new ATOM 0 HA ARG A 399 31.571 36.348 99.463 1.00 9.68 H new ATOM 0 HB2 ARG A 399 29.450 37.263 99.991 1.00 10.98 H new ATOM 0 HB3 ARG A 399 29.792 38.506 99.113 1.00 10.98 H new ATOM 0 HG2 ARG A 399 29.771 37.216 97.179 1.00 12.13 H new ATOM 0 HG3 ARG A 399 29.618 35.904 98.009 1.00 12.13 H new ATOM 0 HD2 ARG A 399 27.488 36.514 98.707 1.00 12.77 H new ATOM 0 HD3 ARG A 399 27.649 37.941 98.098 1.00 12.77 H new ATOM 0 HE ARG A 399 26.976 37.146 96.168 1.00 15.20 H new ATOM 0 HH11 ARG A 399 27.847 34.473 97.930 1.00 16.12 H new ATOM 0 HH12 ARG A 399 27.352 33.472 96.944 1.00 16.12 H new ATOM 0 HH21 ARG A 399 26.211 35.615 94.714 1.00 19.85 H new ATOM 0 HH22 ARG A 399 26.364 34.162 95.003 1.00 19.85 H new ATOM 3115 N GLY A 400 32.890 37.110 97.512 1.00 11.53 N ATOM 3116 CA GLY A 400 33.739 37.626 96.448 1.00 12.90 C ATOM 3117 C GLY A 400 34.897 38.431 97.025 1.00 13.77 C ATOM 3118 O GLY A 400 35.418 39.349 96.381 1.00 15.55 O ATOM 0 H GLY A 400 32.835 36.253 97.551 1.00 11.53 H new ATOM 0 HA2 GLY A 400 34.083 36.891 95.917 1.00 12.90 H new ATOM 0 HA3 GLY A 400 33.216 38.185 95.853 1.00 12.90 H new ATOM 3119 N GLY A 401 35.295 38.101 98.251 1.00 12.74 N ATOM 3120 CA GLY A 401 36.392 38.804 98.897 1.00 13.29 C ATOM 3121 C GLY A 401 36.043 40.151 99.503 1.00 13.63 C ATOM 3122 O GLY A 401 36.939 40.894 99.915 1.00 15.26 O ATOM 0 H GLY A 401 34.942 37.474 98.723 1.00 12.74 H new ATOM 0 HA2 GLY A 401 36.751 38.236 99.597 1.00 13.29 H new ATOM 0 HA3 GLY A 401 37.099 38.934 98.246 1.00 13.29 H new ATOM 3123 N LYS A 402 34.754 40.477 99.567 1.00 13.22 N ATOM 3124 CA LYS A 402 34.297 41.745 100.140 1.00 14.02 C ATOM 3125 C LYS A 402 33.300 41.533 101.276 1.00 13.24 C ATOM 3126 O LYS A 402 32.491 40.608 101.235 1.00 12.17 O ATOM 3127 CB LYS A 402 33.627 42.604 99.068 1.00 17.41 C ATOM 3128 CG LYS A 402 34.577 43.122 98.010 1.00 21.50 C ATOM 3129 CD LYS A 402 33.853 44.004 97.011 1.00 24.82 C ATOM 3130 CE LYS A 402 34.849 44.705 96.102 1.00 27.71 C ATOM 3131 NZ LYS A 402 35.762 43.731 95.443 1.00 29.52 N ATOM 0 H LYS A 402 34.120 39.972 99.281 1.00 13.22 H new ATOM 0 HA LYS A 402 35.083 42.191 100.491 1.00 14.02 H new ATOM 0 HB2 LYS A 402 32.931 42.083 98.637 1.00 17.41 H new ATOM 0 HB3 LYS A 402 33.192 43.358 99.496 1.00 17.41 H new ATOM 0 HG2 LYS A 402 35.292 43.625 98.431 1.00 21.50 H new ATOM 0 HG3 LYS A 402 34.989 42.375 97.548 1.00 21.50 H new ATOM 0 HD2 LYS A 402 33.243 43.468 96.480 1.00 24.82 H new ATOM 0 HD3 LYS A 402 33.317 44.662 97.481 1.00 24.82 H new ATOM 0 HE2 LYS A 402 34.372 45.212 95.426 1.00 27.71 H new ATOM 0 HE3 LYS A 402 35.369 45.340 96.618 1.00 27.71 H new ATOM 0 HZ1 LYS A 402 36.170 44.124 94.757 1.00 29.52 H new ATOM 0 HZ2 LYS A 402 36.371 43.451 96.029 1.00 29.52 H new ATOM 0 HZ3 LYS A 402 35.292 43.035 95.149 1.00 29.52 H new ATOM 3132 N VAL A 403 33.343 42.393 102.285 1.00 11.44 N ATOM 3133 CA VAL A 403 32.407 42.271 103.399 1.00 11.92 C ATOM 3134 C VAL A 403 31.006 42.730 102.984 1.00 12.39 C ATOM 3135 O VAL A 403 30.820 43.867 102.539 1.00 13.05 O ATOM 3136 CB VAL A 403 32.880 43.107 104.620 1.00 11.90 C ATOM 3137 CG1 VAL A 403 31.805 43.119 105.702 1.00 13.28 C ATOM 3138 CG2 VAL A 403 34.187 42.532 105.171 1.00 14.25 C ATOM 0 H VAL A 403 33.898 43.047 102.346 1.00 11.44 H new ATOM 0 HA VAL A 403 32.376 41.335 103.651 1.00 11.92 H new ATOM 0 HB VAL A 403 33.037 44.021 104.334 1.00 11.90 H new ATOM 0 HG11 VAL A 403 32.112 43.644 106.458 1.00 13.28 H new ATOM 0 HG12 VAL A 403 30.992 43.511 105.346 1.00 13.28 H new ATOM 0 HG13 VAL A 403 31.626 42.210 105.991 1.00 13.28 H new ATOM 0 HG21 VAL A 403 34.477 43.058 105.933 1.00 14.25 H new ATOM 0 HG22 VAL A 403 34.045 41.613 105.448 1.00 14.25 H new ATOM 0 HG23 VAL A 403 34.869 42.559 104.482 1.00 14.25 H new ATOM 3139 N ILE A 404 30.020 41.840 103.112 1.00 10.41 N ATOM 3140 CA ILE A 404 28.646 42.195 102.767 1.00 10.29 C ATOM 3141 C ILE A 404 27.716 42.299 103.976 1.00 9.34 C ATOM 3142 O ILE A 404 26.571 42.723 103.848 1.00 9.81 O ATOM 3143 CB ILE A 404 28.036 41.225 101.720 1.00 9.23 C ATOM 3144 CG1 ILE A 404 28.078 39.777 102.217 1.00 8.85 C ATOM 3145 CG2 ILE A 404 28.767 41.393 100.388 1.00 10.59 C ATOM 3146 CD1 ILE A 404 27.192 38.840 101.384 1.00 8.80 C ATOM 0 H ILE A 404 30.125 41.034 103.394 1.00 10.41 H new ATOM 0 HA ILE A 404 28.713 43.081 102.377 1.00 10.29 H new ATOM 0 HB ILE A 404 27.101 41.444 101.587 1.00 9.23 H new ATOM 0 HG12 ILE A 404 28.993 39.457 102.193 1.00 8.85 H new ATOM 0 HG13 ILE A 404 27.792 39.748 103.143 1.00 8.85 H new ATOM 0 HG21 ILE A 404 28.388 40.788 99.732 1.00 10.59 H new ATOM 0 HG22 ILE A 404 28.670 42.307 100.078 1.00 10.59 H new ATOM 0 HG23 ILE A 404 29.708 41.191 100.507 1.00 10.59 H new ATOM 0 HD11 ILE A 404 27.253 37.939 101.737 1.00 8.80 H new ATOM 0 HD12 ILE A 404 26.271 39.142 101.427 1.00 8.80 H new ATOM 0 HD13 ILE A 404 27.492 38.846 100.461 1.00 8.80 H new ATOM 3147 N ALA A 405 28.206 41.913 105.152 1.00 9.95 N ATOM 3148 CA ALA A 405 27.430 42.035 106.379 1.00 9.60 C ATOM 3149 C ALA A 405 28.358 41.955 107.577 1.00 9.40 C ATOM 3150 O ALA A 405 29.403 41.313 107.523 1.00 9.40 O ATOM 3151 CB ALA A 405 26.366 40.938 106.469 1.00 10.94 C ATOM 0 H ALA A 405 28.990 41.576 105.259 1.00 9.95 H new ATOM 0 HA ALA A 405 26.978 42.893 106.373 1.00 9.60 H new ATOM 0 HB1 ALA A 405 25.864 41.041 107.293 1.00 10.94 H new ATOM 0 HB2 ALA A 405 25.763 41.009 105.712 1.00 10.94 H new ATOM 0 HB3 ALA A 405 26.796 40.068 106.459 1.00 10.94 H new ATOM 3152 N SER A 406 27.979 42.630 108.653 1.00 10.57 N ATOM 3153 CA SER A 406 28.768 42.591 109.872 1.00 11.48 C ATOM 3154 C SER A 406 27.883 42.861 111.077 1.00 11.26 C ATOM 3155 O SER A 406 26.898 43.598 110.994 1.00 11.70 O ATOM 3156 CB SER A 406 29.900 43.619 109.811 1.00 13.66 C ATOM 3157 OG SER A 406 29.391 44.940 109.813 1.00 17.82 O ATOM 0 H SER A 406 27.270 43.115 108.697 1.00 10.57 H new ATOM 0 HA SER A 406 29.157 41.707 109.959 1.00 11.48 H new ATOM 0 HB2 SER A 406 30.493 43.497 110.569 1.00 13.66 H new ATOM 0 HB3 SER A 406 30.429 43.475 109.011 1.00 13.66 H new ATOM 0 HG SER A 406 30.028 45.486 109.781 1.00 17.82 H new ATOM 3158 N THR A 407 28.219 42.229 112.193 1.00 11.78 N ATOM 3159 CA THR A 407 27.482 42.431 113.424 1.00 13.44 C ATOM 3160 C THR A 407 28.433 42.785 114.550 1.00 14.75 C ATOM 3161 O THR A 407 29.358 42.032 114.856 1.00 16.61 O ATOM 3162 CB THR A 407 26.685 41.167 113.864 1.00 11.35 C ATOM 3163 OG1 THR A 407 25.576 40.953 112.980 1.00 12.62 O ATOM 3164 CG2 THR A 407 26.144 41.348 115.278 1.00 12.85 C ATOM 0 H THR A 407 28.875 41.676 112.256 1.00 11.78 H new ATOM 0 HA THR A 407 26.856 43.150 113.248 1.00 