USER MOD reduce.3.24.130724 H: found=0, std=0, add=3293, rem=0, adj=96 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE 31-OCT-03 1RA5 TITLE BACTERIAL CYTOSINE DEAMINASE D314A 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, D314A MUTANT, HYDROLASE EXPDTA X-RAY DIFFRACTION AUTHOR S.D.MAHAN,G.C.IRETON,B.L.STODDARD,M.E.BLACK REVDAT 4 13-JUL-11 1RA5 1 VERSN REVDAT 3 24-FEB-09 1RA5 1 VERSN REVDAT 2 04-JAN-05 1RA5 1 JRNL REVDAT 1 05-OCT-04 1RA5 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. 1.40 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) : 1.40 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 19.97 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 338051.240 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 99.1 REMARK 3 NUMBER OF REFLECTIONS : 107622 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) : 0.183 REMARK 3 FREE R VALUE : 0.193 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 5367 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.003 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) : 1.40 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.49 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 98.10 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 16739 REMARK 3 BIN R VALUE (WORKING SET) : 0.2170 REMARK 3 BIN FREE R VALUE : 0.2260 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 4.80 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 840 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.008 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3322 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 16 REMARK 3 SOLVENT ATOMS : 433 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 14.40 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 16.10 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.55000 REMARK 3 B22 (A**2) : 0.43000 REMARK 3 B33 (A**2) : -0.98000 REMARK 3 B12 (A**2) : -0.41000 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) : 0.14 REMARK 3 ESD FROM SIGMAA (A) : 0.07 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) : 0.16 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.09 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) : 23.10 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) : 0.940 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 1.370 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 1.820 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 2.420 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.39 REMARK 3 BSOL : 58.12 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 1RA5 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 07-NOV-03. REMARK 100 THE RCSB ID CODE IS RCSB020624. 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 : 117634 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.350 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 (%) : 100.0 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.35 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.40 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: FOURIER SYNTHESIS REMARK 200 SOFTWARE USED: CNS REMARK 200 STARTING MODEL: 1K7O REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 57.51 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.89 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 54.66800 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 31.56258 REMARK 290 SMTRY3 7 0.000000 0.000000 1.000000 80.21300 REMARK 290 SMTRY1 8 -0.500000 -0.866025 0.000000 54.66800 REMARK 290 SMTRY2 8 0.866025 -0.500000 0.000000 31.56258 REMARK 290 SMTRY3 8 0.000000 0.000000 1.000000 80.21300 REMARK 290 SMTRY1 9 -0.500000 0.866025 0.000000 54.66800 REMARK 290 SMTRY2 9 -0.866025 -0.500000 0.000000 31.56258 REMARK 290 SMTRY3 9 0.000000 0.000000 1.000000 80.21300 REMARK 290 SMTRY1 10 -0.500000 0.866025 0.000000 54.66800 REMARK 290 SMTRY2 10 0.866025 0.500000 0.000000 31.56258 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 80.21300 REMARK 290 SMTRY1 11 1.000000 0.000000 0.000000 54.66800 REMARK 290 SMTRY2 11 0.000000 -1.000000 0.000000 31.56258 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 80.21300 REMARK 290 SMTRY1 12 -0.500000 -0.866025 0.000000 54.66800 REMARK 290 SMTRY2 12 -0.866025 0.500000 0.000000 31.56258 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 80.21300 REMARK 290 SMTRY1 13 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 13 0.000000 1.000000 0.000000 63.12517 REMARK 290 SMTRY3 13 0.000000 0.000000 1.000000 160.42600 REMARK 290 SMTRY1 14 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 14 0.866025 -0.500000 0.000000 63.12517 REMARK 290 SMTRY3 14 0.000000 0.000000 1.000000 160.42600 REMARK 290 SMTRY1 15 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 15 -0.866025 -0.500000 0.000000 63.12517 REMARK 290 SMTRY3 15 0.000000 0.000000 1.000000 160.42600 REMARK 290 SMTRY1 16 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 16 0.866025 0.500000 0.000000 63.12517 REMARK 290 SMTRY3 16 0.000000 0.000000 -1.000000 160.42600 REMARK 290 SMTRY1 17 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 17 0.000000 -1.000000 0.000000 63.12517 REMARK 290 SMTRY3 17 0.000000 0.000000 -1.000000 160.42600 REMARK 290 SMTRY1 18 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 18 -0.866025 0.500000 0.000000 63.12517 REMARK 290 SMTRY3 18 0.000000 0.000000 -1.000000 160.42600 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: 31910 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 77240 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -191.0 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 240.63900 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 240.63900 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 240.63900 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 986 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 927 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 935 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 952 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 917 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 857 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 951 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 922 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 674 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 988 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: 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 3.62 80.77 REMARK 500 ASP A 127 112.30 -165.51 REMARK 500 ILE A 183 67.73 -154.04 REMARK 500 HIS A 246 -72.81 74.75 REMARK 500 THR A 288 -94.05 -100.76 REMARK 500 ASP A 313 -63.28 70.58 REMARK 500 TYR A 320 111.48 -166.04 REMARK 500 LEU A 322 -161.84 -126.98 REMARK 500 THR A 354 -96.42 -132.20 REMARK 500 LEU A 416 -140.13 -95.89 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 = 5.79 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 106.9 REMARK 620 3 HIS A 214 NE2 101.0 96.4 REMARK 620 4 ASP A 313 OD2 86.5 80.7 172.5 REMARK 620 5 FPY A 501 O4 115.9 130.7 98.3 78.7 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: 1RAK RELATED DB: PDB REMARK 900 RELATED ID: 1RB7 RELATED DB: PDB DBREF 1RA5 A -1 426 UNP P25524 CODA_ECOLI 1 426 SEQADV 1RA5 GLY A -3 UNP P25524 CLONING ARTIFACT SEQADV 1RA5 SER A -2 UNP P25524 CLONING ARTIFACT SEQADV 1RA5 SER A -1 UNP P25524 CLONING ARTIFACT SEQADV 1RA5 MET A 0 UNP P25524 CLONING ARTIFACT SEQADV 1RA5 ALA A 1 UNP P25524 SER 1 ENGINEERED SEQADV 1RA5 ALA 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 ALA 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 *433(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 GLU A 420 N VAL A 414 LINK NE2 HIS A 63 FE FE A 500 1555 1555 2.06 LINK NE2 HIS A 61 FE FE A 500 1555 1555 2.04 LINK FE FE A 500 NE2 HIS A 214 1555 1555 2.29 LINK FE FE A 500 OD2 ASP A 313 1555 1555 2.52 LINK FE FE A 500 O4 FPY A 501 1555 1555 1.98 CISPEP 1 GLN A 72 PRO A 73 0 -0.24 CISPEP 2 TYR A 289 PRO A 290 0 -0.21 SITE *** AC1 6 HIS A 61 HIS A 63 HIS A 214 HIS A 246 SITE *** AC1 6 ASP A 313 FPY A 501 SITE *** AC2 12 HIS A 61 HIS A 63 LEU A 81 PHE A 154 SITE *** AC2 12 GLN A 156 HIS A 214 GLU A 217 HIS A 246 SITE *** AC2 12 ASP A 313 TRP A 319 FE A 500 HOH A 665 SITE *** AC3 8 ALA A 128 LYS A 134 GLU A 171 ARG A 174 SITE *** AC3 8 LEU A 175 HOH A 951 HOH A 976 HOH A 980 CRYST1 109.336 109.336 240.639 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 0.009146 0.005281 0.000000 0.00000 SCALE2 0.000000 0.010561 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004156 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 O2 :(H bumps) USER MOD Set 1.1: A 271 ASN : amide:sc= 0.933 K(o=4.8,f=0.98) USER MOD Set 1.2: A 307 ASN : amide:sc= 1.74 K(o=4.8,f=1.7) USER MOD Set 1.3: A 309 CYS SG : rot 60:sc= 0.0225 USER MOD Set 1.4: A 356 HIS : +bothHN:sc= 1.52 K(o=4.8,f=-2.2!) USER MOD Set 1.5: A 360 THR OG1 : rot 162:sc= 0.58 USER MOD Set 2.1: A 248 THR OG1 : rot 180:sc= -0.281 USER MOD Set 2.2: A 283 GLN : amide:sc= 2.57 K(o=2.3,f=1.3) USER MOD Set 3.1: A 247 THR OG1 : rot -2:sc= 1.97 USER MOD Set 3.2: A 250 MET CE :methyl -164:sc= -0.0321 (180deg=-0.314) USER MOD Set 3.3: A 296 THR OG1 : rot 152:sc= 0.942 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= 1.06 K(o=1.3,f=-4.6!) USER MOD Set 4.2: A 275 ASN : amide:sc= -1.59 K(o=1.3,f=0.74) USER MOD Set 4.3: A 279 ASN : amide:sc= 1.86 K(o=1.3,f=-2.2) USER MOD Set 5.1: A 129 THR OG1 : rot -63:sc= 1.82 USER MOD Set 5.2: A 131 THR OG1 : rot 72:sc= 2.09 USER MOD Set 6.1: A 117 GLN : amide:sc= 0.644 K(o=-0.56,f=-4.7!) USER MOD Set 6.2: A 397 SER OG : rot 164:sc= -1.2! USER MOD Set 7.1: A 78 SER OG : rot -79:sc= 1.73 USER MOD Set 7.2: A 80 THR OG1 : rot -85:sc= 1.04 USER MOD Set 8.1: A 67 THR OG1 : rot 31:sc= 1.38 USER MOD Set 8.2: A 68 GLN :FLIP amide:sc= 0.259 F(o=0.53,f=2.6) USER MOD Set 8.3: A 107 THR OG1 : rot 179:sc= 0.961 USER MOD Set 9.1: A 10 ASN : amide:sc= 1.89 K(o=2.3,f=-10!) USER MOD Set 9.2: A 35 GLN : amide:sc= 0.446! C(o=2.3!,f=-3.2!) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 7 THR OG1 : rot -81:sc= 0.845 USER MOD Single : A 21 GLN : amide:sc= -1.94! C(o=-1.9!,f=-3.7!) USER MOD Single : A 23 HIS : +bothHN:sc= 0.609 K(o=0.61,f=-5.4!) USER MOD Single : A 25 GLN : amide:sc= -0.547 K(o=-0.55,f=-3.6) USER MOD Single : A 28 LYS NZ :NH3+ -166:sc= 0.361 (180deg=0.152) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -122:sc= 0.876 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc=-0.00782 USER MOD Single : A 44 ASN : amide:sc= -0.0147 X(o=-0.015,f=-0.11) USER MOD Single : A 45 SER OG : rot -173:sc= 0.218 USER MOD Single : A 50 GLN : amide:sc= 0.404 X(o=0.4,f=0.16) USER MOD Single : A 66 THR OG1 : rot 113:sc= 1.33 USER MOD Single : A 69 THR OG1 : rot -80:sc= 1.17 USER MOD Single : A 72 GLN : amide:sc= 0.534 K(o=0.53,f=-5.3!) USER MOD Single : A 74 ASN : amide:sc= 1.07 X(o=1.1,f=0.78) USER MOD Single : A 76 ASN : amide:sc= 0.0948 K(o=0.095,f=-5.2!) USER MOD Single : A 77 GLN :FLIP amide:sc= -2.15! C(o=-3.2!,f=-2.1!) USER MOD Single : A 92 LYS NZ :NH3+ -177:sc= 2.98 (180deg=2.97) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0408 USER MOD Single : A 97 HIS : no HD1:sc= 1.09 K(o=1.1,f=-5.3!) USER MOD Single : A 101 LYS NZ :NH3+ 177:sc= 2.29 (180deg=2.21) USER MOD Single : A 102 GLN :FLIP amide:sc= -0.405 F(o=-2.5!,f=-0.4) USER MOD Single : A 106 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 109 LYS NZ :NH3+ 176:sc= 0.00487 (180deg=0.00444) USER MOD Single : A 111 GLN : amide:sc= 0.0591 K(o=0.059,f=-2.2!) USER MOD Single : A 114 ASN : amide:sc= 0.848 K(o=0.85,f=-0.88) USER MOD Single : A 118 HIS : no HE2:sc= 1.65 K(o=1.7,f=-2.8!) USER MOD Single : A 121 THR OG1 : rot -140:sc= 0.547 USER MOD Single : A 122 HIS : no HD1:sc= 1.76 K(o=1.8,f=-3.3!) USER MOD Single : A 126 SER OG : rot -53:sc= 1.83 USER MOD Single : A 134 LYS NZ :NH3+ -175:sc= 2.53 (180deg=2.29) USER MOD Single : A 136 MET CE :methyl 167:sc= -0.0489 (180deg=-0.299) USER MOD Single : A 140 LYS NZ :NH3+ 175:sc= 2.16 (180deg=2.12) USER MOD Single : A 141 GLN :FLIP amide:sc= -0.0346 F(o=-1.8!,f=-0.035) USER MOD Single : A 150 GLN :FLIP amide:sc= 1.25 F(o=-6!,f=1.2) USER MOD Single : A 156 GLN : amide:sc= 1.59 K(o=1.6,f=-4.6!) USER MOD Single : A 161 SER OG : rot 79:sc= 1.68 USER MOD Single : A 162 TYR OH : rot -82:sc= 2.28 USER MOD Single : A 164 ASN : amide:sc= 1.74 K(o=1.7,f=0.8) USER MOD Single : A 185 HIS : no HE2:sc= 0.453 K(o=0.45,f=-3.2!) USER MOD Single : A 189 THR OG1 : rot -164:sc= 1.46 USER MOD Single : A 192 TYR OH : rot 177:sc= 2.21 USER MOD Single : A 196 SER OG : rot -54:sc= 2.15 USER MOD Single : A 198 HIS : no HE2:sc= 2.32 K(o=2.3,f=-6.4!) USER MOD Single : A 199 LYS NZ :NH3+ -167:sc= 1.37 (180deg=1.11) USER MOD Single : A 200 THR OG1 : rot 76:sc= 0.698 USER MOD Single : A 205 GLN : amide:sc= 0.332 K(o=0.33,f=-7.1!) USER MOD Single : A 206 LYS NZ :NH3+ -172:sc= 1.35 (180deg=1.29) USER MOD Single : A 207 TYR OH : rot -5:sc= 1.39 USER MOD Single : A 215 CYS SG : rot -58:sc= 0.0923 USER MOD Single : A 222 GLN : amide:sc= 1.33 X(o=1.3,f=1.2) USER MOD Single : A 223 SER OG : rot -63:sc= 1.5 USER MOD Single : A 228 THR OG1 : rot 92:sc= 1.27 USER MOD Single : A 234 HIS : no HE2:sc= 2.26 K(o=2.3,f=-5.7!) USER MOD Single : A 235 HIS : no HD1:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 238 MET CE :methyl -121:sc= 0 (180deg=-0.0483) USER MOD Single : A 243 THR OG1 : rot 1:sc= 0.81 USER MOD Single : A 245 SER OG : rot 100:sc= 1.84 USER MOD Single : A 251 HIS :FLIP no HE2:sc= -0.0153 F(o=-0.74,f=-0.015) USER MOD Single : A 252 SER OG : rot 93:sc= 1.9 USER MOD Single : A 253 TYR OH : rot 10:sc= 2.33 USER MOD Single : A 254 ASN : amide:sc= 0.752 K(o=0.75,f=-4!) USER MOD Single : A 257 TYR OH : rot 5:sc= 1.2 USER MOD Single : A 258 THR OG1 : rot 78:sc= 0.584 USER MOD Single : A 259 SER OG : rot 180:sc= 0 USER MOD Single : A 266 LYS NZ :NH3+ 159:sc= 0.79 (180deg=0.584) USER MOD Single : A 267 MET CE :methyl 171:sc= 0 (180deg=-0.0876) USER MOD Single : A 268 SER OG : rot -47:sc= 0.587 USER MOD Single : A 281 HIS : no HD1:sc= 0.956 K(o=0.96,f=-4.3!) USER MOD Single : A 288 THR OG1 : rot 180:sc= 0.438 USER MOD Single : A 289 TYR OH : rot 180:sc= 1 USER MOD Single : A 291 LYS NZ :NH3+ -148:sc= 1.73 (180deg=0.727) USER MOD Single : A 299 LYS NZ :NH3+ 175:sc= 1.67 (180deg=1.63) USER MOD Single : A 304 SER OG : rot 147:sc= 1.04 USER MOD Single : A 312 HIS :FLIP no HE2:sc= 0.842 F(o=-4.4!,f=0.84) USER MOD Single : A 320 TYR OH : rot 180:sc= 1.05 USER MOD Single : A 324 THR OG1 : rot 110:sc= 2.31 USER MOD Single : A 326 ASN : amide:sc= 1.37 K(o=1.4,f=-4.5!) USER MOD Single : A 327 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 329 GLN : amide:sc= 2.76 K(o=2.8,f=0.28) USER MOD Single : A 332 HIS : no HD1:sc= 1.03 K(o=1,f=-1.5) USER MOD Single : A 333 MET CE :methyl 167:sc= -0.0204 (180deg=-0.173) USER MOD Single : A 336 HIS : no HE2:sc= 0.873 K(o=0.87,f=-2.8!) USER MOD Single : A 338 CYS SG : rot 180:sc= -0.0775 USER MOD Single : A 339 GLN : amide:sc= 1.02 K(o=1,f=0.095) USER MOD Single : A 341 MET CE :methyl -119:sc=-0.00437 (180deg=-0.133) USER MOD Single : A 343 TYR OH : rot 13:sc= 1.25 USER MOD Single : A 345 GLN : amide:sc= 1.88 K(o=1.9,f=-1.9!) USER MOD Single : A 347 ASN : amide:sc= 0.893 K(o=0.89,f=-5!) USER MOD Single : A 351 ASN : amide:sc= 0.586 K(o=0.59,f=-0.64) USER MOD Single : A 354 THR OG1 : rot -68:sc= 2.34 USER MOD Single : A 355 HIS : no HE2:sc= 2.22 K(o=2.2,f=-4.2!) USER MOD Single : A 357 SER OG : rot 163:sc= 0.556 USER MOD Single : A 362 ASN : amide:sc= 1.45 K(o=1.4,f=0.83) USER MOD Single : A 364 GLN : amide:sc= 0.66 K(o=0.66,f=-0.006) USER MOD Single : A 366 TYR OH : rot 154:sc= 1.16 USER MOD Single : A 372 ASN : amide:sc= 2.04 K(o=2,f=-1.1) USER MOD Single : A 373 SER OG : rot 70:sc= 1.21 USER MOD Single : A 375 ASN : amide:sc= 1.78 K(o=1.8,f=-1.2!) USER MOD Single : A 383 ASN : amide:sc= 0.533 K(o=0.53,f=-4.9!) USER MOD Single : A 391 GLN : amide:sc= 1.62 K(o=1.6,f=0.028) USER MOD Single : A 396 TYR OH : rot 180:sc= 0 USER MOD Single : A 402 LYS NZ :NH3+ 164:sc= -0.0723 (180deg=-0.32) 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=-0.00291 X(o=-0.0029,f=0) USER MOD Single : A 411 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 412 THR OG1 : rot 96:sc= 1.57 USER MOD Single : A 413 THR OG1 : rot -92:sc= 2.38 USER MOD Single : A 415 TYR OH : rot 180:sc= 0 USER MOD Single : A 418 GLN :FLIP amide:sc= -2.16! C(o=-6.5!,f=-2.2!) USER MOD Single : A 424 TYR OH : rot 30:sc= 1.23 USER MOD Single : A 425 LYS NZ :NH3+ -135:sc= 0.554 (180deg=-0.047) USER MOD Single : A 502 GOL O1 : rot -0:sc= 0.829 USER MOD Single : A 502 GOL O3 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 4 39.564 46.186 99.734 1.00 33.17 N ATOM 2 CA ALA A 4 40.364 45.249 98.893 1.00 32.39 C ATOM 3 C ALA A 4 41.085 44.233 99.774 1.00 31.48 C ATOM 4 O ALA A 4 42.317 44.194 99.822 1.00 31.33 O ATOM 5 CB ALA A 4 41.374 46.036 98.058 1.00 32.39 C ATOM 0 HA ALA A 4 39.766 44.771 98.297 1.00 32.39 H new ATOM 0 HB1 ALA A 4 41.892 45.423 97.513 1.00 32.39 H new ATOM 0 HB2 ALA A 4 40.903 46.660 97.483 1.00 32.39 H new ATOM 0 HB3 ALA A 4 41.969 46.526 98.647 1.00 32.39 H new ATOM 6 N LEU A 5 40.305 43.413 100.471 1.00 30.36 N ATOM 7 CA LEU A 5 40.848 42.389 101.360 1.00 29.01 C ATOM 8 C LEU A 5 41.815 41.447 100.659 1.00 27.50 C ATOM 9 O LEU A 5 41.534 40.946 99.576 1.00 26.98 O ATOM 10 CB LEU A 5 39.715 41.563 101.974 1.00 29.59 C ATOM 11 CG LEU A 5 38.796 42.263 102.974 1.00 30.17 C ATOM 12 CD1 LEU A 5 37.768 41.265 103.486 1.00 30.50 C ATOM 13 CD2 LEU A 5 39.616 42.826 104.126 1.00 30.52 C ATOM 0 H LEU A 5 39.446 43.434 100.442 1.00 30.36 H new ATOM 0 HA LEU A 5 41.340 42.862 102.050 1.00 29.01 H new ATOM 0 HB2 LEU A 5 39.166 41.222 101.250 1.00 29.59 H new ATOM 0 HB3 LEU A 5 40.110 40.795 102.416 1.00 29.59 H new ATOM 0 HG LEU A 5 38.337 42.999 102.540 1.00 30.17 H new ATOM 0 HD11 LEU A 5 37.181 41.703 104.122 1.00 30.50 H new ATOM 0 HD12 LEU A 5 37.245 40.928 102.742 1.00 30.50 H new ATOM 0 HD13 LEU A 5 