13.44 H new ATOM 0 HB THR A 407 27.286 40.406 113.836 1.00 11.35 H new ATOM 0 HG1 THR A 407 25.858 40.684 112.236 1.00 12.62 H new ATOM 0 HG21 THR A 407 25.650 40.555 115.540 1.00 12.85 H new ATOM 0 HG22 THR A 407 26.882 41.486 115.892 1.00 12.85 H new ATOM 0 HG23 THR A 407 25.555 42.118 115.303 1.00 12.85 H new ATOM 3165 N GLN A 408 28.213 43.953 115.140 1.00 14.65 N ATOM 3166 CA GLN A 408 28.986 44.391 116.290 1.00 17.76 C ATOM 3167 C GLN A 408 28.255 43.689 117.438 1.00 18.01 C ATOM 3168 O GLN A 408 27.084 43.960 117.695 1.00 15.04 O ATOM 3169 CB GLN A 408 28.880 45.904 116.447 1.00 20.04 C ATOM 3170 CG GLN A 408 29.482 46.438 117.736 1.00 25.77 C ATOM 3171 CD GLN A 408 29.365 47.942 117.842 1.00 28.96 C ATOM 3172 OE1 GLN A 408 29.991 48.679 117.077 1.00 31.70 O ATOM 3173 NE2 GLN A 408 28.555 48.409 118.787 1.00 30.28 N ATOM 0 H GLN A 408 27.612 44.512 114.884 1.00 14.65 H new ATOM 0 HA GLN A 408 29.933 44.187 116.236 1.00 17.76 H new ATOM 0 HB2 GLN A 408 29.321 46.329 115.695 1.00 20.04 H new ATOM 0 HB3 GLN A 408 27.945 46.159 116.408 1.00 20.04 H new ATOM 0 HG2 GLN A 408 29.037 46.027 118.493 1.00 25.77 H new ATOM 0 HG3 GLN A 408 30.417 46.184 117.784 1.00 25.77 H new ATOM 0 HE21 GLN A 408 28.135 47.863 119.302 1.00 30.28 H new ATOM 0 HE22 GLN A 408 28.451 49.257 118.884 1.00 30.28 H new ATOM 3174 N PRO A 409 28.928 42.755 118.126 1.00 19.98 N ATOM 3175 CA PRO A 409 28.292 42.033 119.232 1.00 20.86 C ATOM 3176 C PRO A 409 27.710 42.880 120.359 1.00 19.27 C ATOM 3177 O PRO A 409 28.163 43.994 120.629 1.00 19.52 O ATOM 3178 CB PRO A 409 29.407 41.116 119.728 1.00 22.21 C ATOM 3179 CG PRO A 409 30.171 40.822 118.468 1.00 22.21 C ATOM 3180 CD PRO A 409 30.262 42.198 117.841 1.00 21.61 C ATOM 0 HA PRO A 409 27.495 41.578 118.917 1.00 20.86 H new ATOM 0 HB2 PRO A 409 29.962 41.551 120.394 1.00 22.21 H new ATOM 0 HB3 PRO A 409 29.056 40.308 120.134 1.00 22.21 H new ATOM 0 HG2 PRO A 409 31.046 40.446 118.651 1.00 22.21 H new ATOM 0 HG3 PRO A 409 29.705 40.191 117.897 1.00 22.21 H new ATOM 0 HD2 PRO A 409 30.970 42.731 118.236 1.00 21.61 H new ATOM 0 HD3 PRO A 409 30.440 42.152 116.889 1.00 21.61 H new ATOM 3181 N ALA A 410 26.687 42.334 121.004 1.00 19.39 N ATOM 3182 CA ALA A 410 26.052 42.999 122.131 1.00 18.58 C ATOM 3183 C ALA A 410 27.088 43.065 123.249 1.00 18.53 C ATOM 3184 O ALA A 410 28.046 42.289 123.263 1.00 20.04 O ATOM 3185 CB ALA A 410 24.841 42.201 122.592 1.00 18.59 C ATOM 0 H ALA A 410 26.344 41.572 120.802 1.00 19.39 H new ATOM 0 HA ALA A 410 25.749 43.887 121.884 1.00 18.58 H new ATOM 0 HB1 ALA A 410 24.424 42.651 123.343 1.00 18.59 H new ATOM 0 HB2 ALA A 410 24.204 42.130 121.864 1.00 18.59 H new ATOM 0 HB3 ALA A 410 25.122 41.313 122.863 1.00 18.59 H new ATOM 3186 N GLN A 411 26.900 43.999 124.173 1.00 17.10 N ATOM 3187 CA GLN A 411 27.810 44.168 125.299 1.00 17.34 C ATOM 3188 C GLN A 411 26.997 44.128 126.582 1.00 13.87 C ATOM 3189 O GLN A 411 26.205 45.024 126.852 1.00 13.42 O ATOM 3190 CB GLN A 411 28.547 45.502 125.179 1.00 20.06 C ATOM 3191 CG GLN A 411 29.621 45.509 124.102 1.00 25.26 C ATOM 3192 CD GLN A 411 30.223 46.883 123.888 1.00 27.83 C ATOM 3193 OE1 GLN A 411 30.510 47.603 124.846 1.00 30.60 O ATOM 3194 NE2 GLN A 411 30.428 47.252 122.627 1.00 29.69 N ATOM 0 H GLN A 411 26.242 44.553 124.165 1.00 17.10 H new ATOM 0 HA GLN A 411 28.470 43.457 125.305 1.00 17.34 H new ATOM 0 HB2 GLN A 411 27.904 46.202 124.988 1.00 20.06 H new ATOM 0 HB3 GLN A 411 28.954 45.716 126.033 1.00 20.06 H new ATOM 0 HG2 GLN A 411 30.323 44.886 124.347 1.00 25.26 H new ATOM 0 HG3 GLN A 411 29.240 45.193 123.268 1.00 25.26 H new ATOM 0 HE21 GLN A 411 30.215 46.722 121.984 1.00 29.69 H new ATOM 0 HE22 GLN A 411 30.774 48.020 122.455 1.00 29.69 H new ATOM 3195 N THR A 412 27.204 43.079 127.371 1.00 13.49 N ATOM 3196 CA THR A 412 26.471 42.897 128.615 1.00 11.94 C ATOM 3197 C THR A 412 27.358 43.120 129.833 1.00 11.76 C ATOM 3198 O THR A 412 28.473 42.603 129.914 1.00 11.77 O ATOM 3199 CB THR A 412 25.876 41.482 128.677 1.00 13.05 C ATOM 3200 OG1 THR A 412 25.017 41.282 127.546 1.00 14.64 O ATOM 3201 CG2 THR A 412 25.086 41.291 129.953 1.00 13.27 C ATOM 0 H THR A 412 27.771 42.456 127.200 1.00 13.49 H new ATOM 0 HA THR A 412 25.761 43.557 128.630 1.00 11.94 H new ATOM 0 HB THR A 412 26.599 40.836 128.663 1.00 13.05 H new ATOM 0 HG1 THR A 412 25.437 40.873 126.944 1.00 14.64 H new ATOM 0 HG21 THR A 412 24.718 40.394 129.975 1.00 13.27 H new ATOM 0 HG22 THR A 412 25.669 41.420 130.717 1.00 13.27 H new ATOM 0 HG23 THR A 412 24.363 41.937 129.986 1.00 13.27 H new ATOM 3202 N THR A 413 26.845 43.891 130.783 1.00 10.79 N ATOM 3203 CA THR A 413 27.574 44.199 132.002 1.00 12.17 C ATOM 3204 C THR A 413 26.691 43.973 133.225 1.00 10.18 C ATOM 3205 O THR A 413 25.499 44.294 133.201 1.00 11.21 O ATOM 3206 CB THR A 413 28.019 45.685 132.008 1.00 12.93 C ATOM 3207 OG1 THR A 413 28.771 45.962 130.821 1.00 16.29 O ATOM 3208 CG2 THR A 413 28.883 45.998 133.238 1.00 13.46 C ATOM 0 H THR A 413 26.065 44.250 130.738 1.00 10.79 H new ATOM 0 HA THR A 413 28.348 43.616 132.034 1.00 12.17 H new ATOM 0 HB THR A 413 27.225 46.241 132.039 1.00 12.93 H new ATOM 0 HG1 THR A 413 28.252 46.226 130.216 1.00 16.29 H new ATOM 0 HG21 THR A 413 29.148 46.931 133.219 1.00 13.46 H new ATOM 0 HG22 THR A 413 28.373 45.824 134.045 1.00 13.46 H new ATOM 0 HG23 THR A 413 29.675 45.437 133.229 1.00 13.46 H new ATOM 3209 N VAL A 414 27.263 43.396 134.280 1.00 10.71 N ATOM 3210 CA VAL A 414 26.543 43.226 135.535 1.00 9.93 C ATOM 3211 C VAL A 414 27.277 44.117 136.541 1.00 10.94 C ATOM 3212 O VAL A 414 28.514 44.192 136.538 1.00 12.08 O ATOM 3213 CB VAL A 414 26.495 41.749 136.036 1.00 10.29 C ATOM 3214 CG1 VAL A 414 25.643 40.920 135.085 1.00 10.08 C ATOM 3215 CG2 VAL A 414 27.891 41.161 136.159 1.00 10.43 C ATOM 0 H VAL A 414 28.069 43.096 134.287 1.00 10.71 H new ATOM 0 HA VAL A 414 25.612 43.471 135.420 1.00 9.93 H new ATOM 0 HB VAL A 414 26.097 41.734 136.920 1.00 10.29 H new ATOM 0 HG11 VAL A 414 25.612 40.001 135.395 1.00 10.08 H new ATOM 0 HG12 VAL A 414 24.743 41.282 135.057 1.00 10.08 H new ATOM 0 HG13 VAL A 414 26.030 40.948 134.196 1.00 10.08 H new ATOM 0 HG21 VAL A 414 27.830 40.245 136.472 1.00 10.43 H new ATOM 0 HG22 VAL A 414 28.327 41.178 135.293 1.00 10.43 H new ATOM 0 HG23 VAL A 414 28.408 41.684 136.791 1.00 10.43 H new ATOM 3216 N TYR A 415 26.510 44.814 137.369 1.00 10.83 N ATOM 3217 CA TYR A 415 27.083 45.736 138.347 1.00 11.60 C ATOM 3218 C TYR A 415 27.081 45.136 139.743 1.00 12.11 C ATOM 3219 O TYR A 415 26.115 45.267 140.493 1.00 12.96 O ATOM 3220 CB TYR A 415 26.315 47.062 138.303 1.00 13.00 C ATOM 3221 CG TYR A 415 26.347 47.693 136.925 1.00 15.08 C ATOM 3222 CD1 TYR A 415 25.327 47.454 135.999 1.00 15.51 C ATOM 3223 CD2 TYR A 415 27.441 48.456 136.515 1.00 16.52 C ATOM 3224 CE1 TYR A 415 25.402 47.951 134.701 1.00 17.60 C ATOM 3225 CE2 TYR A 415 27.522 48.958 135.215 1.00 18.19 C ATOM 3226 CZ TYR A 415 26.500 48.699 134.315 1.00 18.88 C ATOM 3227 OH TYR A 415 26.578 49.177 133.025 1.00 20.63 O ATOM 0 H TYR A 415 25.651 44.769 137.382 1.00 10.83 H new ATOM 0 HA TYR A 415 28.011 45.903 138.118 1.00 11.60 H new ATOM 0 HB2 TYR A 415 25.394 46.910 138.567 1.00 13.00 H new ATOM 0 HB3 TYR A 415 26.697 47.677 138.948 1.00 13.00 H new ATOM 0 HD1 TYR A 415 24.586 46.954 136.255 1.00 15.51 H new ATOM 0 HD2 TYR A 415 28.127 48.633 137.117 1.00 16.52 H new ATOM 0 HE1 TYR A 415 24.717 47.781 134.096 1.00 17.60 H new ATOM 0 HE2 TYR A 415 28.258 49.464 134.954 1.00 18.19 H new ATOM 0 HH TYR A 415 27.291 49.611 132.930 1.00 20.63 H new ATOM 3228 N LEU A 416 28.177 44.456 140.063 1.00 14.08 N ATOM 3229 CA LEU A 416 28.343 43.808 141.358 1.00 16.55 C ATOM 3230 C LEU A 416 29.141 44.761 142.246 1.00 18.59 C ATOM 3231 O LEU A 416 28.872 45.959 142.248 1.00 19.12 O ATOM 3232 CB LEU A 416 29.067 42.470 141.168 1.00 16.95 C ATOM 3233 CG LEU A 416 28.453 41.565 140.085 1.00 17.64 C ATOM 3234 CD1 LEU A 416 29.199 40.238 140.028 1.00 18.64 C ATOM 3235 CD2 LEU A 416 26.978 41.330 140.375 1.00 18.85 C ATOM 0 H LEU A 416 28.847 44.357 139.533 1.00 14.08 H new ATOM 0 HA LEU A 416 27.489 43.618 141.776 1.00 16.55 H new ATOM 0 HB2 LEU A 416 29.994 42.645 140.941 1.00 16.95 H new ATOM 0 HB3 LEU A 416 29.067 41.992 142.012 1.00 16.95 H new ATOM 0 HG LEU A 416 28.534 42.005 139.224 1.00 17.64 H new ATOM 0 HD11 LEU A 416 28.806 39.675 139.343 1.00 18.64 H new ATOM 0 HD12 LEU A 416 30.132 40.400 139.816 1.00 18.64 H new ATOM 0 HD13 LEU A 416 29.135 39.794 140.888 1.00 18.64 H new ATOM 0 HD21 LEU A 416 26.600 40.759 139.688 1.00 18.85 H new ATOM 0 HD22 LEU A 416 26.882 40.901 141.240 1.00 18.85 H new ATOM 0 HD23 LEU A 416 26.510 42.180 140.382 1.00 18.85 H new ATOM 3236 N GLU A 417 30.104 44.253 143.007 1.00 20.55 N ATOM 3237 CA GLU A 417 30.896 45.155 143.839 1.00 23.06 C ATOM 3238 C GLU A 417 31.614 46.085 142.870 1.00 22.87 C ATOM 3239 O GLU A 417 31.951 47.224 143.199 1.00 24.00 O ATOM 3240 CB GLU A 417 31.896 44.375 144.695 1.00 25.39 C ATOM 3241 CG GLU A 417 31.224 43.495 145.741 1.00 29.91 C ATOM 3242 CD GLU A 417 32.159 43.094 146.865 1.00 32.49 C ATOM 3243 OE1 GLU A 417 33.235 42.526 146.578 1.00 34.63 O ATOM 3244 OE2 GLU A 417 31.812 43.345 148.038 1.00 34.79 O ATOM 0 H GLU A 417 30.311 43.420 143.058 1.00 20.55 H new ATOM 0 HA GLU A 417 30.338 45.650 144.459 1.00 23.06 H new ATOM 0 HB2 GLU A 417 32.445 43.821 144.118 1.00 25.39 H new ATOM 0 HB3 GLU A 417 32.491 45.000 145.139 1.00 25.39 H new ATOM 0 HG2 GLU A 417 30.463 43.967 146.113 1.00 29.91 H new ATOM 0 HG3 GLU A 417 30.880 42.696 145.312 1.00 29.91 H new ATOM 3245 N GLN A 418 31.823 45.579 141.660 1.00 22.74 N ATOM 3246 CA GLN A 418 32.455 46.326 140.581 1.00 22.24 C ATOM 3247 C GLN A 418 31.820 45.836 139.283 1.00 20.09 C ATOM 3248 O GLN A 418 31.286 44.727 139.234 1.00 19.47 O ATOM 3249 CB GLN A 418 33.961 46.069 140.565 1.00 24.94 C ATOM 3250 CG GLN A 418 34.691 46.675 141.752 1.00 30.04 C ATOM 3251 CD GLN A 418 36.170 46.350 141.756 1.00 32.62 C ATOM 3252 OE1 GLN A 418 36.861 46.539 140.756 1.00 34.82 O ATOM 3253 NE2 GLN A 418 36.666 45.866 142.891 1.00 34.55 N ATOM 0 H GLN A 418 31.598 44.779 141.440 1.00 22.74 H new ATOM 0 HA GLN A 418 32.326 47.280 140.696 1.00 22.24 H new ATOM 0 HB2 GLN A 418 34.119 45.112 140.552 1.00 24.94 H new ATOM 0 HB3 GLN A 418 34.335 46.430 139.746 1.00 24.94 H new ATOM 0 HG2 GLN A 418 34.575 47.638 141.741 1.00 30.04 H new ATOM 0 HG3 GLN A 418 34.290 46.351 142.574 1.00 30.04 H new ATOM 0 HE21 GLN A 418 36.151 45.748 143.569 1.00 34.55 H new ATOM 0 HE22 GLN A 418 37.502 45.671 142.947 1.00 34.55 H new ATOM 3254 N PRO A 419 31.843 46.659 138.224 1.00 18.92 N ATOM 3255 CA PRO A 419 31.246 46.232 136.952 1.00 18.06 C ATOM 3256 C PRO A 419 32.007 45.056 136.357 1.00 18.03 C ATOM 3257 O PRO A 419 33.233 44.984 136.450 1.00 18.14 O ATOM 3258 CB PRO A 419 31.357 47.479 136.077 1.00 18.41 C ATOM 3259 CG PRO A 419 31.354 48.608 137.081 1.00 19.56 C ATOM 3260 CD PRO A 419 32.252 48.073 138.164 1.00 19.41 C ATOM 0 HA PRO A 419 30.332 45.920 137.043 1.00 18.06 H new ATOM 0 HB2 PRO A 419 32.169 47.473 135.547 1.00 18.41 H new ATOM 0 HB3 PRO A 419 30.614 47.549 135.457 1.00 18.41 H new ATOM 0 HG2 PRO A 419 31.696 49.432 136.701 1.00 19.56 H new ATOM 0 HG3 PRO A 419 30.462 48.797 137.411 1.00 19.56 H new ATOM 0 HD2 PRO A 419 33.191 48.171 137.940 1.00 19.41 H new ATOM 0 HD3 PRO A 419 32.113 48.528 139.009 1.00 19.41 H new ATOM 3261 N GLU A 420 31.282 44.128 135.745 1.00 16.93 N ATOM 3262 CA GLU A 420 31.913 42.967 135.135 1.00 16.56 C ATOM 3263 C GLU A 420 31.266 42.649 133.798 1.00 15.17 C ATOM 3264 O GLU A 420 30.040 42.593 133.696 1.00 14.79 O ATOM 3265 CB GLU A 420 31.797 41.750 136.057 1.00 18.72 C ATOM 3266 CG GLU A 420 32.687 41.807 137.285 1.00 22.47 C ATOM 3267 CD GLU A 420 32.544 40.579 138.168 1.00 23.33 C ATOM 3268 OE1 GLU A 420 32.378 39.467 137.623 1.00 22.90 O ATOM 3269 OE2 GLU A 420 32.615 40.727 139.407 1.00 27.06 O ATOM 0 H GLU A 420 30.425 44.152 135.672 1.00 16.93 H new ATOM 0 HA GLU A 420 32.850 43.174 134.994 1.00 16.56 H new ATOM 0 HB2 GLU A 420 30.874 41.662 136.343 1.00 18.72 H new ATOM 0 HB3 GLU A 420 32.014 40.952 135.550 1.00 18.72 H new ATOM 0 HG2 GLU A 420 33.612 41.895 137.006 1.00 22.47 H new ATOM 0 HG3 GLU A 420 32.470 42.599 137.801 1.00 22.47 H new ATOM 3270 N ALA A 421 32.092 42.461 132.772 1.00 14.06 N ATOM 3271 CA ALA A 421 31.596 42.122 131.445 1.00 13.19 C ATOM 3272 C ALA A 421 31.233 40.641 131.443 1.00 13.55 C ATOM 3273 O ALA A 421 31.972 39.813 131.974 1.00 14.65 O ATOM 3274 CB ALA A 421 32.664 42.395 130.396 1.00 14.22 C ATOM 0 H ALA A 421 32.948 42.526 132.826 1.00 14.06 H new ATOM 0 HA ALA A 421 30.819 42.662 131.232 1.00 13.19 H new ATOM 0 HB1 ALA A 421 32.322 42.165 129.518 1.00 14.22 H new ATOM 0 HB2 ALA A 421 32.903 43.335 130.414 1.00 14.22 H new ATOM 0 HB3 ALA A 421 33.450 41.859 130.587 1.00 14.22 H new ATOM 3275 N ILE A 422 30.094 40.313 130.845 1.00 12.18 N ATOM 3276 CA ILE A 422 29.647 38.925 130.784 1.00 12.99 C ATOM 3277 C ILE A 422 29.562 38.474 129.328 1.00 13.27 C ATOM 3278 O ILE A 422 28.862 39.091 128.524 1.00 16.02 O ATOM 3279 CB ILE A 422 28.252 38.763 131.445 1.00 12.39 C ATOM 3280 CG1 ILE A 422 28.323 39.137 132.932 