38.222 40.527 103.921 1.00 30.50 H new ATOM 0 HD21 LEU A 5 39.027 43.269 104.757 1.00 30.52 H new ATOM 0 HD22 LEU A 5 40.084 42.104 104.574 1.00 30.52 H new ATOM 0 HD23 LEU A 5 40.260 43.465 103.783 1.00 30.52 H new ATOM 14 N GLN A 6 42.948 41.191 101.300 1.00 26.34 N ATOM 15 CA GLN A 6 43.949 40.300 100.737 1.00 25.59 C ATOM 16 C GLN A 6 44.105 39.025 101.556 1.00 23.87 C ATOM 17 O GLN A 6 44.558 38.004 101.041 1.00 22.73 O ATOM 18 CB GLN A 6 45.299 41.017 100.652 1.00 28.16 C ATOM 19 CG GLN A 6 45.324 42.169 99.658 1.00 31.25 C ATOM 20 CD GLN A 6 46.661 42.877 99.627 1.00 33.78 C ATOM 21 OE1 GLN A 6 47.707 42.243 99.493 1.00 35.87 O ATOM 22 NE2 GLN A 6 46.635 44.200 99.749 1.00 34.95 N ATOM 0 H GLN A 6 43.156 41.525 102.065 1.00 26.34 H new ATOM 0 HA GLN A 6 43.647 40.051 99.850 1.00 25.59 H new ATOM 0 HB2 GLN A 6 45.532 41.355 101.531 1.00 28.16 H new ATOM 0 HB3 GLN A 6 45.982 40.374 100.405 1.00 28.16 H new ATOM 0 HG2 GLN A 6 45.119 41.832 98.772 1.00 31.25 H new ATOM 0 HG3 GLN A 6 44.629 42.806 99.888 1.00 31.25 H new ATOM 0 HE21 GLN A 6 45.884 44.609 99.841 1.00 34.95 H new ATOM 0 HE22 GLN A 6 47.369 44.648 99.736 1.00 34.95 H new ATOM 23 N THR A 7 43.712 39.077 102.824 1.00 23.31 N ATOM 24 CA THR A 7 43.862 37.911 103.681 1.00 22.65 C ATOM 25 C THR A 7 42.889 37.855 104.848 1.00 21.74 C ATOM 26 O THR A 7 42.434 38.885 105.346 1.00 21.28 O ATOM 27 CB THR A 7 45.277 37.873 104.306 1.00 23.70 C ATOM 28 OG1 THR A 7 46.244 38.306 103.344 1.00 25.82 O ATOM 29 CG2 THR A 7 45.621 36.472 104.762 1.00 24.00 C ATOM 0 H THR A 7 43.362 39.766 103.201 1.00 23.31 H new ATOM 0 HA THR A 7 43.688 37.161 103.091 1.00 22.65 H new ATOM 0 HB THR A 7 45.288 38.466 105.073 1.00 23.70 H new ATOM 0 HG1 THR A 7 46.433 37.669 102.830 1.00 25.82 H new ATOM 0 HG21 THR A 7 46.510 36.467 105.150 1.00 24.00 H new ATOM 0 HG22 THR A 7 44.977 36.180 105.426 1.00 24.00 H new ATOM 0 HG23 THR A 7 45.597 35.869 104.002 1.00 24.00 H new ATOM 30 N ILE A 8 42.558 36.635 105.262 1.00 19.87 N ATOM 31 CA ILE A 8 41.737 36.430 106.449 1.00 19.45 C ATOM 32 C ILE A 8 42.770 35.782 107.362 1.00 18.37 C ATOM 33 O ILE A 8 43.363 34.768 107.000 1.00 18.76 O ATOM 34 CB ILE A 8 40.591 35.408 106.266 1.00 19.52 C ATOM 35 CG1 ILE A 8 39.678 35.816 105.110 1.00 22.82 C ATOM 36 CG2 ILE A 8 39.805 35.297 107.567 1.00 19.88 C ATOM 37 CD1 ILE A 8 40.281 35.554 103.760 1.00 27.62 C ATOM 0 H ILE A 8 42.800 35.911 104.867 1.00 19.87 H new ATOM 0 HA ILE A 8 41.304 37.249 106.738 1.00 19.45 H new ATOM 0 HB ILE A 8 40.968 34.541 106.047 1.00 19.52 H new ATOM 0 HG12 ILE A 8 38.839 35.334 105.182 1.00 22.82 H new ATOM 0 HG13 ILE A 8 39.470 36.760 105.187 1.00 22.82 H new ATOM 0 HG21 ILE A 8 39.085 34.657 107.457 1.00 19.88 H new ATOM 0 HG22 ILE A 8 40.395 35.000 108.277 1.00 19.88 H new ATOM 0 HG23 ILE A 8 39.434 36.164 107.796 1.00 19.88 H new ATOM 0 HD11 ILE A 8 39.660 35.831 103.069 1.00 27.62 H new ATOM 0 HD12 ILE A 8 41.107 36.055 103.672 1.00 27.62 H new ATOM 0 HD13 ILE A 8 40.466 34.606 103.667 1.00 27.62 H new ATOM 38 N ILE A 9 42.991 36.363 108.531 1.00 17.98 N ATOM 39 CA ILE A 9 43.985 35.812 109.445 1.00 17.54 C ATOM 40 C ILE A 9 43.391 35.313 110.754 1.00 17.31 C ATOM 41 O ILE A 9 42.264 35.662 111.121 1.00 17.41 O ATOM 42 CB ILE A 9 45.079 36.859 109.787 1.00 18.29 C ATOM 43 CG1 ILE A 9 44.448 38.056 110.507 1.00 17.28 C ATOM 44 CG2 ILE A 9 45.790 37.298 108.510 1.00 18.56 C ATOM 45 CD1 ILE A 9 45.458 39.070 111.054 1.00 19.63 C ATOM 0 H ILE A 9 42.585 37.066 108.814 1.00 17.98 H new ATOM 0 HA ILE A 9 44.368 35.057 108.972 1.00 17.54 H new ATOM 0 HB ILE A 9 45.736 36.461 110.380 1.00 18.29 H new ATOM 0 HG12 ILE A 9 43.850 38.510 109.893 1.00 17.28 H new ATOM 0 HG13 ILE A 9 43.905 37.728 111.241 1.00 17.28 H new ATOM 0 HG21 ILE A 9 46.472 37.952 108.728 1.00 18.56 H new ATOM 0 HG22 ILE A 9 46.203 36.528 108.088 1.00 18.56 H new ATOM 0 HG23 ILE A 9 45.147 37.693 107.901 1.00 18.56 H new ATOM 0 HD11 ILE A 9 44.985 39.794 111.493 1.00 19.63 H new ATOM 0 HD12 ILE A 9 46.043 38.632 111.692 1.00 19.63 H new ATOM 0 HD13 ILE A 9 45.987 39.427 110.323 1.00 19.63 H new ATOM 46 N ASN A 10 44.169 34.488 111.448 1.00 17.28 N ATOM 47 CA ASN A 10 43.780 33.931 112.735 1.00 17.05 C ATOM 48 C ASN A 10 42.441 33.224 112.686 1.00 16.96 C ATOM 49 O ASN A 10 41.598 33.412 113.557 1.00 17.88 O ATOM 50 CB ASN A 10 43.737 35.034 113.789 1.00 17.56 C ATOM 51 CG ASN A 10 45.069 35.746 113.934 1.00 18.10 C ATOM 52 OD1 ASN A 10 46.125 35.115 113.919 1.00 17.68 O ATOM 53 ND2 ASN A 10 45.022 37.062 114.085 1.00 17.38 N ATOM 0 H ASN A 10 44.946 34.234 111.180 1.00 17.28 H new ATOM 0 HA ASN A 10 44.449 33.269 112.969 1.00 17.05 H new ATOM 0 HB2 ASN A 10 43.052 35.679 113.551 1.00 17.56 H new ATOM 0 HB3 ASN A 10 43.482 34.652 114.643 1.00 17.56 H new ATOM 0 HD21 ASN A 10 45.750 37.510 114.178 1.00 17.38 H new ATOM 0 HD22 ASN A 10 44.264 37.467 114.090 1.00 17.38 H new ATOM 54 N ALA A 11 42.269 32.397 111.667 1.00 16.43 N ATOM 55 CA ALA A 11 41.035 31.656 111.492 1.00 16.53 C ATOM 56 C ALA A 11 41.111 30.239 112.026 1.00 16.58 C ATOM 57 O ALA A 11 42.114 29.547 111.862 1.00 16.41 O ATOM 58 CB ALA A 11 40.682 31.611 110.015 1.00 16.44 C ATOM 0 H ALA A 11 42.861 32.251 111.061 1.00 16.43 H new ATOM 0 HA ALA A 11 40.352 32.119 112.002 1.00 16.53 H new ATOM 0 HB1 ALA A 11 39.857 31.116 109.894 1.00 16.44 H new ATOM 0 HB2 ALA A 11 40.568 32.515 109.682 1.00 16.44 H new ATOM 0 HB3 ALA A 11 41.396 31.174 109.525 1.00 16.44 H new ATOM 59 N ARG A 12 40.045 29.815 112.691 1.00 16.22 N ATOM 60 CA ARG A 12 39.954 28.442 113.145 1.00 16.55 C ATOM 61 C ARG A 12 39.089 27.791 112.073 1.00 14.57 C ATOM 62 O ARG A 12 38.251 28.454 111.455 1.00 15.49 O ATOM 63 CB ARG A 12 39.281 28.348 114.514 1.00 17.42 C ATOM 64 CG ARG A 12 40.187 28.824 115.635 1.00 21.61 C ATOM 65 CD ARG A 12 39.589 28.611 117.013 1.00 25.38 C ATOM 66 NE ARG A 12 40.529 29.040 118.050 1.00 31.02 N ATOM 67 CZ ARG A 12 40.265 29.047 119.352 1.00 33.91 C ATOM 68 NH1 ARG A 12 41.187 29.457 120.213 1.00 35.45 N ATOM 69 NH2 ARG A 12 39.082 28.643 119.795 1.00 35.75 N ATOM 0 H ARG A 12 39.367 30.306 112.888 1.00 16.22 H new ATOM 0 HA ARG A 12 40.821 28.021 113.256 1.00 16.55 H new ATOM 0 HB2 ARG A 12 38.469 28.878 114.510 1.00 17.42 H new ATOM 0 HB3 ARG A 12 39.019 27.429 114.681 1.00 17.42 H new ATOM 0 HG2 ARG A 12 41.034 28.355 115.580 1.00 21.61 H new ATOM 0 HG3 ARG A 12 40.376 29.767 115.512 1.00 21.61 H new ATOM 0 HD2 ARG A 12 38.761 29.109 117.093 1.00 25.38 H new ATOM 0 HD3 ARG A 12 39.369 27.674 117.135 1.00 25.38 H new ATOM 0 HE ARG A 12 41.307 29.306 117.799 1.00 31.02 H new ATOM 0 HH11 ARG A 12 41.955 29.718 119.928 1.00 35.45 H new ATOM 0 HH12 ARG A 12 41.016 29.462 121.056 1.00 35.45 H new ATOM 0 HH21 ARG A 12 38.483 28.375 119.239 1.00 35.75 H new ATOM 0 HH22 ARG A 12 38.914 28.649 120.638 1.00 35.75 H new ATOM 70 N LEU A 13 39.315 26.509 111.822 1.00 15.16 N ATOM 71 CA LEU A 13 38.564 25.763 110.820 1.00 15.17 C ATOM 72 C LEU A 13 38.019 24.503 111.472 1.00 15.05 C ATOM 73 O LEU A 13 38.719 23.849 112.239 1.00 16.17 O ATOM 74 CB LEU A 13 39.469 25.362 109.655 1.00 15.64 C ATOM 75 CG LEU A 13 40.127 26.503 108.881 1.00 14.86 C ATOM 76 CD1 LEU A 13 41.149 25.930 107.914 1.00 17.10 C ATOM 77 CD2 LEU A 13 39.066 27.320 108.150 1.00 16.68 C ATOM 0 H LEU A 13 39.912 26.043 112.230 1.00 15.16 H new ATOM 0 HA LEU A 13 37.846 26.319 110.480 1.00 15.17 H new ATOM 0 HB2 LEU A 13 40.169 24.785 109.999 1.00 15.64 H new ATOM 0 HB3 LEU A 13 38.946 24.834 109.032 1.00 15.64 H new ATOM 0 HG LEU A 13 40.585 27.097 109.496 1.00 14.86 H new ATOM 0 HD11 LEU A 13 41.569 26.652 107.421 1.00 17.10 H new ATOM 0 HD12 LEU A 13 41.825 25.442 108.409 1.00 17.10 H new ATOM 0 HD13 LEU A 13 40.707 25.330 107.294 1.00 17.10 H new ATOM 0 HD21 LEU A 13 39.492 28.042 107.662 1.00 16.68 H new ATOM 0 HD22 LEU A 13 38.588 26.748 107.529 1.00 16.68 H new ATOM 0 HD23 LEU A 13 38.442 27.690 108.794 1.00 16.68 H new ATOM 78 N PRO A 14 36.769 24.131 111.163 1.00 14.57 N ATOM 79 CA PRO A 14 36.230 22.915 111.782 1.00 15.46 C ATOM 80 C PRO A 14 37.102 21.694 111.518 1.00 17.06 C ATOM 81 O PRO A 14 37.614 21.513 110.413 1.00 18.59 O ATOM 82 CB PRO A 14 34.864 22.768 111.122 1.00 14.76 C ATOM 83 CG PRO A 14 34.457 24.190 110.878 1.00 14.72 C ATOM 84 CD PRO A 14 35.743 24.810 110.350 1.00 13.56 C ATOM 0 HA PRO A 14 36.189 22.980 112.749 1.00 15.46 H new ATOM 0 HB2 PRO A 14 34.916 22.262 110.296 1.00 14.76 H new ATOM 0 HB3 PRO A 14 34.234 22.307 111.698 1.00 14.76 H new ATOM 0 HG2 PRO A 14 33.734 24.254 110.235 1.00 14.72 H new ATOM 0 HG3 PRO A 14 34.153 24.624 111.691 1.00 14.72 H new ATOM 0 HD2 PRO A 14 35.863 24.644 109.402 1.00 13.56 H new ATOM 0 HD3 PRO A 14 35.760 25.772 110.474 1.00 13.56 H new ATOM 85 N GLY A 15 37.260 20.865 112.547 1.00 19.41 N ATOM 86 CA GLY A 15 38.040 19.649 112.406 1.00 21.90 C ATOM 87 C GLY A 15 39.536 19.838 112.259 1.00 23.37 C ATOM 88 O GLY A 15 40.274 18.863 112.088 1.00 25.43 O ATOM 0 H GLY A 15 36.924 20.991 113.329 1.00 19.41 H new ATOM 0 HA2 GLY A 15 37.877 19.088 113.181 1.00 21.90 H new ATOM 0 HA3 GLY A 15 37.715 19.164 111.631 1.00 21.90 H new ATOM 89 N GLU A 16 39.992 21.083 112.320 1.00 23.36 N ATOM 90 CA GLU A 16 41.417 21.360 112.190 1.00 24.31 C ATOM 91 C GLU A 16 41.966 21.932 113.480 1.00 24.34 C ATOM 92 O GLU A 16 41.254 22.589 114.240 1.00 24.25 O ATOM 93 CB GLU A 16 41.677 22.362 111.060 1.00 24.65 C ATOM 94 CG GLU A 16 41.306 21.889 109.663 1.00 26.50 C ATOM 95 CD GLU A 16 42.110 20.683 109.196 1.00 28.55 C ATOM 96 OE1 GLU A 16 43.312 20.582 109.525 1.00 27.49 O ATOM 97 OE2 GLU A 16 41.541 19.838 108.476 1.00 29.38 O ATOM 0 H GLU A 16 39.498 21.777 112.435 1.00 23.36 H new ATOM 0 HA GLU A 16 41.861 20.522 111.987 1.00 24.31 H new ATOM 0 HB2 GLU A 16 41.183 23.175 111.250 1.00 24.65 H new ATOM 0 HB3 GLU A 16 42.619 22.594 111.066 1.00 24.65 H new ATOM 0 HG2 GLU A 16 40.362 21.666 109.645 1.00 26.50 H new ATOM 0 HG3 GLU A 16 41.437 22.618 109.037 1.00 26.50 H new ATOM 98 N GLU A 17 43.245 21.681 113.721 1.00 25.11 N ATOM 99 CA GLU A 17 43.910 22.194 114.903 1.00 25.69 C ATOM 100 C GLU A 17 44.530 23.534 114.545 1.00 23.43 C ATOM 101 O GLU A 17 44.814 23.801 113.379 1.00 23.45 O ATOM 102 CB GLU A 17 45.026 21.241 115.344 1.00 27.99 C ATOM 103 CG GLU A 17 44.550 19.859 115.748 1.00 32.90 C ATOM 104 CD GLU A 17 43.766 19.873 117.043 1.00 34.87 C ATOM 105 OE1 GLU A 17 43.205 18.817 117.406 1.00 37.93 O ATOM 106 OE2 GLU A 17 43.715 20.937 117.699 1.00 36.77 O ATOM 0 H GLU A 17 43.748 21.211 113.206 1.00 25.11 H new ATOM 0 HA GLU A 17 43.269 22.283 115.625 1.00 25.69 H new ATOM 0 HB2 GLU A 17 45.665 21.152 114.619 1.00 27.99 H new ATOM 0 HB3 GLU A 17 45.499 21.639 116.091 1.00 27.99 H new ATOM 0 HG2 GLU A 17 43.996 19.491 115.042 1.00 32.90 H new ATOM 0 HG3 GLU A 17 45.316 19.271 115.843 1.00 32.90 H new ATOM 107 N GLY A 18 44.726 24.374 115.552 1.00 22.83 N ATOM 108 CA GLY A 18 45.371 25.655 115.342 1.00 20.91 C ATOM 109 C GLY A 18 44.669 26.737 114.551 1.00 21.08 C ATOM 110 O GLY A 18 43.450 26.715 114.347 1.00 20.50 O ATOM 0 H GLY A 18 44.492 24.219 116.365 1.00 22.83 H new ATOM 0 HA2 GLY A 18 45.573 26.023 116.217 1.00 20.91 H new ATOM 0 HA3 GLY A 18 46.219 25.482 114.904 1.00 20.91 H new ATOM 111 N LEU A 19 45.473 27.699 114.111 1.00 19.69 N ATOM 112 CA LEU A 19 45.000 28.841 113.343 1.00 19.02 C ATOM 113 C LEU A 19 45.475 28.775 111.902 1.00 19.34 C ATOM 114 O LEU A 19 46.513 28.164 111.596 1.00 20.47 O ATOM 115 CB LEU A 19 45.480 30.139 113.984 1.00 17.97 C ATOM 116 CG LEU A 19 45.003 30.365 115.419 1.00 18.24 C ATOM 117 CD1 LEU A 19 45.580 31.670 115.939 1.00 20.15 C ATOM 118 CD2 LEU A 19 43.475 30.403 115.475 1.00 18.12 C ATOM 0 H LEU A 19 46.321 27.705 114.253 1.00 19.69 H new ATOM 0 HA LEU A 19 44.030 28.818 113.344 1.00 19.02 H new ATOM 0 HB2 LEU A 19 46.450 30.150 113.974 1.00 17.97 H new ATOM 0 HB3 LEU A 19 45.183 30.883 113.438 1.00 17.97 H new ATOM 0 HG LEU A 19 45.309 29.632 115.976 1.00 18.24 H new ATOM 0 HD11 LEU A 19 45.279 31.817 116.849 1.00 20.15 H new ATOM 0 HD12 LEU A 19 46.549 31.625 115.922 1.00 20.15 H new ATOM 0 HD13 LEU A 19 45.281 32.403 115.378 1.00 20.15 H new ATOM 0 HD21 LEU A 19 43.188 30.547 116.390 1.00 18.12 H new ATOM 0 HD22 LEU A 19 43.148 31.126 114.917 1.00 18.12 H new ATOM 0 HD23 LEU A 19 43.118 29.560 115.153 1.00 18.12 H new ATOM 119 N TRP A 20 44.719 29.429 111.026 1.00 19.14 N ATOM 120 CA TRP A 20 44.997 29.418 109.604 1.00 18.38 C ATOM 121 C TRP A 20 44.829 30.771 108.944 1.00 19.15 C ATOM 122 O TRP A 20 44.045 31.604 109.397 1.00 17.49 O ATOM 123 CB TRP A 20 44.067 28.417 108.917 1.00 19.34 C ATOM 124 CG TRP A 20 44.186 27.051 109.488 1.00 19.66 C ATOM 125 CD1 TRP A 20 43.705 26.617 110.691 1.00 20.39 C ATOM 126 CD2 TRP A 20 44.909 25.956 108.924 1.00 20.74 C ATOM 127 NE1 TRP A 20 44.093 25.318 110.914 1.00 21.09 N ATOM 128 CE2 TRP A 20 44.833 24.887 109.844 1.00 22.01 C ATOM 129 CE3 TRP A 20 45.618 25.773 107.729 1.00 21.38 C ATOM 130 CZ2 TRP A 20 45.440 23.652 109.608 1.00 22.95 C ATOM 131 CZ3 TRP A 20 46.224 24.541 107.494 1.00 23.51 C ATOM 132 CH2 TRP A 20 46.129 23.497 108.432 1.00 23.67 C ATOM 0 H TRP A 20 44.028 29.892 111.245 1.00 19.14 H new ATOM 0 HA TRP A 20 45.929 29.166 109.505 1.00 18.38 H new ATOM 0 HB2 TRP A 20 43.150 28.721 109.001 1.00 19.34 H new ATOM 0 HB3 TRP A 20 44.271 28.388 107.969 1.00 19.34 H new ATOM 0 HD1 TRP A 20 43.190 27.127 111.274 1.00 20.39 H new ATOM 0 HE1 TRP A 20 43.903 24.852 111.611 1.00 21.09 H new ATOM 0 HE3 TRP A 20 45.683 26.460 107.106 1.00 21.38 H new ATOM 0 HZ2 TRP A 20 45.379 22.959 110.226 1.00 22.95 H new ATOM 0 HZ3 TRP A 20 46.698 24.407 106.705 1.00 23.51 H new ATOM 0 HH2 TRP A 20 46.542 22.684 108.251 1.00 23.67 H new ATOM 133 N GLN A 21 45.575 30.968 107.864 1.00 19.69 N ATOM 134 CA GLN A 21 45.525 32.202 107.093 1.00 20.60 C ATOM 135 C GLN A 21 44.939 31.847 105.731 1.00 19.97 C ATOM 136 O GLN A 21 45.340 30.856 105.112 1.00 20.01 O ATOM 137 CB GLN A 21 46.941 32.771 106.952 1.00 23.19 C ATOM 138 CG GLN A 21 47.001 34.162 106.366 1.00 27.27 C ATOM 139 CD GLN A 21 48.373 34.799 106.517 1.00 28.32 C ATOM 140 OE1 GLN A 21 48.573 35.954 106.146 1.00 32.43 O ATOM 141 NE2 GLN A 21 49.324 34.047 107.064 1.00 30.57 N ATOM 0 H GLN A 21 46.128 30.386 107.556 1.00 19.69 H new ATOM 0 HA GLN A 21 44.979 32.877 107.527 1.00 20.60 H new ATOM 0 HB2 GLN A 21 47.362 32.782 107.826 1.00 23.19 H new ATOM 0 HB3 GLN A 21 47.463 32.174 106.393 1.00 23.19 H new ATOM 0 HG2 GLN A 21 46.767 34.124 105.425 1.00 27.27 H new ATOM 0 HG3 GLN A 21 46.338 34.722 106.800 1.00 27.27 H new ATOM 0 HE21 GLN A 21 49.147 33.243 107.312 1.00 30.57 H new ATOM 0 HE22 GLN A 21 50.116 34.365 107.170 1.00 30.57 H new ATOM 142 N ILE A 22 43.972 32.638 105.276 1.00 18.47 N ATOM 143 CA ILE A 22 43.334 32.392 103.990 1.00 19.22 C ATOM 144 C ILE A 22 43.670 33.561 103.076 1.00 19.10 C ATOM 145 O ILE A 22 43.216 34.680 103.295 1.00 19.35 O ATOM 146 CB ILE A 22 41.795 32.277 104.140 1.00 19.15 C ATOM 147 CG1 ILE A 22 41.450 31.130 105.096 1.00 20.05 C ATOM 148 CG2 ILE A 22 41.152 32.046 102.783 1.00 20.20 C ATOM 149 CD1 ILE A 22 41.789 31.406 106.547 1.00 24.85 C ATOM 0 H ILE A 22 43.671 33.324 105.699 1.00 18.47 H new ATOM 0 HA ILE A 22 43.658 31.555 103.622 1.00 19.22 H new ATOM 0 HB ILE A 22 41.450 33.106 104.507 1.00 19.15 H new ATOM 0 HG12 ILE A 22 40.501 30.939 105.027 1.00 20.05 H new ATOM 0 HG13 ILE A 22 41.921 30.332 104.811 1.00 20.05 H new ATOM 0 HG21 ILE A 22 40.190 31.976 102.888 1.00 20.20 H new ATOM 0 HG22 ILE A 22 41.359 32.790 102.196 1.00 20.20 H new ATOM 0 HG23 ILE A 22 41.496 31.225 102.397 1.00 20.20 H new ATOM 0 HD11 ILE A 22 41.544 30.639 107.088 1.00 24.85 H new ATOM 0 HD12 ILE A 22 42.741 31.569 106.632 1.00 24.85 H new ATOM 0 HD13 ILE A 22 41.299 32.186 106.851 1.00 24.85 H new ATOM 150 N HIS A 23 44.481 33.287 102.062 1.00 19.99 N ATOM 151 CA HIS A 23 44.900 34.310 101.117 1.00 21.90 C ATOM 152 C HIS A 23 43.865 34.470 100.018 1.00 21.95 C ATOM 153 O HIS A 23 43.393 33.483 99.449 1.00 22.70 O ATOM 154 CB HIS A 23 46.254 33.931 100.518 1.00 23.39 C ATOM 155 CG HIS A 23 47.327 33.749 101.545 1.00 25.52 C ATOM 156 ND1 HIS A 23 47.873 34.802 102.247 1.00 26.82 N ATOM 157 CD2 HIS A 23 47.924 32.630 102.019 1.00 26.21 C ATOM 158 CE1 HIS A 23 48.760 34.340 103.110 1.00 26.49 C ATOM 159 NE2 HIS A 23 48.810 33.025 102.992 1.00 27.30 N ATOM 0 H HIS A 23 44.803 32.505 101.903 1.00 19.99 H new ATOM 0 HA HIS A 23 44.984 35.156 101.583 1.00 21.90 H new ATOM 0 HB2 HIS A 23 46.158 33.109 100.011 1.00 23.39 H new ATOM 0 HB3 HIS A 23 46.528 34.620 99.892 1.00 23.39 H new ATOM 0 HD1 HIS A 23 47.668 35.630 102.140 1.00 26.82 H new ATOM 0 HD2 HIS A 23 47.764 31.758 101.739 1.00 26.21 H new ATOM 0 HE1 HIS A 23 49.264 34.853 103.700 1.00 26.49 H new ATOM 0 HE2 HIS A 23 49.315 32.501 103.450 1.00 27.30 H new ATOM 160 N LEU A 24 43.527 35.723 99.725 1.00 22.45 N ATOM 161 CA LEU A 24 42.533 36.042 98.710 1.00 22.77 C ATOM 162 C LEU A 24 43.150 36.783 97.531 1.00 23.65 C ATOM 163 O LEU A 24 43.981 37.677 97.712 1.00 24.37 O ATOM 164 CB LEU A 24 41.431 36.914 99.319 1.00 22.27 C ATOM 165 CG LEU A 24 40.834 36.437 100.644 1.00 22.59 C ATOM 166 CD1 LEU A 24 39.758 37.417 101.089 1.00 24.01 C ATOM 167 CD2 LEU A 24 40.259 35.035 100.484 1.00 22.13 C ATOM 0 H LEU A 24 43.869 36.411 100.111 1.00 22.45 H new ATOM 0 HA LEU A 24 42.164 35.204 98.389 1.00 22.77 H new ATOM 0 HB2 LEU A 24 41.789 37.806 99.451 1.00 22.27 H new ATOM 0 HB3 LEU A 24 40.712 36.990 98.672 1.00 22.27 H new ATOM 0 HG LEU A 24 41.527 36.401 101.322 1.00 22.59 H new ATOM 0 HD11 LEU A 24 39.376 37.119 101.929 1.00 24.01 H new ATOM 0 HD12 LEU A 24 40.150 38.297 101.206 1.00 24.01 H new ATOM 0 HD13 LEU A 24 39.062 37.461 100.415 1.00 24.01 H new ATOM 0 HD21 LEU A 24 39.883 34.741 101.328 1.00 22.13 H new ATOM 0 HD22 LEU A 24 39.564 35.045 99.807 1.00 22.13 H new ATOM 0 HD23 LEU A 24 40.963 34.425 100.214 1.00 22.13 H new ATOM 168 N GLN A 25 42.729 36.407 96.330 1.00 24.37 N ATOM 169 CA GLN A 25 43.211 