1.00 14.04 C ATOM 3281 CG2 ILE A 422 27.753 37.334 131.281 1.00 12.89 C ATOM 3282 CD1 ILE A 422 29.267 38.278 133.762 1.00 15.51 C ATOM 0 H ILE A 422 29.565 40.877 130.469 1.00 12.18 H new ATOM 0 HA ILE A 422 30.289 38.379 131.265 1.00 12.99 H new ATOM 0 HB ILE A 422 27.627 39.361 131.005 1.00 12.39 H new ATOM 0 HG12 ILE A 422 28.599 40.064 133.007 1.00 14.04 H new ATOM 0 HG13 ILE A 422 27.432 39.075 133.311 1.00 14.04 H new ATOM 0 HG21 ILE A 422 26.882 37.246 131.698 1.00 12.89 H new ATOM 0 HG22 ILE A 422 27.683 37.122 130.337 1.00 12.89 H new ATOM 0 HG23 ILE A 422 28.376 36.723 131.704 1.00 12.89 H new ATOM 0 HD11 ILE A 422 29.252 38.579 134.684 1.00 15.51 H new ATOM 0 HD12 ILE A 422 28.983 37.352 133.720 1.00 15.51 H new ATOM 0 HD13 ILE A 422 30.168 38.355 133.411 1.00 15.51 H new ATOM 3283 N ASP A 423 30.284 37.408 128.988 1.00 13.76 N ATOM 3284 CA ASP A 423 30.254 36.889 127.626 1.00 14.56 C ATOM 3285 C ASP A 423 29.723 35.460 127.545 1.00 13.04 C ATOM 3286 O ASP A 423 29.701 34.867 126.466 1.00 14.01 O ATOM 3287 CB ASP A 423 31.644 36.969 126.983 1.00 17.55 C ATOM 3288 CG ASP A 423 32.695 36.204 127.754 1.00 18.79 C ATOM 3289 OD1 ASP A 423 33.889 36.333 127.402 1.00 23.42 O ATOM 3290 OD2 ASP A 423 32.352 35.473 128.707 1.00 18.95 O ATOM 0 H ASP A 423 30.794 36.975 129.528 1.00 13.76 H new ATOM 0 HA ASP A 423 29.636 37.452 127.133 1.00 14.56 H new ATOM 0 HB2 ASP A 423 31.597 36.622 126.078 1.00 17.55 H new ATOM 0 HB3 ASP A 423 31.911 37.899 126.917 1.00 17.55 H new ATOM 3291 N TYR A 424 29.295 34.914 128.684 1.00 10.81 N ATOM 3292 CA TYR A 424 28.731 33.563 128.755 1.00 11.15 C ATOM 3293 C TYR A 424 29.685 32.437 128.351 1.00 11.95 C ATOM 3294 O TYR A 424 29.252 31.330 128.034 1.00 10.89 O ATOM 3295 CB TYR A 424 27.457 33.498 127.902 1.00 11.34 C ATOM 3296 CG TYR A 424 26.447 34.567 128.263 1.00 10.11 C ATOM 3297 CD1 TYR A 424 25.567 34.402 129.335 1.00 8.56 C ATOM 3298 CD2 TYR A 424 26.377 35.753 127.533 1.00 10.75 C ATOM 3299 CE1 TYR A 424 24.639 35.391 129.665 1.00 9.14 C ATOM 3300 CE2 TYR A 424 25.454 36.749 127.853 1.00 11.14 C ATOM 3301 CZ TYR A 424 24.586 36.563 128.915 1.00 9.08 C ATOM 3302 OH TYR A 424 23.655 37.538 129.196 1.00 10.04 O ATOM 0 H TYR A 424 29.324 35.319 129.442 1.00 10.81 H new ATOM 0 HA TYR A 424 28.539 33.408 129.693 1.00 11.15 H new ATOM 0 HB2 TYR A 424 27.696 33.589 126.966 1.00 11.34 H new ATOM 0 HB3 TYR A 424 27.048 32.625 128.007 1.00 11.34 H new ATOM 0 HD1 TYR A 424 25.600 33.620 129.837 1.00 8.56 H new ATOM 0 HD2 TYR A 424 26.958 35.883 126.818 1.00 10.75 H new ATOM 0 HE1 TYR A 424 24.059 35.268 130.382 1.00 9.14 H new ATOM 0 HE2 TYR A 424 25.422 37.534 127.355 1.00 11.14 H new ATOM 0 HH TYR A 424 23.474 37.525 130.016 1.00 10.04 H new ATOM 3303 N LYS A 425 30.987 32.711 128.387 1.00 14.00 N ATOM 3304 CA LYS A 425 31.982 31.704 128.020 1.00 18.57 C ATOM 3305 C LYS A 425 32.523 30.998 129.255 1.00 22.31 C ATOM 3306 O LYS A 425 32.354 31.466 130.373 1.00 22.08 O ATOM 3307 CB LYS A 425 33.158 32.350 127.276 1.00 18.32 C ATOM 3308 CG LYS A 425 32.804 33.044 125.966 1.00 18.88 C ATOM 3309 CD LYS A 425 34.053 33.652 125.332 1.00 21.06 C ATOM 3310 CE LYS A 425 33.727 34.465 124.090 1.00 21.80 C ATOM 3311 NZ LYS A 425 34.963 35.057 123.493 1.00 25.24 N ATOM 0 H LYS A 425 31.315 33.471 128.620 1.00 14.00 H new ATOM 0 HA LYS A 425 31.541 31.060 127.444 1.00 18.57 H new ATOM 0 HB2 LYS A 425 33.576 32.998 127.864 1.00 18.32 H new ATOM 0 HB3 LYS A 425 33.820 31.665 127.092 1.00 18.32 H new ATOM 0 HG2 LYS A 425 32.401 32.408 125.355 1.00 18.88 H new ATOM 0 HG3 LYS A 425 32.146 33.738 126.128 1.00 18.88 H new ATOM 0 HD2 LYS A 425 34.500 34.219 125.980 1.00 21.06 H new ATOM 0 HD3 LYS A 425 34.674 32.944 125.100 1.00 21.06 H new ATOM 0 HE2 LYS A 425 33.288 33.899 123.436 1.00 21.80 H new ATOM 0 HE3 LYS A 425 33.104 35.172 124.318 1.00 21.80 H new ATOM 0 HZ1 LYS A 425 34.796 35.890 123.229 1.00 25.24 H new ATOM 0 HZ2 LYS A 425 35.613 35.064 124.101 1.00 25.24 H new ATOM 0 HZ3 LYS A 425 35.218 34.570 122.793 1.00 25.24 H new ATOM 3312 N ARG A 426 33.175 29.861 129.045 1.00 27.15 N ATOM 3313 CA ARG A 426 33.777 29.113 130.142 1.00 31.40 C ATOM 3314 C ARG A 426 35.237 28.841 129.794 1.00 32.64 C ATOM 3315 O ARG A 426 35.671 29.280 128.705 1.00 34.24 O ATOM 3316 CB ARG A 426 33.047 27.785 130.377 1.00 33.40 C ATOM 3317 CG ARG A 426 33.473 27.089 131.669 1.00 35.70 C ATOM 3318 CD ARG A 426 32.747 25.763 131.918 1.00 37.71 C ATOM 3319 NE ARG A 426 33.363 24.631 131.226 1.00 39.22 N ATOM 3320 CZ ARG A 426 33.234 24.372 129.928 1.00 39.59 C ATOM 3321 NH1 ARG A 426 32.501 25.165 129.156 1.00 40.69 N ATOM 3322 NH2 ARG A 426 33.845 23.319 129.400 1.00 39.01 N ATOM 3323 OXT ARG A 426 35.930 28.196 130.608 1.00 34.50 O ATOM 0 H ARG A 426 33.281 29.503 128.270 1.00 27.15 H new ATOM 0 HA ARG A 426 33.710 29.636 130.956 1.00 31.40 H new ATOM 0 HB2 ARG A 426 32.091 27.948 130.403 1.00 33.40 H new ATOM 0 HB3 ARG A 426 33.214 27.193 129.627 1.00 33.40 H new ATOM 0 HG2 ARG A 426 34.429 26.926 131.640 1.00 35.70 H new ATOM 0 HG3 ARG A 426 33.310 27.684 132.417 1.00 35.70 H new ATOM 0 HD2 ARG A 426 32.732 25.583 132.871 1.00 37.71 H new ATOM 0 HD3 ARG A 426 31.824 25.847 131.631 1.00 37.71 H new ATOM 0 HE ARG A 426 33.844 24.093 131.693 1.00 39.22 H new ATOM 0 HH11 ARG A 426 32.107 25.850 129.495 1.00 40.69 H new ATOM 0 HH12 ARG A 426 32.420 24.994 128.317 1.00 40.69 H new ATOM 0 HH21 ARG A 426 34.323 22.805 129.897 1.00 39.01 H new ATOM 0 HH22 ARG A 426 33.763 23.150 128.561 1.00 39.01 H new TER 3324 ARG A 426 HETATM 3325 FE FE A 500 8.234 23.474 102.636 1.00 8.58 FE HETATM 3326 N1 FPY A 501 3.998 23.828 102.258 1.00 11.06 N HETATM 3327 C2 FPY A 501 4.130 22.445 102.445 1.00 10.42 C HETATM 3328 O2 FPY A 501 3.605 21.569 101.742 1.00 11.37 O HETATM 3329 N3 FPY A 501 4.928 22.092 103.525 1.00 10.13 N HETATM 3330 C4 FPY A 501 5.579 22.988 104.411 1.00 10.55 C HETATM 3331 O4 FPY A 501 7.038 22.813 104.084 1.00 9.89 O HETATM 3332 C5 FPY A 501 5.388 24.415 104.171 1.00 11.44 C HETATM 3333 F5 FPY A 501 5.934 25.301 104.959 1.00 11.64 F HETATM 3334 C6 FPY A 501 4.633 24.808 103.134 1.00 12.23 C HETATM 0 HN3 FPY A 501 5.038 21.252 103.670 1.00 10.13 H new HETATM 0 HN1 FPY A 501 3.523 24.111 101.599 1.00 11.06 H new HETATM 0 H6 FPY A 501 4.508 25.755 102.964 1.00 12.23 H new HETATM 0 H4 FPY A 501 5.244 22.785 105.299 1.00 10.55 H new HETATM 3335 C1 GOL A 502 1.207 33.743 82.698 1.00 22.38 C HETATM 3336 O1 GOL A 502 -0.378 33.869 83.014 1.00 22.21 O HETATM 3337 C2 GOL A 502 2.124 34.789 82.771 1.00 20.29 C HETATM 3338 O2 GOL A 502 1.547 35.911 83.086 1.00 22.80 O HETATM 