37.034 95.110 1.00 26.53 C ATOM 170 C GLN A 25 42.121 36.994 94.043 1.00 26.12 C ATOM 171 O GLN A 25 41.567 35.937 93.752 1.00 24.58 O ATOM 172 CB GLN A 25 44.461 36.305 94.612 1.00 28.33 C ATOM 173 CG GLN A 25 45.032 36.846 93.309 1.00 33.52 C ATOM 174 CD GLN A 25 45.511 38.280 93.427 1.00 35.74 C ATOM 175 OE1 GLN A 25 44.728 39.189 93.706 1.00 38.41 O ATOM 176 NE2 GLN A 25 46.808 38.490 93.213 1.00 37.34 N ATOM 0 H GLN A 25 42.155 35.780 96.201 1.00 24.37 H new ATOM 0 HA GLN A 25 43.438 37.959 95.294 1.00 26.53 H new ATOM 0 HB2 GLN A 25 45.146 36.356 95.297 1.00 28.33 H new ATOM 0 HB3 GLN A 25 44.248 35.366 94.493 1.00 28.33 H new ATOM 0 HG2 GLN A 25 45.771 36.285 93.027 1.00 33.52 H new ATOM 0 HG3 GLN A 25 44.355 36.792 92.617 1.00 33.52 H new ATOM 0 HE21 GLN A 25 47.324 37.830 93.020 1.00 37.34 H new ATOM 0 HE22 GLN A 25 47.129 39.286 93.268 1.00 37.34 H new ATOM 177 N ASP A 26 41.812 38.154 93.472 1.00 26.22 N ATOM 178 CA ASP A 26 40.806 38.260 92.423 1.00 26.83 C ATOM 179 C ASP A 26 39.461 37.614 92.772 1.00 25.98 C ATOM 180 O ASP A 26 38.890 36.877 91.965 1.00 25.49 O ATOM 181 CB ASP A 26 41.349 37.657 91.123 1.00 29.42 C ATOM 182 CG ASP A 26 42.672 38.280 90.699 1.00 31.59 C ATOM 183 OD1 ASP A 26 42.763 39.525 90.681 1.00 33.13 O ATOM 184 OD2 ASP A 26 43.617 37.526 90.380 1.00 33.74 O ATOM 0 H ASP A 26 42.181 38.902 93.683 1.00 26.22 H new ATOM 0 HA ASP A 26 40.628 39.208 92.317 1.00 26.83 H new ATOM 0 HB2 ASP A 26 41.467 36.701 91.238 1.00 29.42 H new ATOM 0 HB3 ASP A 26 40.696 37.779 90.416 1.00 29.42 H new ATOM 185 N GLY A 27 38.967 37.903 93.974 1.00 25.14 N ATOM 186 CA GLY A 27 37.686 37.370 94.414 1.00 23.66 C ATOM 187 C GLY A 27 37.670 35.891 94.750 1.00 22.82 C ATOM 188 O GLY A 27 36.607 35.326 95.015 1.00 21.16 O ATOM 0 H GLY A 27 39.361 38.407 94.549 1.00 25.14 H new ATOM 0 HA2 GLY A 27 37.400 37.866 95.197 1.00 23.66 H new ATOM 0 HA3 GLY A 27 37.030 37.534 93.719 1.00 23.66 H new ATOM 189 N LYS A 28 38.838 35.263 94.746 1.00 22.39 N ATOM 190 CA LYS A 28 38.939 33.842 95.045 1.00 22.94 C ATOM 191 C LYS A 28 39.919 33.577 96.170 1.00 22.34 C ATOM 192 O LYS A 28 40.651 34.465 96.600 1.00 22.41 O ATOM 193 CB LYS A 28 39.406 33.068 93.809 1.00 24.70 C ATOM 194 CG LYS A 28 38.496 33.201 92.607 1.00 27.42 C ATOM 195 CD LYS A 28 38.971 32.319 91.462 1.00 30.35 C ATOM 196 CE LYS A 28 38.076 32.483 90.245 1.00 31.98 C ATOM 197 NZ LYS A 28 36.646 32.213 90.572 1.00 34.27 N ATOM 0 H LYS A 28 39.589 35.645 94.571 1.00 22.39 H new ATOM 0 HA LYS A 28 38.056 33.546 95.315 1.00 22.94 H new ATOM 0 HB2 LYS A 28 40.293 33.375 93.565 1.00 24.70 H new ATOM 0 HB3 LYS A 28 39.484 32.129 94.039 1.00 24.70 H new ATOM 0 HG2 LYS A 28 37.591 32.956 92.854 1.00 27.42 H new ATOM 0 HG3 LYS A 28 38.470 34.126 92.318 1.00 27.42 H new ATOM 0 HD2 LYS A 28 39.885 32.548 91.230 1.00 30.35 H new ATOM 0 HD3 LYS A 28 38.974 31.391 91.743 1.00 30.35 H new ATOM 0 HE2 LYS A 28 38.164 33.384 89.897 1.00 31.98 H new ATOM 0 HE3 LYS A 28 38.368 31.879 89.545 1.00 31.98 H new ATOM 0 HZ1 LYS A 28 36.182 32.116 89.819 1.00 34.27 H new ATOM 0 HZ2 LYS A 28 36.587 31.467 91.054 1.00 34.27 H new ATOM 0 HZ3 LYS A 28 36.314 32.894 91.039 1.00 34.27 H new ATOM 198 N ILE A 29 39.911 32.339 96.652 1.00 21.60 N ATOM 199 CA ILE A 29 40.831 31.909 97.690 1.00 21.88 C ATOM 200 C ILE A 29 42.045 31.378 96.924 1.00 22.13 C ATOM 201 O ILE A 29 41.946 30.395 96.185 1.00 22.95 O ATOM 202 CB ILE A 29 40.209 30.782 98.535 1.00 20.71 C ATOM 203 CG1 ILE A 29 38.996 31.327 99.295 1.00 20.90 C ATOM 204 CG2 ILE A 29 41.248 30.202 99.477 1.00 20.33 C ATOM 205 CD1 ILE A 29 38.190 30.254 100.015 1.00 20.31 C ATOM 0 H ILE A 29 39.370 31.726 96.384 1.00 21.60 H new ATOM 0 HA ILE A 29 41.055 32.628 98.302 1.00 21.88 H new ATOM 0 HB ILE A 29 39.907 30.064 97.957 1.00 20.71 H new ATOM 0 HG12 ILE A 29 39.298 31.982 99.943 1.00 20.90 H new ATOM 0 HG13 ILE A 29 38.416 31.792 98.672 1.00 20.90 H new ATOM 0 HG21 ILE A 29 40.847 29.494 100.005 1.00 20.33 H new ATOM 0 HG22 ILE A 29 41.987 29.842 98.962 1.00 20.33 H new ATOM 0 HG23 ILE A 29 41.575 30.899 100.067 1.00 20.33 H new ATOM 0 HD11 ILE A 29 37.441 30.665 100.473 1.00 20.31 H new ATOM 0 HD12 ILE A 29 37.860 29.610 99.370 1.00 20.31 H new ATOM 0 HD13 ILE A 29 38.756 29.803 100.661 1.00 20.31 H new ATOM 206 N SER A 30 43.184 32.040 97.076 1.00 23.59 N ATOM 207 CA SER A 30 44.386 31.615 96.367 1.00 23.63 C ATOM 208 C SER A 30 45.167 30.534 97.106 1.00 24.01 C ATOM 209 O SER A 30 45.742 29.638 96.481 1.00 25.20 O ATOM 210 CB SER A 30 45.285 32.824 96.095 1.00 23.52 C ATOM 211 OG SER A 30 45.582 33.521 97.291 1.00 24.84 O ATOM 0 H SER A 30 43.284 32.731 97.579 1.00 23.59 H new ATOM 0 HA SER A 30 44.095 31.222 95.529 1.00 23.63 H new ATOM 0 HB2 SER A 30 46.109 32.530 95.676 1.00 23.52 H new ATOM 0 HB3 SER A 30 44.847 33.422 95.470 1.00 23.52 H new ATOM 0 HG SER A 30 46.076 34.178 97.117 1.00 24.84 H new ATOM 212 N ALA A 31 45.182 30.609 98.432 1.00 22.93 N ATOM 213 CA ALA A 31 45.901 29.629 99.235 1.00 22.84 C ATOM 214 C ALA A 31 45.468 29.678 100.692 1.00 21.98 C ATOM 215 O ALA A 31 44.956 30.691 101.171 1.00 21.87 O ATOM 216 CB ALA A 31 47.404 29.879 99.136 1.00 23.60 C ATOM 0 H ALA A 31 44.782 31.220 98.886 1.00 22.93 H new ATOM 0 HA ALA A 31 45.692 28.748 98.888 1.00 22.84 H new ATOM 0 HB1 ALA A 31 47.877 29.224 99.672 1.00 23.60 H new ATOM 0 HB2 ALA A 31 47.685 29.802 98.211 1.00 23.60 H new ATOM 0 HB3 ALA A 31 47.606 30.770 99.462 1.00 23.60 H new ATOM 217 N ILE A 32 45.664 28.563 101.386 1.00 22.28 N ATOM 218 CA ILE A 32 45.331 28.455 102.802 1.00 23.26 C ATOM 219 C ILE A 32 46.586 27.909 103.481 1.00 23.64 C ATOM 220 O ILE A 32 47.074 26.842 103.114 1.00 24.60 O ATOM 221 CB ILE A 32 44.145 27.478 103.039 1.00 24.38 C ATOM 222 CG1 ILE A 32 42.875 28.013 102.372 1.00 24.99 C ATOM 223 CG2 ILE A 32 43.905 27.296 104.531 1.00 23.51 C ATOM 224 CD1 ILE A 32 42.890 27.906 100.871 1.00 28.88 C ATOM 0 H ILE A 32 45.995 27.845 101.048 1.00 22.28 H new ATOM 0 HA ILE A 32 45.060 29.317 103.155 1.00 23.26 H new ATOM 0 HB ILE A 32 44.369 26.620 102.647 1.00 24.38 H new ATOM 0 HG12 ILE A 32 42.109 27.527 102.715 1.00 24.99 H new ATOM 0 HG13 ILE A 32 42.755 28.943 102.621 1.00 24.99 H new ATOM 0 HG21 ILE A 32 43.164 26.685 104.668 1.00 23.51 H new ATOM 0 HG22 ILE A 32 44.703 26.933 104.945 1.00 23.51 H new ATOM 0 HG23 ILE A 32 43.695 28.154 104.932 1.00 23.51 H new ATOM 0 HD11 ILE A 32 42.061 28.260 100.513 1.00 28.88 H new ATOM 0 HD12 ILE A 32 43.637 28.413 100.518 1.00 28.88 H new ATOM 0 HD13 ILE A 32 42.981 26.975 100.614 1.00 28.88 H new ATOM 225 N ASP A 33 47.103 28.643 104.462 1.00 22.62 N ATOM 226 CA ASP A 33 48.321 28.239 105.160 1.00 24.02 C ATOM 227 C ASP A 33 48.141 28.235 106.668 1.00 22.39 C ATOM 228 O ASP A 33 47.525 29.130 107.232 1.00 22.17 O ATOM 229 CB ASP A 33 49.471 29.194 104.821 1.00 26.39 C ATOM 230 CG ASP A 33 49.717 29.316 103.333 1.00 28.95 C ATOM 231 OD1 ASP A 33 49.974 28.286 102.676 1.00 32.13 O ATOM 232 OD2 ASP A 33 49.661 30.454 102.822 1.00 32.83 O ATOM 0 H ASP A 33 46.762 29.382 104.740 1.00 22.62 H new ATOM 0 HA ASP A 33 48.524 27.338 104.865 1.00 24.02 H new ATOM 0 HB2 ASP A 33 49.274 30.072 105.184 1.00 26.39 H new ATOM 0 HB3 ASP A 33 50.282 28.883 105.254 1.00 26.39 H new ATOM 233 N ALA A 34 48.697 27.227 107.324 1.00 22.45 N ATOM 234 CA ALA A 34 48.605 27.143 108.768 1.00 22.77 C ATOM 235 C ALA A 34 49.516 28.186 109.400 1.00 22.07 C ATOM 236 O ALA A 34 50.548 28.562 108.835 1.00 22.19 O ATOM 237 CB ALA A 34 49.004 25.745 109.240 1.00 23.97 C ATOM 0 H ALA A 34 49.130 26.584 106.951 1.00 22.45 H new ATOM 0 HA ALA A 34 47.689 27.313 109.038 1.00 22.77 H new ATOM 0 HB1 ALA A 34 48.939 25.699 110.207 1.00 23.97 H new ATOM 0 HB2 ALA A 34 48.410 25.088 108.845 1.00 23.97 H new ATOM 0 HB3 ALA A 34 49.917 25.560 108.968 1.00 23.97 H new ATOM 238 N GLN A 35 49.112 28.671 110.566 1.00 21.45 N ATOM 239 CA GLN A 35 49.902 29.640 111.314 1.00 21.44 C ATOM 240 C GLN A 35 50.437 28.886 112.526 1.00 22.43 C ATOM 241 O GLN A 35 49.828 27.917 112.972 1.00 23.32 O ATOM 242 CB GLN A 35 49.035 30.796 111.814 1.00 20.08 C ATOM 243 CG GLN A 35 48.302 31.571 110.738 1.00 19.29 C ATOM 244 CD GLN A 35 47.390 32.645 111.314 1.00 18.46 C ATOM 245 OE1 GLN A 35 46.616 33.265 110.586 1.00 19.02 O ATOM 246 NE2 GLN A 35 47.483 32.875 112.621 1.00 18.82 N ATOM 0 H GLN A 35 48.373 28.449 110.946 1.00 21.45 H new ATOM 0 HA GLN A 35 50.601 30.012 110.753 1.00 21.44 H new ATOM 0 HB2 GLN A 35 48.382 30.444 112.439 1.00 20.08 H new ATOM 0 HB3 GLN A 35 49.598 31.412 112.309 1.00 20.08 H new ATOM 0 HG2 GLN A 35 48.948 31.984 110.144 1.00 19.29 H new ATOM 0 HG3 GLN A 35 47.776 30.957 110.202 1.00 19.29 H new ATOM 0 HE21 GLN A 35 48.036 32.422 113.099 1.00 18.82 H new ATOM 0 HE22 GLN A 35 46.990 33.477 112.988 1.00 18.82 H new ATOM 247 N SER A 36 51.570 29.322 113.061 1.00 23.43 N ATOM 248 CA SER A 36 52.125 28.671 114.242 1.00 24.09 C ATOM 249 C SER A 36 51.853 29.541 115.463 1.00 24.19 C ATOM 250 O SER A 36 52.232 29.202 