3339 C3 GOL A 502 3.237 34.400 82.530 1.00 24.17 C HETATM 3340 O3 GOL A 502 4.420 33.490 82.176 1.00 16.28 O HETATM 0 HO3 GOL A 502 4.209 32.993 81.533 1.00 16.28 H new HETATM 0 HO1 GOL A 502 -0.745 33.121 82.908 1.00 22.21 H new HETATM 0 H12 GOL A 502 1.543 33.053 83.292 1.00 22.38 H new HETATM 0 H11 GOL A 502 1.271 33.396 81.795 1.00 22.38 H new HETATM 3341 O HOH A 601 15.007 31.918 113.134 1.00 6.59 O HETATM 3342 O HOH A 602 0.764 14.841 109.820 1.00 7.41 O HETATM 3343 O HOH A 603 17.982 18.731 94.810 1.00 6.77 O HETATM 3344 O HOH A 604 6.396 5.018 96.731 1.00 6.58 O HETATM 3345 O HOH A 605 12.132 15.887 109.055 1.00 6.21 O HETATM 3346 O HOH A 606 1.566 20.251 126.478 1.00 7.85 O HETATM 3347 O HOH A 607 34.087 23.232 114.865 1.00 9.61 O HETATM 3348 O HOH A 608 9.417 9.265 104.232 1.00 6.25 O HETATM 3349 O HOH A 609 15.983 26.456 118.708 1.00 6.94 O HETATM 3350 O HOH A 610 5.814 2.366 96.606 1.00 6.54 O HETATM 3351 O HOH A 611 7.842 31.544 104.874 1.00 7.67 O HETATM 3352 O HOH A 612 12.598 24.451 110.417 1.00 6.21 O HETATM 3353 O HOH A 613 11.040 34.112 83.029 1.00 8.81 O HETATM 3354 O HOH A 614 -6.194 7.237 91.401 1.00 8.76 O HETATM 3355 O HOH A 615 16.638 30.937 106.493 1.00 7.04 O HETATM 3356 O HOH A 616 3.424 31.394 91.181 1.00 7.66 O HETATM 3357 O HOH A 617 21.235 24.449 106.196 1.00 7.06 O HETATM 3358 O HOH A 618 14.087 22.203 100.006 1.00 7.68 O HETATM 3359 O HOH A 619 22.061 31.832 109.942 1.00 8.58 O HETATM 3360 O HOH A 620 11.627 32.997 116.382 1.00 9.85 O HETATM 3361 O HOH A 621 6.367 3.054 89.957 1.00 8.71 O HETATM 3362 O HOH A 622 12.214 30.246 116.113 1.00 7.09 O HETATM 3363 O HOH A 623 25.703 37.031 104.158 1.00 8.89 O HETATM 3364 O HOH A 624 2.984 15.297 93.684 1.00 6.72 O HETATM 3365 O HOH A 625 13.871 14.391 104.449 1.00 6.34 O HETATM 3366 O HOH A 626 1.547 23.154 89.117 1.00 9.04 O HETATM 3367 O HOH A 627 0.588 16.042 112.478 1.00 9.58 O HETATM 3368 O HOH A 628 20.285 34.951 93.096 1.00 8.27 O HETATM 3369 O HOH A 629 35.588 26.011 107.443 1.00 9.67 O HETATM 3370 O HOH A 630 -6.339 4.749 92.576 1.00 7.26 O HETATM 3371 O HOH A 631 32.367 28.986 99.986 1.00 10.84 O HETATM 3372 O HOH A 632 24.291 36.851 101.839 1.00 7.71 O HETATM 3373 O HOH A 633 8.763 20.854 96.429 1.00 8.95 O HETATM 3374 O HOH A 634 6.475 14.769 82.771 1.00 10.62 O HETATM 3375 O HOH A 635 31.563 22.004 110.578 1.00 12.42 O HETATM 3376 O HOH A 636 5.957 1.826 108.088 1.00 8.76 O HETATM 3377 O HOH A 637 -5.444 16.686 99.023 1.00 10.60 O HETATM 3378 O HOH A 638 25.630 15.931 114.315 1.00 13.36 O HETATM 3379 O HOH A 639 -2.932 3.726 110.127 1.00 9.75 O HETATM 3380 O HOH A 640 22.533 13.174 86.219 1.00 12.13 O HETATM 3381 O HOH A 641 5.667 10.710 111.645 1.00 7.29 O HETATM 3382 O HOH A 642 15.404 34.646 116.722 1.00 8.90 O HETATM 3383 O HOH A 643 -9.280 12.558 90.459 1.00 10.15 O HETATM 3384 O HOH A 644 23.622 10.716 100.538 1.00 14.54 O HETATM 3385 O HOH A 645 -1.403 10.595 98.214 1.00 9.12 O HETATM 3386 O HOH A 646 -1.845 19.576 82.836 1.00 14.08 O HETATM 3387 O HOH A 647 3.826 38.585 89.131 1.00 11.87 O HETATM 3388 O HOH A 648 5.582 27.947 98.462 1.00 10.67 O HETATM 3389 O HOH A 649 3.185 5.757 99.708 1.00 9.43 O HETATM 3390 O HOH A 650 20.409 19.307 86.666 1.00 12.63 O HETATM 3391 O HOH A 651 -1.384 2.144 101.987 1.00 12.53 O HETATM 3392 O HOH A 652 1.494 32.688 92.692 1.00 9.55 O HETATM 3393 O HOH A 653 -5.743 19.667 94.813 1.00 10.34 O HETATM 3394 O HOH A 654 20.672 18.600 94.240 1.00 8.74 O HETATM 3395 O HOH A 655 22.707 28.637 95.933 1.00 10.76 O HETATM 3396 O HOH A 656 32.094 21.731 113.306 1.00 11.75 O HETATM 3397 O HOH A 657 2.195 44.697 91.974 1.00 15.06 O HETATM 3398 O HOH A 658 22.697 31.586 112.664 1.00 11.32 O HETATM 3399 O HOH A 659 17.561 -3.563 101.681 1.00 12.33 O HETATM 3400 O HOH A 660 24.240 37.839 112.425 1.00 10.94 O HETATM 3401 O HOH A 661 8.662 28.037 76.481 1.00 9.32 O HETATM 3402 O HOH A 662 25.989 14.461 96.034 1.00 17.79 O HETATM 3403 O HOH A 663 0.056 13.228 114.582 1.00 9.61 O HETATM 3404 O HOH A 664 -0.528 22.313 90.671 1.00 9.28 O HETATM 3405 O HOH A 665 4.124 18.760 102.107 1.00 9.88 O HETATM 3406 O HOH A 666 26.330 16.872 111.779 1.00 13.67 O HETATM 3407 O HOH A 667 27.469 23.181 115.753 1.00 7.76 O HETATM 3408 O HOH A 668 22.840 39.240 127.226 1.00 17.37 O HETATM 3409 O HOH A 669 30.926 26.906 124.780 1.00 10.89 O HETATM 3410 O HOH A 670 19.043 23.823 88.090 1.00 11.91 O HETATM 3411 O HOH A 671 22.654 27.765 93.249 1.00 12.78 O HETATM 3412 O HOH A 672 33.298 29.537 97.500 1.00 12.95 O HETATM 3413 O HOH A 673 30.002 29.811 98.346 1.00 12.36 O HETATM 3414 O HOH A 674 -1.363 31.236 110.510 1.00 19.70 O HETATM 3415 O HOH A 675 26.148 40.071 110.478 1.00 11.04 O HETATM 3416 O HOH A 676 31.191 24.020 108.694 1.00 11.02 O HETATM 3417 O HOH A 677 0.601 5.055 89.762 1.00 14.68 O HETATM 3418 O HOH A 678 2.956 27.255 99.163 1.00 12.10 O HETATM 3419 O HOH A 679 35.422 24.269 104.079 1.00 11.28 O HETATM 3420 O HOH A 680 9.474 37.289 85.888 1.00 11.92 O HETATM 3421 O HOH A 681 7.037 -0.579 100.472 1.00 11.41 O HETATM 3422 O HOH A 682 1.190 27.858 112.016 1.00 15.56 O HETATM 3423 O HOH A 683 2.780 2.630 100.886 1.00 10.88 O HETATM 3424 O HOH A 684 41.435 25.397 113.785 1.00 18.16 O HETATM 3425 O HOH A 685 -0.040 2.840 94.340 1.00 15.04 O HETATM 3426 O HOH A 686 29.069 13.936 125.172 1.00 14.54 O HETATM 3427 O HOH A 687 24.750 33.201 113.341 1.00 14.63 O HETATM 3428 O HOH A 688 25.216 33.865 124.244 1.00 17.07 O HETATM 3429 O HOH A 689 11.233 44.687 101.329 1.00 19.19 O HETATM 3430 O HOH A 690 22.991 35.485 113.066 1.00 17.22 O HETATM 3431 O HOH A 691 21.696 9.155 99.956 1.00 13.57 O HETATM 3432 O HOH A 692 -1.758 10.993 102.001 1.00 14.89 O HETATM 3433 O HOH A 693 -5.380 25.806 86.899 1.00 16.48 O HETATM 3434 O HOH A 694 27.714 34.987 124.006 1.00 15.72 O HETATM 3435 O HOH A 695 12.187 13.132 80.006 1.00 14.18 O HETATM 3436 O HOH A 696 3.062 24.012 79.941 1.00 14.56 O HETATM 3437 O HOH A 697 16.153 -1.087 99.517 1.00 9.69 O HETATM 3438 O HOH A 698 7.961 43.544 86.363 1.00 14.33 O HETATM 3439 O HOH A 699 24.294 11.517 90.811 1.00 20.12 O HETATM 3440 O HOH A 700 13.868 27.201 80.808 1.00 19.35 O HETATM 3441 O HOH A 701 -0.650 25.665 118.378 1.00 13.08 O HETATM 3442 O HOH A 702 2.573 31.144 94.818 1.00 12.29 O HETATM 3443 O HOH A 703 55.877 30.046 111.754 1.00 18.04 O HETATM 3444 O HOH A 704 12.682 13.047 116.489 1.00 15.69 O HETATM 3445 O HOH A 705 35.506 44.474 102.223 1.00 22.39 O HETATM 3446 O HOH A 706 21.946 7.953 91.777 1.00 14.68 O HETATM 3447 O HOH A 707 12.603 44.843 94.239 1.00 18.48 O HETATM 3448 O HOH A 708 17.815 9.228 119.953 1.00 17.60 O HETATM 3449 O HOH A 709 0.118 9.128 102.704 1.00 14.30 O HETATM 3450 O HOH A 710 -2.116 17.816 85.346 1.00 20.00 O HETATM 3451 O HOH A 711 2.132 16.916 108.392 1.00 11.62 O HETATM 3452 O HOH A 712 23.096 22.001 89.469 1.00 15.94 O HETATM 3453 O HOH A 713 18.506 31.723 119.079 1.00 20.08 O HETATM 3454 O HOH A 714 48.340 27.368 115.360 1.00 19.32 O HETATM 3455 O HOH A 715 -1.028 10.665 114.870 1.00 17.07 O HETATM 3456 O HOH A 716 23.716 12.954 98.508 1.00 15.20 O HETATM 3457 O HOH A 717 35.552 36.689 115.642 1.00 19.17 O HETATM 3458 O HOH A 718 15.781 0.266 111.557 1.00 18.17 O HETATM 3459 O HOH A 719 0.327 41.430 90.390 1.00 17.78 O HETATM 3460 O HOH A 720 5.021 22.824 77.879 1.00 21.88 O HETATM 3461 O HOH A 721 25.662 12.422 106.373 1.00 20.75 O HETATM 3462 O HOH A 722 -2.791 26.548 98.710 1.00 18.65 O HETATM 3463 O HOH A 723 0.331 8.600 113.186 1.00 23.55 O HETATM 3464 O HOH A 724 24.084 16.335 95.701 1.00 16.85 O HETATM 3465 O HOH A 725 18.580 26.361 86.624 1.00 22.94 O HETATM 3466 O HOH A 726 44.210 39.324 116.998 1.00 23.58 O HETATM 3467 O HOH A 727 2.804 5.388 88.173 1.00 17.67 O HETATM 3468 O HOH A 728 -2.320 34.485 92.629 1.00 18.74 O HETATM 3469 O HOH A 729 -5.770 32.730 105.581 1.00 17.40 O HETATM 3470 O HOH A 730 12.358 1.867 114.392 1.00 20.45 O HETATM 3471 O HOH A 731 52.355 27.357 107.074 1.00 23.31 O HETATM 3472 O HOH A 732 19.159 23.513 83.164 1.00 17.10 O HETATM 3473 O HOH A 733 31.291 35.860 121.118 1.00 20.00 O HETATM 3474 O HOH A 734 39.793 42.940 111.255 1.00 22.55 O HETATM 3475 O HOH A 735 15.869 34.911 87.368 1.00 17.81 O HETATM 3476 O HOH A 736 43.366 37.131 118.497 1.00 22.89 O HETATM 3477 O HOH A 737 -4.335 30.485 118.346 1.00 33.41 O HETATM 3478 O HOH A 738 22.878 23.812 91.519 1.00 16.97 O HETATM 3479 O HOH A 739 9.876 -1.462 114.703 1.00 15.73 O HETATM 3480 O HOH A 740 -0.703 29.774 82.862 1.00 13.82 O HETATM 3481 O HOH A 741 20.905 11.357 84.622 1.00 16.73 O HETATM 3482 O HOH A 742 0.338 18.501 110.035 1.00 11.84 O HETATM 3483 O HOH A 743 39.751 24.829 104.804 1.00 22.22 O HETATM 3484 O HOH A 744 6.473 17.219 79.109 1.00 17.96 O HETATM 3485 O HOH A 745 46.883 40.087 116.543 1.00 21.57 O HETATM 3486 O HOH A 746 46.923 26.451 99.994 1.00 28.09 O HETATM 3487 O HOH A 747 10.217 9.263 84.729 1.00 21.06 O HETATM 3488 O HOH A 748 48.182 40.293 108.917 1.00 21.29 O HETATM 3489 O HOH A 749 46.738 37.607 99.042 1.00 22.70 O HETATM 3490 O HOH A 750 35.430 22.906 97.198 1.00 22.65 O HETATM 3491 O HOH A 751 26.189 15.315 126.237 1.00 20.93 O HETATM 3492 O HOH A 752 31.630 13.377 121.923 1.00 26.82 O HETATM 3493 O HOH A 753 38.560 24.460 115.184 1.00 26.38 O HETATM 3494 O HOH A 754 33.702 17.230 116.629 1.00 23.76 O HETATM 3495 O HOH A 755 -5.134 28.024 88.830 1.00 19.22 O HETATM 3496 O HOH A 756 14.956 17.749 76.368 1.00 25.61 O HETATM 3497 O HOH A 757 27.231 26.152 92.022 1.00 28.16 O HETATM 3498 O HOH A 758 42.824 24.117 99.392 1.00 22.03 O HETATM 3499 O HOH A 759 18.549 35.958 113.714 1.00 16.52 O HETATM 3500 O HOH A 760 38.798 24.970 94.152 1.00 28.83 O HETATM 3501 O HOH A 761 27.490 11.152 107.948 1.00 18.76 O HETATM 3502 O HOH A 762 20.849 29.684 91.686 1.00 18.34 O HETATM 3503 O HOH A 763 -6.239 27.472 95.647 1.00 18.13 O HETATM 3504 O HOH A 764 33.561 19.340 113.323 1.00 19.89 O HETATM 3505 O HOH A 765 28.267 27.391 94.386 1.00 23.61 O HETATM 3506 O HOH A 766 16.217 31.403 86.762 1.00 22.16 O HETATM 3507 O HOH A 767 29.815 15.158 107.088 1.00 26.95 O HETATM 3508 O HOH A 768 -8.406 8.333 89.877 1.00 17.08 O HETATM 3509 O HOH A 769 14.315 43.551 88.558 1.00 28.40 O HETATM 3510 O HOH A 770 -1.462 41.450 98.230 1.00 33.08 O HETATM 3511 O HOH A 771 47.434 27.634 96.944 1.00 32.97 O HETATM 3512 O HOH A 772 10.800 40.721 84.609 1.00 21.22 O HETATM 3513 O HOH A 773 22.011 3.943 110.718 1.00 27.61 O HETATM 3514 O HOH A 774 44.456 19.822 111.909 1.00 22.21 O HETATM 3515 O HOH A 775 33.210 23.656 95.435 1.00 24.25 O HETATM 3516 O HOH A 776 27.789 19.731 95.734 1.00 24.51 O HETATM 3517 O HOH A 777 39.321 40.498 98.559 1.00 25.05 O HETATM 3518 O HOH A 778 30.424 33.199 94.245 1.00 33.33 O HETATM 3519 O HOH A 779 26.025 39.696 120.119 1.00 25.85 O HETATM 3520 O HOH A 780 -6.094 30.213 95.888 1.00 17.44 O HETATM 3521 O HOH A 781 -0.789 17.254 119.400 1.00 18.98 O HETATM 3522 O HOH A 782 1.188 30.857 111.497 1.00 14.50 O HETATM 3523 O HOH A 783 29.213 47.808 140.053 1.00 24.03 O HETATM 3524 O HOH A 784 39.368 20.512 107.070 1.00 32.51 O HETATM 3525 O HOH A 785 20.504 27.714 89.905 1.00 26.45 O HETATM 3526 O HOH A 786 20.960 43.994 92.161 1.00 21.02 O HETATM 3527 O HOH A 787 -3.316 27.410 117.508 1.00 30.04 O HETATM 3528 O HOH A 788 32.983 28.598 127.129 1.00 20.55 O HETATM 3529 O HOH A 789 -1.767 8.347 118.232 1.00 34.45 O HETATM 3530 O HOH A 790 39.643 29.034 90.394 1.00 32.42 O HETATM 3531 O HOH A 791 24.569 34.845 92.652 1.00 24.41 O HETATM 3532 O HOH A 792 3.536 4.738 113.979 1.00 27.85 O HETATM 3533 O HOH A 793 20.634 5.369 116.500 1.00 26.84 O HETATM 3534 O HOH A 794 47.702 37.486 101.592 1.00 24.79 O HETATM 3535 O HOH A 795 27.098 46.849 128.777 1.00 24.68 O HETATM 3536 O HOH A 796 6.191 19.395 109.127 1.00 8.06 O HETATM 3537 O HOH A 797 19.993 -2.152 105.230 1.00 23.19 O HETATM 3538 O HOH A 798 -5.984 19.184 109.692 1.00 27.90 O HETATM 3539 O HOH A 799 -3.390 18.576 118.480 1.00 30.24 O HETATM 3540 O HOH A 800 35.996 29.647 91.593 1.00 34.36 O HETATM 3541 O HOH A 801 -6.105 37.870 111.311 1.00 32.32 O HETATM 3542 O HOH A 802 -9.002 35.106 99.595 1.00 25.39 O HETATM 3543 O HOH A 803 34.453 23.438 123.525 1.00 24.27 O HETATM 3544 O HOH A 804 0.117 37.674 87.555 1.00 16.73 O HETATM 3545 O HOH A 805 31.814 35.389 94.940 1.00 28.63 O HETATM 3546 O HOH A 806 12.598 10.173 83.754 1.00 28.36 O HETATM 3547 O HOH A 807 29.557 13.527 115.383 1.00 24.09 O HETATM 3548 O HOH A 808 34.363 35.661 93.203 1.00 29.38 O HETATM 3549 O HOH A 809 20.619 30.089 87.926 1.00 30.27 O HETATM 3550 O HOH A 810 31.777 32.852 132.345 1.00 36.24 O HETATM 3551 O HOH A 811 18.957 16.303 81.056 1.00 28.40 O HETATM 3552 O HOH A 812 22.409 1.389 106.890 1.00 42.02 O HETATM 3553 O HOH A 813 27.990 31.779 95.298 1.00 29.64 O HETATM 3554 O HOH A 814 0.671 6.260 100.710 1.00 25.04 O HETATM 3555 O HOH A 815 22.558 2.448 104.346 1.00 38.94 O HETATM 3556 O HOH A 816 37.532 22.228 107.979 1.00 20.50 O HETATM 3557 O HOH A 817 41.812 42.623 115.600 1.00 26.15 O HETATM 3558 O HOH A 818 35.012 32.933 121.407 1.00 29.83 O HETATM 3559 O HOH A 819 41.029 25.436 116.744 1.00 35.55 O HETATM 3560 O HOH A 820 29.462 48.039 127.172 1.00 42.17 O HETATM 3561 O HOH A 821 7.614 39.544 85.799 1.00 20.89 O HETATM 