116.584 1.00 26.14 O ATOM 251 CB SER A 36 53.629 28.445 114.079 1.00 25.75 C ATOM 252 OG SER A 36 54.309 29.670 113.885 1.00 26.17 O ATOM 0 H SER A 36 52.029 29.985 112.761 1.00 23.43 H new ATOM 0 HA SER A 36 51.703 27.805 114.357 1.00 24.09 H new ATOM 0 HB2 SER A 36 53.979 27.998 114.866 1.00 25.75 H new ATOM 0 HB3 SER A 36 53.791 27.858 113.324 1.00 25.75 H new ATOM 0 HG SER A 36 54.724 29.648 113.155 1.00 26.17 H new ATOM 253 N GLY A 37 51.178 30.663 115.232 1.00 23.13 N ATOM 254 CA GLY A 37 50.844 31.582 116.306 1.00 22.73 C ATOM 255 C GLY A 37 49.860 32.623 115.808 1.00 21.76 C ATOM 256 O GLY A 37 49.369 32.525 114.682 1.00 23.08 O ATOM 0 H GLY A 37 50.904 30.909 114.455 1.00 23.13 H new ATOM 0 HA2 GLY A 37 50.461 31.094 117.052 1.00 22.73 H new ATOM 0 HA3 GLY A 37 51.648 32.016 116.633 1.00 22.73 H new ATOM 257 N VAL A 38 49.563 33.617 116.638 1.00 22.36 N ATOM 258 CA VAL A 38 48.636 34.675 116.258 1.00 21.16 C ATOM 259 C VAL A 38 49.331 35.710 115.368 1.00 20.37 C ATOM 260 O VAL A 38 50.400 36.222 115.715 1.00 20.44 O ATOM 261 CB VAL A 38 48.056 35.372 117.511 1.00 21.18 C ATOM 262 CG1 VAL A 38 47.170 36.534 117.107 1.00 22.49 C ATOM 263 CG2 VAL A 38 47.256 34.373 118.331 1.00 21.79 C ATOM 0 H VAL A 38 49.890 33.697 117.430 1.00 22.36 H new ATOM 0 HA VAL A 38 47.910 34.268 115.760 1.00 21.16 H new ATOM 0 HB VAL A 38 48.790 35.712 118.047 1.00 21.18 H new ATOM 0 HG11 VAL A 38 46.814 36.961 117.902 1.00 22.49 H new ATOM 0 HG12 VAL A 38 47.690 37.177 116.601 1.00 22.49 H new ATOM 0 HG13 VAL A 38 46.438 36.208 116.560 1.00 22.49 H new ATOM 0 HG21 VAL A 38 46.894 34.814 119.116 1.00 21.79 H new ATOM 0 HG22 VAL A 38 46.529 34.022 117.794 1.00 21.79 H new ATOM 0 HG23 VAL A 38 47.834 33.645 118.608 1.00 21.79 H new ATOM 264 N MET A 39 48.725 36.002 114.219 1.00 19.26 N ATOM 265 CA MET A 39 49.271 36.967 113.263 1.00 19.00 C ATOM 266 C MET A 39 48.829 38.381 113.589 1.00 20.56 C ATOM 267 O MET A 39 47.743 38.598 114.108 1.00 19.97 O ATOM 268 CB MET A 39 48.818 36.623 111.838 1.00 17.20 C ATOM 269 CG MET A 39 49.517 35.447 111.227 1.00 20.15 C ATOM 270 SD MET A 39 51.202 35.907 110.811 1.00 22.50 S ATOM 271 CE MET A 39 51.885 34.330 110.343 1.00 23.12 C ATOM 0 H MET A 39 47.983 35.645 113.970 1.00 19.26 H new ATOM 0 HA MET A 39 50.238 36.918 113.324 1.00 19.00 H new ATOM 0 HB2 MET A 39 47.864 36.448 111.848 1.00 17.20 H new ATOM 0 HB3 MET A 39 48.958 37.398 111.271 1.00 17.20 H new ATOM 0 HG2 MET A 39 49.518 34.701 111.847 1.00 20.15 H new ATOM 0 HG3 MET A 39 49.045 35.155 110.432 1.00 20.15 H new ATOM 0 HE1 MET A 39 52.815 34.442 110.089 1.00 23.12 H new ATOM 0 HE2 MET A 39 51.826 33.717 111.092 1.00 23.12 H new ATOM 0 HE3 MET A 39 51.387 33.971 109.592 1.00 23.12 H new ATOM 272 N PRO A 40 49.678 39.373 113.286 1.00 21.47 N ATOM 273 CA PRO A 40 49.305 40.756 113.573 1.00 22.44 C ATOM 274 C PRO A 40 48.318 41.264 112.534 1.00 23.36 C ATOM 275 O PRO A 40 48.335 40.830 111.380 1.00 23.65 O ATOM 276 CB PRO A 40 50.637 41.489 113.497 1.00 22.12 C ATOM 277 CG PRO A 40 51.327 40.764 112.389 1.00 21.81 C ATOM 278 CD PRO A 40 51.036 39.302 112.719 1.00 21.71 C ATOM 0 HA PRO A 40 48.863 40.876 114.428 1.00 22.44 H new ATOM 0 HB2 PRO A 40 50.522 42.431 113.298 1.00 22.12 H new ATOM 0 HB3 PRO A 40 51.130 41.433 114.330 1.00 22.12 H new ATOM 0 HG2 PRO A 40 50.976 41.015 111.520 1.00 21.81 H new ATOM 0 HG3 PRO A 40 52.279 40.948 112.375 1.00 21.81 H new ATOM 0 HD2 PRO A 40 51.070 38.739 111.930 1.00 21.71 H new ATOM 0 HD3 PRO A 40 51.675 38.940 113.353 1.00 21.71 H new ATOM 279 N ILE A 41 47.458 42.179 112.955 1.00 26.02 N ATOM 280 CA ILE A 41 46.478 42.767 112.060 1.00 28.45 C ATOM 281 C ILE A 41 47.235 43.756 111.179 1.00 29.58 C ATOM 282 O ILE A 41 48.344 44.172 111.514 1.00 29.83 O ATOM 283 CB ILE A 41 45.385 43.507 112.873 1.00 29.94 C ATOM 284 CG1 ILE A 41 44.260 44.001 111.951 1.00 32.06 C ATOM 285 CG2 ILE A 41 46.022 44.643 113.660 1.00 30.97 C ATOM 286 CD1 ILE A 41 44.500 45.368 111.307 1.00 34.10 C ATOM 0 H ILE A 41 47.426 42.475 113.762 1.00 26.02 H new ATOM 0 HA ILE A 41 46.037 42.086 111.528 1.00 28.45 H new ATOM 0 HB ILE A 41 44.978 42.893 113.504 1.00 29.94 H new ATOM 0 HG12 ILE A 41 44.127 43.347 111.247 1.00 32.06 H new ATOM 0 HG13 ILE A 41 43.436 44.040 112.462 1.00 32.06 H new ATOM 0 HG21 ILE A 41 45.339 45.107 114.169 1.00 30.97 H new ATOM 0 HG22 ILE A 41 46.688 44.283 114.266 1.00 30.97 H new ATOM 0 HG23 ILE A 41 46.445 45.264 113.047 1.00 30.97 H new ATOM 0 HD11 ILE A 41 43.744 45.598 110.745 1.00 34.10 H new ATOM 0 HD12 ILE A 41 44.604 46.039 112.000 1.00 34.10 H new ATOM 0 HD13 ILE A 41 45.305 45.335 110.767 1.00 34.10 H new ATOM 287 N THR A 42 46.651 44.102 110.041 1.00 30.15 N ATOM 288 CA THR A 42 47.255 45.060 109.123 1.00 31.22 C ATOM 289 C THR A 42 46.181 45.446 108.120 1.00 32.26 C ATOM 290 O THR A 42 45.154 44.776 108.029 1.00 31.31 O ATOM 291 CB THR A 42 48.465 44.454 108.378 1.00 31.40 C ATOM 292 OG1 THR A 42 49.122 45.479 107.619 1.00 30.91 O ATOM 293 CG2 THR A 42 48.015 43.340 107.439 1.00 30.99 C ATOM 0 H THR A 42 45.894 43.789 109.778 1.00 30.15 H new ATOM 0 HA THR A 42 47.581 45.828 109.618 1.00 31.22 H new ATOM 0 HB THR A 42 49.078 44.083 109.032 1.00 31.40 H new ATOM 0 HG1 THR A 42 49.781 45.150 107.215 1.00 30.91 H new ATOM 0 HG21 THR A 42 48.786 42.972 106.980 1.00 30.99 H new ATOM 0 HG22 THR A 42 47.580 42.641 107.951 1.00 30.99 H new ATOM 0 HG23 THR A 42 47.392 43.698 106.787 1.00 30.99 H new ATOM 294 N GLU A 43 46.401 46.524 107.376 1.00 33.30 N ATOM 295 CA GLU A 43 45.411 46.946 106.396 1.00 35.01 C ATOM 296 C GLU A 43 45.279 45.856 105.339 1.00 34.88 C ATOM 297 O GLU A 43 46.268 45.229 104.958 1.00 35.93 O ATOM 298 CB GLU A 43 45.827 48.264 105.740 1.00 36.72 C ATOM 299 CG GLU A 43 44.647 49.103 105.276 1.00 39.59 C ATOM 300 CD GLU A 43 45.070 50.367 104.556 1.00 41.48 C ATOM 301 OE1 GLU A 43 45.979 51.064 105.057 1.00 42.56 O ATOM 302 OE2 GLU A 43 44.485 50.668 103.492 1.00 42.94 O ATOM 0 H GLU A 43 47.104 47.017 107.422 1.00 33.30 H new ATOM 0 HA GLU A 43 44.559 47.087 106.838 1.00 35.01 H new ATOM 0 HB2 GLU A 43 46.354 48.779 106.370 1.00 36.72 H new ATOM 0 HB3 GLU A 43 46.399 48.074 104.980 1.00 36.72 H new ATOM 0 HG2 GLU A 43 44.090 48.571 104.686 1.00 39.59 H new ATOM 0 HG3 GLU A 43 44.103 49.340 106.043 1.00 39.59 H new ATOM 303 N ASN A 44 44.052 45.633 104.879 1.00 34.62 N ATOM 304 CA ASN A 44 43.754 44.618 103.871 1.00 33.64 C ATOM 305 C ASN A 44 43.646 43.214 104.463 1.00 31.74 C ATOM 306 O ASN A 44 43.475 42.236 103.735 1.00 32.15 O ATOM 307 CB ASN A 44 44.803 44.631 102.757 1.00 35.49 C ATOM 308 CG ASN A 44 44.863 45.961 102.036 1.00 36.96 C ATOM 309 OD1 ASN A 44 43.833 46.513 101.643 1.00 38.46 O ATOM 310 ND2 ASN A 44 46.071 46.482 101.851 1.00 37.62 N ATOM 0 H ASN A 44 43.361 46.071 105.145 1.00 34.62 H new ATOM 0 HA ASN A 44 42.887 44.847 103.501 1.00 33.64 H new ATOM 0 HB2 ASN A 44 45.674 44.431 103.134 1.00 35.49 H new ATOM 0 HB3 ASN A 44 44.602 43.929 102.119 1.00 35.49 H new ATOM 0 HD21 ASN A 44 46.157 47.234 101.443 1.00 37.62 H new ATOM 0 HD22 ASN A 44 46.767 46.067 102.140 1.00 37.62 H new ATOM 311 N SER A 45 43.758 43.119 105.784 1.00 30.44 N ATOM 312 CA SER A 45 43.640 41.838 106.476 1.00 28.08 C ATOM 313 C SER A 45 42.393 41.855 107.348 1.00 26.49 C ATOM 314 O SER A 45 42.187 42.789 108.119 1.00 26.51 O ATOM 315 CB SER A 45 44.855 41.577 107.376 1.00 28.84 C ATOM 316 OG SER A 45 45.918 40.969 106.664 1.00 30.55 O ATOM 0 H SER A 45 43.904 43.790 106.302 1.00 30.44 H new ATOM 0 HA SER A 45 43.588 41.138 105.807 1.00 28.08 H new ATOM 0 HB2 SER A 45 45.160 42.415 107.759 1.00 28.84 H new ATOM 0 HB3 SER A 45 44.593 41.006 108.115 1.00 28.84 H new ATOM 0 HG SER A 45 46.529 40.756 107.200 1.00 30.55 H new ATOM 317 N LEU A 46 41.553 40.834 107.213 1.00 23.13 N ATOM 318 CA LEU A 46 40.356 40.739 108.036 1.00 21.25 C ATOM 319 C LEU A 46 40.733 39.751 109.133 1.00 20.09 C ATOM 320 O LEU A 46 41.069 38.595 108.861 1.00 20.26 O ATOM 321 CB LEU A 46 39.169 40.220 107.221 1.00 20.75 C ATOM 322 CG LEU A 46 37.815 40.248 107.937 1.00 21.41 C ATOM 323 CD1 LEU A 46 37.476 41.665 108.372 1.00 21.92 C ATOM 324 CD2 LEU A 46 36.741 39.721 106.997 1.00 20.92 C ATOM 0 H LEU A 46 41.658 40.190 106.653 1.00 23.13 H new ATOM 0 HA LEU A 46 40.081 41.600 108.389 1.00 21.25 H new ATOM 0 HB2 LEU A 46 39.099 40.747 106.409 1.00 20.75 H new ATOM 0 HB3 LEU A 46 39.356 39.307 106.952 1.00 20.75 H new ATOM 0 HG LEU A 46 37.859 39.687 108.727 1.00 21.41 H new ATOM 0 HD11 LEU A 46 36.617 41.668 108.823 1.00 21.92 H new ATOM 0 HD12 LEU A 46 38.160 41.990 108.977 1.00 21.92 H new ATOM 0 HD13 LEU A 46 37.434 42.241 107.593 1.00 21.92 H new ATOM 0 HD21 LEU A 46 35.881 39.737 107.446 1.00 20.92 H new ATOM 0 HD22 LEU A 46 36.702 40.279 106.205 1.00 20.92 H new ATOM 0 HD23 LEU A 46 36.954 38.810 106.740 1.00 20.92 H new ATOM 325 N ASP A 47 40.700 40.223 110.370 1.00 19.05 N ATOM 326 CA ASP A 47 41.078 39.405 111.512 1.00 19.88 C ATOM 327 C ASP A 47 39.908 38.596 112.049 1.00 18.69 C ATOM 