3562 O HOH A 822 -4.695 26.651 84.298 1.00 29.92 O HETATM 3563 O HOH A 823 3.836 18.988 81.795 1.00 26.74 O HETATM 3564 O HOH A 824 1.418 41.630 103.141 1.00 28.82 O HETATM 3565 O HOH A 825 50.912 33.649 119.497 1.00 29.81 O HETATM 3566 O HOH A 826 -4.792 41.880 96.946 1.00 37.74 O HETATM 3567 O HOH A 827 30.977 40.896 96.552 1.00 29.96 O HETATM 3568 O HOH A 828 0.219 26.299 81.711 1.00 27.88 O HETATM 3569 O HOH A 829 -0.892 15.366 84.366 1.00 36.47 O HETATM 3570 O HOH A 830 17.220 23.778 80.285 1.00 23.11 O HETATM 3571 O HOH A 831 -1.379 9.892 121.158 1.00 24.17 O HETATM 3572 O HOH A 832 0.826 45.514 96.300 1.00 34.78 O HETATM 3573 O HOH A 833 33.499 39.784 118.069 1.00 35.80 O HETATM 3574 O HOH A 834 17.086 7.711 117.311 1.00 35.76 O HETATM 3575 O HOH A 835 15.627 9.990 81.112 1.00 24.18 O HETATM 3576 O HOH A 836 26.147 9.150 100.143 1.00 45.39 O HETATM 3577 O HOH A 837 2.661 39.551 84.475 1.00 25.21 O HETATM 3578 O HOH A 838 30.699 35.332 131.574 1.00 18.09 O HETATM 3579 O HOH A 839 -5.927 31.793 93.507 1.00 50.75 O HETATM 3580 O HOH A 840 14.168 43.256 106.247 1.00 24.25 O HETATM 3581 O HOH A 841 3.413 11.282 81.583 1.00 35.31 O HETATM 3582 O HOH A 842 26.249 39.912 125.401 1.00 33.52 O HETATM 3583 O HOH A 843 -6.476 27.777 93.091 1.00 32.20 O HETATM 3584 O HOH A 844 35.368 46.782 136.432 1.00 37.46 O HETATM 3585 O HOH A 845 36.357 34.615 128.041 1.00 37.83 O HETATM 3586 O HOH A 846 -1.611 10.381 112.240 1.00 15.46 O HETATM 3587 O HOH A 847 2.851 21.288 79.181 1.00 27.96 O HETATM 3588 O HOH A 848 7.889 15.754 76.268 1.00 38.36 O HETATM 3589 O HOH A 849 7.009 43.782 102.512 1.00 26.85 O HETATM 3590 O HOH A 850 4.498 1.801 112.532 1.00 28.48 O HETATM 3591 O HOH A 851 15.086 34.929 84.748 1.00 39.17 O HETATM 3592 O HOH A 852 16.885 10.421 117.301 1.00 23.76 O HETATM 3593 O HOH A 853 37.601 43.558 99.919 1.00 30.85 O HETATM 3594 O HOH A 854 -3.491 21.092 117.990 1.00 28.25 O HETATM 3595 O HOH A 855 11.729 45.731 98.663 1.00 24.63 O HETATM 3596 O HOH A 856 21.663 40.052 88.652 1.00 27.06 O HETATM 3597 O HOH A 857 53.733 30.262 119.106 1.00 48.52 O HETATM 3598 O HOH A 858 -4.655 9.699 117.674 1.00 36.84 O HETATM 3599 O HOH A 859 22.716 4.377 89.492 1.00 40.18 O HETATM 3600 O HOH A 860 30.694 45.116 100.124 1.00 43.01 O HETATM 3601 O HOH A 861 -1.533 33.431 105.425 1.00 17.39 O HETATM 3602 O HOH A 862 -6.442 11.794 115.428 1.00 28.40 O HETATM 3603 O HOH A 863 31.889 45.515 112.712 1.00 43.08 O HETATM 3604 O HOH A 864 13.066 42.091 84.775 1.00 34.03 O HETATM 3605 O HOH A 865 5.078 42.185 105.821 1.00 30.10 O HETATM 3606 O HOH A 866 12.828 10.653 81.092 1.00 25.37 O HETATM 3607 O HOH A 867 34.976 42.769 133.064 1.00 27.20 O HETATM 3608 O HOH A 868 -3.380 20.699 80.989 1.00 32.43 O HETATM 3609 O HOH A 869 4.458 5.535 84.764 1.00 42.35 O HETATM 3610 O HOH A 870 27.260 37.076 93.774 1.00 28.44 O HETATM 3611 O HOH A 871 15.503 23.607 77.964 1.00 36.61 O HETATM 3612 O HOH A 872 22.039 34.402 116.945 1.00 41.91 O HETATM 3613 O HOH A 873 34.152 39.765 128.136 1.00 49.27 O HETATM 3614 O HOH A 874 26.650 13.807 104.181 1.00 25.13 O HETATM 3615 O HOH A 875 -5.462 18.157 115.087 1.00 37.93 O HETATM 3616 O HOH A 876 35.032 24.403 93.568 1.00 37.47 O HETATM 3617 O HOH A 877 18.882 8.153 81.988 1.00 36.43 O HETATM 3618 O HOH A 878 -8.801 19.483 91.690 1.00 23.07 O HETATM 3619 O HOH A 879 4.604 44.185 101.324 1.00 35.76 O HETATM 3620 O HOH A 880 10.904 46.042 92.520 1.00 35.70 O HETATM 3621 O HOH A 881 19.558 2.326 85.198 1.00 40.69 O HETATM 3622 O HOH A 882 35.741 41.124 115.632 1.00 36.39 O HETATM 3623 O HOH A 883 25.646 39.477 90.978 1.00 29.38 O HETATM 3624 O HOH A 884 19.513 -4.336 103.448 1.00 15.95 O HETATM 3625 O HOH A 885 3.364 18.523 126.468 1.00 21.64 O HETATM 3626 O HOH A 886 -5.052 40.086 106.888 1.00 37.69 O HETATM 3627 O HOH A 887 26.739 16.760 90.996 1.00 31.09 O HETATM 3628 O HOH A 888 25.260 3.106 104.283 1.00 40.17 O HETATM 3629 O HOH A 889 -7.517 7.307 87.521 1.00 29.54 O HETATM 3630 O HOH A 890 14.285 13.607 78.269 1.00 26.98 O HETATM 3631 O HOH A 891 -5.160 31.572 90.333 1.00 36.56 O HETATM 3632 O HOH A 892 31.670 20.763 100.817 1.00 25.88 O HETATM 3633 O HOH A 893 8.055 8.667 82.489 1.00 30.17 O HETATM 3634 O HOH A 894 25.312 15.795 88.925 1.00 31.38 O HETATM 3635 O HOH A 895 11.471 4.525 85.122 1.00 43.15 O HETATM 3636 O HOH A 896 -6.151 18.861 84.654 1.00 32.57 O HETATM 3637 O HOH A 897 -2.110 32.398 108.003 1.00 19.32 O HETATM 3638 O HOH A 898 49.351 26.575 101.139 1.00 37.93 O HETATM 3639 O HOH A 899 29.177 40.955 126.579 1.00 34.21 O HETATM 3640 O HOH A 900 22.860 17.379 84.780 1.00 31.60 O HETATM 3641 O HOH A 901 24.306 9.508 85.269 1.00 38.83 O HETATM 3642 O HOH A 902 42.591 30.759 92.930 1.00 27.65 O HETATM 3643 O HOH A 903 29.173 12.693 120.406 1.00 12.93 O HETATM 3644 O HOH A 904 -1.296 44.008 105.840 1.00 40.70 O HETATM 3645 O HOH A 905 6.109 10.182 83.366 1.00 20.09 O HETATM 3646 O HOH A 906 14.640 45.860 98.631 1.00 38.92 O HETATM 3647 O HOH A 907 7.644 11.818 79.437 1.00 25.85 O HETATM 3648 O HOH A 908 1.673 18.416 80.030 1.00 42.51 O HETATM 3649 O HOH A 909 13.091 45.224 103.211 1.00 32.17 O HETATM 3650 O HOH A 910 1.030 5.732 112.600 1.00 29.90 O HETATM 3651 O HOH A 911 33.684 23.975 107.392 1.00 10.90 O HETATM 3652 O HOH A 912 46.920 41.302 104.375 1.00 35.77 O HETATM 3653 O HOH A 913 36.179 21.755 115.897 1.00 15.16 O HETATM 3654 O HOH A 914 31.361 18.009 105.928 1.00 37.38 O HETATM 3655 O HOH A 915 37.463 24.429 106.198 1.00 14.05 O HETATM 3656 O HOH A 916 -4.895 6.434 88.964 1.00 11.79 O HETATM 3657 O HOH A 917 16.551 28.665 120.337 1.00 19.86 O HETATM 3658 O HOH A 918 -10.062 14.909 89.445 1.00 12.89 O HETATM 3659 O HOH A 919 -3.823 33.244 84.064 1.00 32.11 O HETATM 3660 O HOH A 920 8.924 45.529 90.633 1.00 34.16 O HETATM 3661 O HOH A 921 20.981 21.933 87.513 1.00 12.98 O HETATM 3662 O HOH A 922 0.008 0.003 109.105 0.50 15.06 O HETATM 3663 O HOH A 923 8.261 15.652 80.629 1.00 14.91 O HETATM 3664 O HOH A 924 5.954 12.285 81.666 1.00 16.67 O HETATM 3665 O HOH A 925 14.452 12.074 118.285 1.00 42.52 O HETATM 3666 O HOH A 926 23.869 13.537 88.818 1.00 16.24 O HETATM 3667 O HOH A 927 0.738 31.695 80.238 1.00 22.51 O HETATM 3668 O HOH A 928 -1.360 8.603 100.063 1.00 20.80 O HETATM 3669 O HOH A 929 21.806 34.137 90.966 1.00 21.78 O HETATM 3670 O HOH A 930 10.810 44.721 96.370 1.00 20.67 O HETATM 3671 O HOH A 931 26.953 13.452 114.288 1.00 22.62 O HETATM 3672 O HOH A 932 -0.661 27.906 113.859 1.00 22.04 O HETATM 3673 O HOH A 933 1.303 2.565 92.003 1.00 24.99 O HETATM 3674 O HOH A 934 17.774 35.805 117.514 1.00 23.98 O HETATM 3675 O HOH A 935 