328 O ASP A 47 38.968 39.158 112.597 1.00 19.30 O ATOM 329 CB ASP A 47 41.625 40.309 112.620 1.00 20.27 C ATOM 330 CG ASP A 47 42.389 39.543 113.688 1.00 21.54 C ATOM 331 OD1 ASP A 47 42.425 38.293 113.645 1.00 20.46 O ATOM 332 OD2 ASP A 47 42.965 40.204 114.581 1.00 22.53 O ATOM 0 H ASP A 47 40.459 41.024 110.571 1.00 19.05 H new ATOM 0 HA ASP A 47 41.757 38.778 111.217 1.00 19.88 H new ATOM 0 HB2 ASP A 47 42.209 40.976 112.227 1.00 20.27 H new ATOM 0 HB3 ASP A 47 40.889 40.785 113.035 1.00 20.27 H new ATOM 333 N ALA A 48 39.974 37.277 111.883 1.00 18.02 N ATOM 334 CA ALA A 48 38.922 36.396 112.390 1.00 18.47 C ATOM 335 C ALA A 48 39.018 36.327 113.915 1.00 18.85 C ATOM 336 O ALA A 48 38.126 35.808 114.580 1.00 19.41 O ATOM 337 CB ALA A 48 39.065 35.003 111.789 1.00 18.55 C ATOM 0 H ALA A 48 40.617 36.872 111.481 1.00 18.02 H new ATOM 0 HA ALA A 48 38.055 36.749 112.137 1.00 18.47 H new ATOM 0 HB1 ALA A 48 38.363 34.429 112.132 1.00 18.55 H new ATOM 0 HB2 ALA A 48 38.994 35.058 110.823 1.00 18.55 H new ATOM 0 HB3 ALA A 48 39.930 34.634 112.028 1.00 18.55 H new ATOM 338 N GLU A 49 40.119 36.842 114.464 1.00 19.64 N ATOM 339 CA GLU A 49 40.331 36.868 115.910 1.00 20.04 C ATOM 340 C GLU A 49 40.132 35.522 116.598 1.00 18.80 C ATOM 341 O GLU A 49 39.545 35.439 117.675 1.00 20.09 O ATOM 342 CB GLU A 49 39.417 37.920 116.545 1.00 20.98 C ATOM 343 CG GLU A 49 39.708 39.338 116.068 1.00 24.72 C ATOM 344 CD GLU A 49 38.838 40.383 116.742 1.00 27.35 C ATOM 345 OE1 GLU A 49 39.105 41.590 116.554 1.00 30.59 O ATOM 346 OE2 GLU A 49 37.887 40.004 117.456 1.00 30.48 O ATOM 0 H GLU A 49 40.762 37.185 114.008 1.00 19.64 H new ATOM 0 HA GLU A 49 41.264 37.097 116.042 1.00 20.04 H new ATOM 0 HB2 GLU A 49 38.494 37.701 116.344 1.00 20.98 H new ATOM 0 HB3 GLU A 49 39.514 37.884 117.509 1.00 20.98 H new ATOM 0 HG2 GLU A 49 40.641 39.545 116.235 1.00 24.72 H new ATOM 0 HG3 GLU A 49 39.575 39.384 115.108 1.00 24.72 H new ATOM 347 N GLN A 50 40.647 34.475 115.967 1.00 18.98 N ATOM 348 CA GLN A 50 40.565 33.117 116.485 1.00 18.70 C ATOM 349 C GLN A 50 39.137 32.604 116.532 1.00 18.64 C ATOM 350 O GLN A 50 38.809 31.696 117.301 1.00 19.28 O ATOM 351 CB GLN A 50 41.243 33.032 117.857 1.00 19.62 C ATOM 352 CG GLN A 50 42.734 33.362 117.759 1.00 21.59 C ATOM 353 CD GLN A 50 43.468 33.226 119.073 1.00 23.56 C ATOM 354 OE1 GLN A 50 43.870 34.221 119.678 1.00 26.57 O ATOM 355 NE2 GLN A 50 43.652 31.990 119.522 1.00 24.16 N ATOM 0 H GLN A 50 41.060 34.534 115.215 1.00 18.98 H new ATOM 0 HA GLN A 50 41.041 32.536 115.871 1.00 18.70 H new ATOM 0 HB2 GLN A 50 40.813 33.647 118.472 1.00 19.62 H new ATOM 0 HB3 GLN A 50 41.130 32.140 118.222 1.00 19.62 H new ATOM 0 HG2 GLN A 50 43.145 32.776 117.105 1.00 21.59 H new ATOM 0 HG3 GLN A 50 42.837 34.269 117.432 1.00 21.59 H new ATOM 0 HE21 GLN A 50 43.356 31.320 119.071 1.00 24.16 H new ATOM 0 HE22 GLN A 50 44.067 31.859 120.264 1.00 24.16 H new ATOM 356 N GLY A 51 38.297 33.222 115.702 1.00 17.73 N ATOM 357 CA GLY A 51 36.912 32.812 115.566 1.00 17.85 C ATOM 358 C GLY A 51 36.906 31.724 114.508 1.00 17.04 C ATOM 359 O GLY A 51 37.934 31.409 113.904 1.00 18.14 O ATOM 0 H GLY A 51 38.519 33.888 115.206 1.00 17.73 H new ATOM 0 HA2 GLY A 51 36.563 32.481 116.408 1.00 17.85 H new ATOM 0 HA3 GLY A 51 36.352 33.559 115.301 1.00 17.85 H new ATOM 360 N LEU A 52 35.736 31.157 114.253 1.00 14.69 N ATOM 361 CA LEU A 52 35.600 30.069 113.304 1.00 14.28 C ATOM 362 C LEU A 52 35.246 30.571 111.907 1.00 13.74 C ATOM 363 O LEU A 52 34.315 31.362 111.744 1.00 15.22 O ATOM 364 CB LEU A 52 34.511 29.118 113.819 1.00 15.05 C ATOM 365 CG LEU A 52 34.413 27.727 113.202 1.00 14.69 C ATOM 366 CD1 LEU A 52 35.604 26.857 113.600 1.00 15.46 C ATOM 367 CD2 LEU A 52 33.116 27.090 113.693 1.00 14.64 C ATOM 0 H LEU A 52 34.999 31.394 114.627 1.00 14.69 H new ATOM 0 HA LEU A 52 36.450 29.608 113.229 1.00 14.28 H new ATOM 0 HB2 LEU A 52 34.641 29.009 114.774 1.00 15.05 H new ATOM 0 HB3 LEU A 52 33.654 29.556 113.698 1.00 15.05 H new ATOM 0 HG LEU A 52 34.419 27.800 112.235 1.00 14.69 H new ATOM 0 HD11 LEU A 52 35.515 25.981 113.194 1.00 15.46 H new ATOM 0 HD12 LEU A 52 36.425 27.273 113.294 1.00 15.46 H new ATOM 0 HD13 LEU A 52 35.629 26.765 114.565 1.00 15.46 H new ATOM 0 HD21 LEU A 52 33.028 26.201 113.314 1.00 14.64 H new ATOM 0 HD22 LEU A 52 33.132 27.029 114.661 1.00 14.64 H new ATOM 0 HD23 LEU A 52 32.363 27.635 113.416 1.00 14.64 H new ATOM 368 N VAL A 53 35.990 30.120 110.903 1.00 12.70 N ATOM 369 CA VAL A 53 35.714 30.516 109.532 1.00 13.36 C ATOM 370 C VAL A 53 35.168 29.304 108.802 1.00 12.81 C ATOM 371 O VAL A 53 35.754 28.226 108.819 1.00 14.49 O ATOM 372 CB VAL A 53 36.973 31.048 108.814 1.00 14.27 C ATOM 373 CG1 VAL A 53 36.646 31.348 107.344 1.00 16.23 C ATOM 374 CG2 VAL A 53 37.453 32.318 109.504 1.00 17.56 C ATOM 0 H VAL A 53 36.657 29.585 110.996 1.00 12.70 H new ATOM 0 HA VAL A 53 35.070 31.241 109.535 1.00 13.36 H new ATOM 0 HB VAL A 53 37.672 30.377 108.852 1.00 14.27 H new ATOM 0 HG11 VAL A 53 37.440 31.682 106.897 1.00 16.23 H new ATOM 0 HG12 VAL A 53 36.347 30.536 106.907 1.00 16.23 H new ATOM 0 HG13 VAL A 53 35.945 32.016 107.298 1.00 16.23 H new ATOM 0 HG21 VAL A 53 38.244 32.652 109.053 1.00 17.56 H new ATOM 0 HG22 VAL A 53 36.754 32.989 109.470 1.00 17.56 H new ATOM 0 HG23 VAL A 53 37.667 32.122 110.430 1.00 17.56 H new ATOM 375 N ILE A 54 34.015 29.498 108.171 1.00 12.60 N ATOM 376 CA ILE A 54 33.333 28.435 107.453 1.00 11.65 C ATOM 377 C ILE A 54 32.721 28.965 106.167 1.00 11.85 C ATOM 378 O ILE A 54 32.571 30.175 105.994 1.00 11.98 O ATOM 379 CB ILE A 54 32.163 27.859 108.306 1.00 11.73 C ATOM 380 CG1 ILE A 54 31.228 28.994 108.745 1.00 13.43 C ATOM 381 CG2 ILE A 54 32.712 27.100 109.498 1.00 13.43 C ATOM 382 CD1 ILE A 54 31.775 29.886 109.828 1.00 21.97 C ATOM 0 H ILE A 54 33.606 30.254 108.149 1.00 12.60 H new ATOM 0 HA ILE A 54 33.993 27.749 107.265 1.00 11.65 H new ATOM 0 HB ILE A 54 31.648 27.237 107.769 1.00 11.73 H new ATOM 0 HG12 ILE A 54 31.018 29.539 107.971 1.00 13.43 H new ATOM 0 HG13 ILE A 54 30.394 28.607 109.054 1.00 13.43 H new ATOM 0 HG21 ILE A 54 31.977 26.745 110.023 1.00 13.43 H new ATOM 0 HG22 ILE A 54 33.269 26.369 109.188 1.00 13.43 H new ATOM 0 HG23 ILE A 54 33.241 27.699 110.047 1.00 13.43 H new ATOM 0 HD11 ILE A 54 31.123 30.571 110.043 1.00 21.97 H new ATOM 0 HD12 ILE A 54 31.961 29.357 110.620 1.00 21.97 H new ATOM 0 HD13 ILE A 54 32.594 30.305 109.520 1.00 21.97 H new ATOM 383 N PRO A 55 32.406 28.067 105.227 1.00 11.76 N ATOM 384 CA PRO A 55 31.775 28.562 104.002 1.00 12.62 C ATOM 385 C PRO A 55 30.398 29.097 104.472 1.00 12.91 C ATOM 386 O PRO A 55 29.947 28.821 105.588 1.00 12.43 O ATOM 387 CB PRO A 55 31.701 27.322 103.116 1.00 12.31 C ATOM 388 CG PRO A 55 31.658 26.187 104.115 1.00 12.70 C ATOM 389 CD PRO A 55 32.634 26.615 105.176 1.00 11.72 C ATOM 0 HA PRO A 55 32.220 29.270 103.510 1.00 12.62 H new ATOM 0 HB2 PRO A 55 30.913 27.332 102.551 1.00 12.31 H new ATOM 0 HB3 PRO A 55 32.470 27.254 102.529 1.00 12.31 H new ATOM 0 HG2 PRO A 55 30.767 26.064 104.478 1.00 12.70 H new ATOM 0 HG3 PRO A 55 31.918 25.345 103.710 1.00 12.70 H new ATOM 0 HD2 PRO A 55 32.455 26.188 106.029 1.00 11.72 H new ATOM 0 HD3 PRO A 55 33.549 26.399 104.937 1.00 11.72 H new ATOM 390 N PRO A 56 29.698 29.846 103.622 1.00 12.03 N ATOM 391 CA PRO A 56 28.414 30.400 104.054 1.00 11.72 C ATOM 392 C PRO A 56 27.317 29.456 104.489 1.00 10.22 C ATOM 393 O PRO A 56 27.227 28.325 104.025 1.00 10.99 O ATOM 394 CB PRO A 56 27.965 31.228 102.850 1.00 10.93 C ATOM 395 CG PRO A 56 29.244 31.447 102.048 1.00 12.13 C ATOM 396 CD PRO A 56 29.960 30.150 102.207 1.00 12.47 C ATOM 0 HA PRO A 56 28.562 30.881 104.883 1.00 11.72 H new ATOM 0 HB2 PRO A 56 27.295 30.760 102.328 1.00 10.93 H new ATOM 0 HB3 PRO A 56 27.571 32.070 103.126 1.00 10.93 H new ATOM 0 HG2 PRO A 56 29.056 31.642 101.117 1.00 12.13 H new ATOM 0 HG3 PRO A 56 29.763 32.190 102.394 1.00 12.13 H new ATOM 0 HD2 PRO A 56 29.611 29.465 101.615 1.00 12.47 H new ATOM 0 HD3 PRO A 56 30.908 30.231 102.020 1.00 12.47 H new ATOM 397 N PHE A 57 26.465 29.946 105.379 1.00 10.37 N ATOM 398 CA PHE A 57 25.319 29.148 105.768 1.00 9.63 C ATOM 399 C PHE A 57 24.456 29.020 104.516 1.00 10.09 C ATOM 400 O PHE A 57 24.495 29.853 103.599 1.00 10.03 O ATOM 401 CB PHE A 57 24.529 29.847 106.865 1.00 9.65 C ATOM 402 CG PHE A 57 25.158 29.747 108.228 1.00 8.55 C ATOM 403 CD1 PHE A 57 25.204 30.852 109.059 1.00 9.45 C ATOM 404 CD2 PHE A 57 25.677 28.539 108.689 1.00 9.97 C ATOM 405 CE1 PHE A 57 25.755 30.765 110.338 1.00 9.82 C ATOM 406 CE2 PHE A 57 26.237 28.447 109.971 1.00 9.64 C ATOM 407 CZ PHE A 57 26.273 29.558 110.791 1.00 9.53 C ATOM 0 H PHE A 57 26.530 30.715 105.758 1.00 10.37 H new ATOM 0 HA PHE A 57 25.594 28.283 106.112 1.00 9.63 H new ATOM 0 HB2 PHE A 57 24.429 30.783 106.633 1.00 9.65 H new ATOM 0 HB3 PHE A 57 23.637 29.467 106.901 1.00 9.65 H new ATOM 0 HD1 PHE A 57 24.863 31.664 108.761 1.00 9.45 H new ATOM 0 HD2 PHE A 57 25.652 27.787 108.142 