26.907 46.592 120.352 1.00 39.71 O HETATM 3676 O HOH A 936 9.495 13.835 78.980 1.00 20.81 O HETATM 3677 O HOH A 937 -0.727 6.629 114.370 1.00 29.29 O HETATM 3678 O HOH A 938 4.048 2.946 88.533 1.00 23.54 O HETATM 3679 O HOH A 939 11.990 38.184 85.110 1.00 24.36 O HETATM 3680 O HOH A 940 28.986 17.169 102.707 1.00 30.44 O HETATM 3681 O HOH A 941 18.961 43.395 89.131 1.00 41.67 O HETATM 3682 O HOH A 942 36.380 19.134 119.278 1.00 41.02 O HETATM 3683 O HOH A 943 14.868 46.493 95.172 1.00 35.59 O HETATM 3684 O HOH A 944 30.301 12.123 117.609 1.00 29.18 O HETATM 3685 O HOH A 945 34.912 21.572 107.474 1.00 20.41 O HETATM 3686 O HOH A 946 33.285 25.455 125.009 1.00 26.51 O HETATM 3687 O HOH A 947 20.412 25.045 90.371 1.00 18.43 O HETATM 3688 O HOH A 948 1.548 39.789 88.271 1.00 20.35 O HETATM 3689 O HOH A 949 28.249 15.454 110.498 1.00 19.92 O HETATM 3690 O HOH A 950 23.166 35.059 125.361 1.00 36.95 O HETATM 3691 O HOH A 951 4.387 31.697 80.232 1.00 19.32 O HETATM 3692 O HOH A 952 13.894 31.689 80.234 1.00 51.19 O HETATM 3693 O HOH A 953 22.420 22.818 85.454 1.00 36.23 O HETATM 3694 O HOH A 954 34.138 35.781 121.077 1.00 54.83 O HETATM 3695 O HOH A 955 17.955 2.153 109.782 1.00 32.65 O HETATM 3696 O HOH A 956 9.517 6.941 84.686 1.00 22.61 O HETATM 3697 O HOH A 957 18.517 34.983 86.987 1.00 28.04 O HETATM 3698 O HOH A 958 20.568 35.563 88.672 1.00 28.09 O HETATM 3699 O HOH A 959 35.980 22.217 102.220 1.00 32.07 O HETATM 3700 O HOH A 960 17.768 45.719 94.028 1.00 37.15 O HETATM 3701 O HOH A 961 42.044 23.252 105.544 1.00 32.68 O HETATM 3702 O HOH A 962 23.219 39.057 118.817 1.00 35.10 O HETATM 3703 O HOH A 963 21.941 39.836 116.401 1.00 39.26 O HETATM 3704 O HOH A 964 36.809 32.796 119.722 1.00 37.10 O HETATM 3705 O HOH A 965 36.203 35.311 118.784 1.00 34.69 O HETATM 3706 O HOH A 966 33.253 29.682 125.008 1.00 43.54 O HETATM 3707 O HOH A 967 34.709 31.005 123.360 1.00 40.23 O HETATM 3708 O HOH A 968 -2.338 6.968 88.495 1.00 17.89 O HETATM 3709 O HOH A 969 -1.167 4.689 87.800 1.00 34.20 O HETATM 3710 O HOH A 970 -3.792 9.211 85.921 1.00 31.60 O HETATM 3711 O HOH A 971 34.992 20.045 105.019 1.00 40.99 O HETATM 3712 O HOH A 972 -5.642 21.630 102.739 1.00 19.80 O HETATM 3713 O HOH A 973 23.762 14.890 84.441 1.00 30.62 O HETATM 3714 O HOH A 974 25.050 11.815 95.829 1.00 20.74 O HETATM 3715 O HOH A 975 -2.864 23.741 79.867 1.00 34.34 O HETATM 3716 O HOH A 976 0.784 25.696 79.350 1.00 24.02 O HETATM 3717 O HOH A 977 -1.201 4.426 100.628 1.00 26.93 O HETATM 3718 O HOH A 978 -7.890 22.963 94.569 1.00 40.90 O HETATM 3719 O HOH A 979 24.516 25.964 91.634 1.00 29.47 O HETATM 3720 O HOH A 980 -1.738 30.480 80.656 1.00 25.92 O HETATM 3721 O HOH A 981 16.995 27.462 85.031 1.00 34.45 O HETATM 3722 O HOH A 982 23.636 10.732 120.928 1.00 37.26 O HETATM 3723 O HOH A 983 23.984 8.678 119.053 1.00 35.53 O HETATM 3724 O HOH A 984 27.739 10.373 116.132 1.00 36.97 O HETATM 3725 O HOH A 985 24.411 9.934 114.480 1.00 28.61 O HETATM 3726 O HOH A 986 54.904 31.713 116.175 1.00 41.97 O HETATM 3727 O HOH A 987 2.895 8.875 119.495 1.00 34.21 O HETATM 3728 O HOH A 988 5.269 9.143 120.350 1.00 29.92 O HETATM 3729 O HOH A 989 2.809 6.486 119.930 1.00 40.49 O HETATM 3730 O HOH A 990 4.963 19.004 77.037 1.00 35.06 O HETATM 3731 O HOH A 991 9.985 1.877 114.539 1.00 20.01 O HETATM 3732 O HOH A 992 37.546 42.894 113.379 1.00 40.29 O HETATM 3733 O HOH A 993 47.827 42.761 116.093 1.00 34.80 O HETATM 3734 O HOH A 994 49.047 38.693 106.943 1.00 38.65 O HETATM 3735 O HOH A 995 50.059 25.088 105.985 1.00 39.62 O HETATM 3736 O HOH A 996 17.733 20.254 78.413 1.00 39.47 O HETATM 3737 O HOH A 997 18.388 17.747 78.829 1.00 41.04 O HETATM 3738 O HOH A 998 25.553 22.712 88.062 1.00 36.08 O HETATM 3739 O HOH A 999 10.733 45.247 87.493 1.00 38.57 O HETATM 3740 O HOH A1000 -5.322 40.101 109.763 1.00 38.64 O HETATM 3741 O HOH A1001 -8.991 36.147 110.831 1.00 37.41 O HETATM 3742 O HOH A1002 -8.024 33.679 112.138 1.00 28.18 O HETATM 3743 O HOH A1003 29.074 39.909 95.121 1.00 28.95 O HETATM 3744 O HOH A1004 30.825 37.897 94.425 1.00 35.15 O HETATM 3745 O HOH A1005 34.234 17.157 119.099 1.00 35.66 O HETATM 3746 O HOH A1006 20.110 14.146 81.715 1.00 44.83 O HETATM 3747 O HOH A1007 3.353 43.164 103.911 1.00 35.68 O HETATM 3748 O HOH A1008 -4.309 17.674 86.604 1.00 30.17 O HETATM 3749 O HOH A1009 8.457 45.805 95.558 1.00 38.01 O HETATM 3750 O HOH A1010 24.057 40.939 89.447 1.00 35.22 O HETATM 3751 O HOH A1011 24.340 1.124 92.877 1.00 25.46 O HETATM 3752 O HOH A1012 12.767 44.143 86.318 1.00 38.36 O HETATM 3753 O HOH A1013 30.635 44.157 128.037 1.00 36.33 O HETATM 3754 O HOH A1014 1.516 8.920 83.143 1.00 38.66 O HETATM 3755 O HOH A1015 19.601 34.421 118.957 1.00 32.95 O HETATM 3756 O HOH A1016 -4.669 20.505 115.913 1.00 33.89 O HETATM 3757 O HOH A1017 -8.214 18.618 88.452 1.00 34.34 O HETATM 3758 O HOH A1018 24.831 18.194 88.130 1.00 37.93 O HETATM 3759 O HOH A1019 31.497 21.915 98.140 1.00 38.49 O HETATM 3760 O HOH A1020 22.225 36.814 115.973 1.00 37.83 O HETATM 3761 O HOH A1021 23.920 20.126 83.932 1.00 39.76 O HETATM 3762 O HOH A1022 21.711 21.386 80.061 1.00 38.71 O HETATM 3763 O HOH A1023 16.979 46.908 98.812 1.00 42.60 O HETATM 3764 O HOH A1024 30.893 41.281 143.713 1.00 29.63 O HETATM 3765 O HOH A1025 -0.752 18.272 80.749 1.00 38.88 O HETATM 3766 O HOH A1026 5.514 2.951 85.741 1.00 38.32 O HETATM 3767 O HOH A1027 12.796 35.889 84.093 1.00 30.77 O HETATM 3768 O HOH A1028 18.938 45.278 90.993 1.00 43.15 O HETATM 3769 O HOH A1029 20.013 0.462 108.784 1.00 39.77 O HETATM 3770 O HOH A1030 -10.417 21.410 91.659 1.00 29.86 O HETATM 3771 O HOH A1031 5.419 21.236 75.212 1.00 44.02 O HETATM 3772 O HOH A1032 33.624 46.627 100.250 1.00 41.12 O HETATM 3773 O HOH A1033 36.447 45.761 104.747 1.00 36.45 O HETATM 3774 O HOH A1034 32.887 46.987 106.108 1.00 36.85 O HETATM 3775 O HOH A1035 -0.850 38.870 111.435 1.00 23.26 O HETATM 3776 O HOH A1036 -2.286 40.710 110.894 1.00 25.27 O HETATM 3777 O HOH A1037 -2.526 42.166 100.371 1.00 27.63 O HETATM 3778 O HOH A1038 -2.213 25.467 82.181 1.00 26.79 O HETATM 3779 O HOH A1039 -3.093 27.864 82.588 1.00 25.47 O HETATM 3780 O HOH A1040 -6.843 28.577 83.809 1.00 26.31 O CONECT 440 3325 CONECT 458 3325 CONECT 1667 3325 CONECT 2444 3325 CONECT 3325 440 458 1667 2444 CONECT 3325 3331 CONECT 3326 3327 3334 CONECT 3327 3326 3328 3329 CONECT 3328 3327 CONECT 3329 3327 3330 CONECT 3330 3329 3331 3332 CONECT 3331 3325 3330 CONECT 3332 3330 3333 3334 CONECT 3333 3332 CONECT 3334 3326 3332 CONECT 3335 3336 3337 CONECT 3336 3335 CONECT 3337 3335 3338 3339 CONECT 3338 3337 CONECT 3339 3337 3340 CONECT 3340 3339 END