1.00 9.97 H new ATOM 0 HE1 PHE A 57 25.776 31.515 110.887 1.00 9.82 H new ATOM 0 HE2 PHE A 57 26.584 27.638 110.269 1.00 9.64 H new ATOM 0 HZ PHE A 57 26.642 29.498 111.642 1.00 9.53 H new ATOM 408 N VAL A 58 23.667 27.959 104.489 1.00 10.07 N ATOM 409 CA VAL A 58 22.793 27.657 103.365 1.00 9.43 C ATOM 410 C VAL A 58 21.379 27.446 103.872 1.00 9.79 C ATOM 411 O VAL A 58 21.186 26.897 104.956 1.00 10.12 O ATOM 412 CB VAL A 58 23.241 26.342 102.671 1.00 10.02 C ATOM 413 CG1 VAL A 58 22.295 25.997 101.514 1.00 10.03 C ATOM 414 CG2 VAL A 58 24.694 26.462 102.187 1.00 10.41 C ATOM 0 H VAL A 58 23.622 27.386 105.129 1.00 10.07 H new ATOM 0 HA VAL A 58 22.834 28.396 102.738 1.00 9.43 H new ATOM 0 HB VAL A 58 23.199 25.618 103.315 1.00 10.02 H new ATOM 0 HG11 VAL A 58 22.587 25.175 101.091 1.00 10.03 H new ATOM 0 HG12 VAL A 58 21.394 25.882 101.855 1.00 10.03 H new ATOM 0 HG13 VAL A 58 22.304 26.716 100.863 1.00 10.03 H new ATOM 0 HG21 VAL A 58 24.961 25.635 101.756 1.00 10.41 H new ATOM 0 HG22 VAL A 58 24.765 27.194 101.554 1.00 10.41 H new ATOM 0 HG23 VAL A 58 25.275 26.633 102.945 1.00 10.41 H new ATOM 415 N GLU A 59 20.395 27.916 103.109 1.00 9.25 N ATOM 416 CA GLU A 59 18.985 27.667 103.451 1.00 8.77 C ATOM 417 C GLU A 59 18.487 26.761 102.313 1.00 9.35 C ATOM 418 O GLU A 59 18.115 27.242 101.236 1.00 9.97 O ATOM 419 CB GLU A 59 18.169 28.967 103.479 1.00 9.20 C ATOM 420 CG GLU A 59 16.658 28.706 103.583 1.00 9.16 C ATOM 421 CD GLU A 59 16.334 27.746 104.717 1.00 10.38 C ATOM 422 OE1 GLU A 59 16.087 28.230 105.835 1.00 12.11 O ATOM 423 OE2 GLU A 59 16.350 26.521 104.477 1.00 11.11 O ATOM 0 H GLU A 59 20.515 28.378 102.394 1.00 9.25 H new ATOM 0 HA GLU A 59 18.890 27.273 104.332 1.00 8.77 H new ATOM 0 HB2 GLU A 59 18.454 29.509 104.231 1.00 9.20 H new ATOM 0 HB3 GLU A 59 18.352 29.479 102.675 1.00 9.20 H new ATOM 0 HG2 GLU A 59 16.193 29.545 103.725 1.00 9.16 H new ATOM 0 HG3 GLU A 59 16.333 28.340 102.745 1.00 9.16 H new ATOM 424 N PRO A 60 18.475 25.434 102.523 1.00 8.87 N ATOM 425 CA PRO A 60 18.037 24.493 101.487 1.00 8.95 C ATOM 426 C PRO A 60 16.537 24.396 101.260 1.00 8.17 C ATOM 427 O PRO A 60 16.123 23.783 100.278 1.00 9.69 O ATOM 428 CB PRO A 60 18.615 23.161 101.968 1.00 9.70 C ATOM 429 CG PRO A 60 18.479 23.278 103.467 1.00 10.21 C ATOM 430 CD PRO A 60 18.903 24.725 103.751 1.00 8.02 C ATOM 0 HA PRO A 60 18.347 24.786 100.616 1.00 8.95 H new ATOM 0 HB2 PRO A 60 18.121 22.404 101.617 1.00 9.70 H new ATOM 0 HB3 PRO A 60 19.539 23.047 101.696 1.00 9.70 H new ATOM 0 HG2 PRO A 60 17.569 23.108 103.758 1.00 10.21 H new ATOM 0 HG3 PRO A 60 19.048 22.642 103.928 1.00 10.21 H new ATOM 0 HD2 PRO A 60 18.468 25.080 104.542 1.00 8.02 H new ATOM 0 HD3 PRO A 60 19.859 24.799 103.896 1.00 8.02 H new ATOM 431 N HIS A 61 15.738 24.991 102.145 1.00 8.31 N ATOM 432 CA HIS A 61 14.288 24.888 102.001 1.00 8.53 C ATOM 433 C HIS A 61 13.534 26.014 102.685 1.00 9.49 C ATOM 434 O HIS A 61 13.418 26.040 103.908 1.00 10.16 O ATOM 435 CB HIS A 61 13.840 23.532 102.590 1.00 8.83 C ATOM 436 CG HIS A 61 12.404 23.191 102.345 1.00 9.23 C ATOM 437 ND1 HIS A 61 12.017 21.968 101.838 1.00 10.50 N ATOM 438 CD2 HIS A 61 11.264 23.887 102.570 1.00 10.55 C ATOM 439 CE1 HIS A 61 10.695 21.928 101.760 1.00 10.70 C ATOM 440 NE2 HIS A 61 10.215 23.079 102.198 1.00 10.18 N ATOM 0 H HIS A 61 16.008 25.449 102.821 1.00 8.31 H new ATOM 0 HA HIS A 61 14.079 24.955 101.056 1.00 8.53 H new ATOM 0 HB2 HIS A 61 14.395 22.831 102.215 1.00 8.83 H new ATOM 0 HB3 HIS A 61 14.000 23.540 103.547 1.00 8.83 H new ATOM 0 HD1 HIS A 61 12.549 21.332 101.609 1.00 10.50 H new ATOM 0 HD2 HIS A 61 11.202 24.750 102.912 1.00 10.55 H new ATOM 0 HE1 HIS A 61 10.190 21.211 101.450 1.00 10.70 H new ATOM 441 N ILE A 62 13.018 26.956 101.899 1.00 9.10 N ATOM 442 CA ILE A 62 12.213 28.038 102.455 1.00 9.79 C ATOM 443 C ILE A 62 11.141 28.396 101.434 1.00 9.65 C ATOM 444 O ILE A 62 11.268 28.042 100.265 1.00 10.94 O ATOM 445 CB ILE A 62 13.086 29.279 102.826 1.00 9.44 C ATOM 446 CG1 ILE A 62 12.280 30.263 103.688 1.00 12.03 C ATOM 447 CG2 ILE A 62 13.619 29.958 101.566 1.00 10.58 C ATOM 448 CD1 ILE A 62 11.351 31.174 102.952 1.00 21.09 C ATOM 0 H ILE A 62 13.122 26.986 101.046 1.00 9.10 H new ATOM 0 HA ILE A 62 11.799 27.746 103.282 1.00 9.79 H new ATOM 0 HB ILE A 62 13.847 28.978 103.346 1.00 9.44 H new ATOM 0 HG12 ILE A 62 11.762 29.753 104.330 1.00 12.03 H new ATOM 0 HG13 ILE A 62 12.903 30.807 104.194 1.00 12.03 H new ATOM 0 HG21 ILE A 62 14.158 30.725 101.815 1.00 10.58 H new ATOM 0 HG22 ILE A 62 14.163 29.330 101.065 1.00 10.58 H new ATOM 0 HG23 ILE A 62 12.875 30.251 101.017 1.00 10.58 H new ATOM 0 HD11 ILE A 62 10.894 31.750 103.584 1.00 21.09 H new ATOM 0 HD12 ILE A 62 11.857 31.717 102.328 1.00 21.09 H new ATOM 0 HD13 ILE A 62 10.698 30.647 102.466 1.00 21.09 H new ATOM 449 N HIS A 63 10.069 29.020 101.903 1.00 9.35 N ATOM 450 CA HIS A 63 8.994 29.464 101.018 1.00 10.15 C ATOM 451 C HIS A 63 8.956 30.993 101.060 1.00 9.90 C ATOM 452 O HIS A 63 8.302 31.599 101.914 1.00 11.95 O ATOM 453 CB HIS A 63 7.658 28.874 101.483 1.00 12.36 C ATOM 454 CG HIS A 63 7.588 27.381 101.374 1.00 11.97 C ATOM 455 ND1 HIS A 63 6.915 26.736 100.357 1.00 12.49 N ATOM 456 CD2 HIS A 63 8.125 26.405 102.144 1.00 12.26 C ATOM 457 CE1 HIS A 63 7.039 25.430 100.506 1.00 13.53 C ATOM 458 NE2 HIS A 63 7.770 25.201 101.584 1.00 11.39 N ATOM 0 H HIS A 63 9.942 29.198 102.735 1.00 9.35 H new ATOM 0 HA HIS A 63 9.150 29.163 100.109 1.00 10.15 H new ATOM 0 HB2 HIS A 63 7.504 29.130 102.406 1.00 12.36 H new ATOM 0 HB3 HIS A 63 6.941 29.263 100.957 1.00 12.36 H new ATOM 0 HD1 HIS A 63 6.482 27.125 99.724 1.00 12.49 H new ATOM 0 HD2 HIS A 63 8.639 26.527 102.910 1.00 12.26 H new ATOM 0 HE1 HIS A 63 6.674 24.782 99.948 1.00 13.53 H new ATOM 459 N LEU A 64 9.688 31.617 100.138 1.00 10.70 N ATOM 460 CA LEU A 64 9.729 33.074 100.078 1.00 11.04 C ATOM 461 C LEU A 64 8.464 33.686 99.484 1.00 12.53 C ATOM 462 O LEU A 64 8.250 34.893 99.626 1.00 13.13 O ATOM 463 CB LEU A 64 10.948 33.554 99.283 1.00 10.86 C ATOM 464 CG LEU A 64 12.325 33.250 99.899 1.00 11.02 C ATOM 465 CD1 LEU A 64 13.399 33.753 98.938 1.00 12.64 C ATOM 466 CD2 LEU A 64 12.497 33.916 101.269 1.00 12.11 C ATOM 0 H LEU A 64 10.164 31.218 99.543 1.00 10.70 H new ATOM 0 HA LEU A 64 9.795 33.376 100.998 1.00 11.04 H new ATOM 0 HB2 LEU A 64 10.914 33.153 98.401 1.00 10.86 H new ATOM 0 HB3 LEU A 64 10.874 34.513 99.161 1.00 10.86 H new ATOM 0 HG LEU A 64 12.404 32.293 100.035 1.00 11.02 H new ATOM 0 HD11 LEU A 64 14.277 33.570 99.309 1.00 12.64 H new ATOM 0 HD12 LEU A 64 13.308 33.300 98.085 1.00 12.64 H new ATOM 0 HD13 LEU A 64 13.296 34.709 98.808 1.00 12.64 H new ATOM 0 HD21 LEU A 64 13.374 33.703 101.625 1.00 12.11 H new ATOM 0 HD22 LEU A 64 12.412 34.878 101.174 1.00 12.11 H new ATOM 0 HD23 LEU A 64 11.814 33.590 101.876 1.00 12.11 H new ATOM 467 N ASP A 65 7.625 32.885 98.825 1.00 13.29 N ATOM 468 CA ASP A 65 6.398 33.465 98.280 1.00 13.33 C ATOM 469 C ASP A 65 5.326 33.598 99.351 1.00 13.68 C ATOM 470 O ASP A 65 4.417 34.421 99.230 1.00 13.22 O ATOM 471 CB ASP A 65 5.868 32.690 97.047 1.00 14.31 C ATOM 472 CG ASP A 65 5.556 31.224 97.320 1.00 16.09 C ATOM 473 OD1 ASP A 65 4.726 30.666 96.561 1.00 15.28 O ATOM 474 OD2 ASP A 65 6.141 30.626 98.246 1.00 15.83 O ATOM 0 H ASP A 65 7.738 32.044 98.687 1.00 13.29 H new ATOM 0 HA ASP A 65 6.627 34.355 97.971 1.00 13.33 H new ATOM 0 HB2 ASP A 65 5.065 33.127 96.724 1.00 14.31 H new ATOM 0 HB3 ASP A 65 6.526 32.744 96.336 1.00 14.31 H new ATOM 475 N THR A 66 5.462 32.833 100.432 1.00 14.03 N ATOM 476 CA THR A 66 4.487 32.881 101.514 1.00 14.51 C ATOM 477 C THR A 66 5.013 33.617 102.757 1.00 13.32 C ATOM 478 O THR A 66 4.255 33.942 103.665 1.00 14.53 O ATOM 479 CB THR A 66 4.073 31.448 101.940 1.00 16.05 C ATOM 480 OG1 THR A 66 5.198 30.790 102.532 1.00 16.26 O ATOM 481 CG2 THR A 66 3.628 30.621 100.737 1.00 16.26 C ATOM 0 H THR A 66 6.110 32.282 100.557 1.00 14.03 H new ATOM 0 HA THR A 66 3.725 33.370 101.165 1.00 14.51 H new ATOM 0 HB THR A 66 3.337 31.523 102.568 1.00 16.05 H new ATOM 0 HG1 THR A 66 5.049 30.660 103.348 1.00 16.26 H new ATOM 0 HG21 THR A 66 3.375 29.732 101.031 1.00 16.26 H new ATOM 0 HG22 THR A 66 2.868 31.049 100.313 1.00 16.26 H new ATOM 0 HG23 THR A 66 4.358 30.556 100.101 1.00 16.26 H new ATOM 482 N THR A 67 6.316 33.889 102.798 1.00 12.54 N ATOM 483 CA THR A 67 6.908 34.538 103.961 1.00 13.58 C ATOM 484 C THR A 67 6.284 35.876 104.334 1.00 15.70 C ATOM 485 O THR A 67 5.891 36.659 103.467 1.00 14.79 O ATOM 486 CB THR A 67 8.454 34.694 103.790 1.00 12.42 C ATOM 487 OG1 THR A 67 9.046 35.026 105.052 1.00 11.75 O ATOM 488 CG2 THR A 67 8.799 35.802 102.785 1.00 12.28 C ATOM 0 H THR A 67 6.870 33.706 102.166 1.00 12.54 H new ATOM 0 HA THR A 67 6.715 33.942 104.701 1.00 13.58 H new ATOM 0 HB THR A 67 8.801 33.851 103.459 1.00 12.42 H new ATOM 0 HG1 THR A 67 8.597 34.680 105.672 1.00 11.75 H new ATOM 0 HG21 THR A 67 9.763 35.874 102.701 1.00 12.28 H new ATOM 0 HG22 THR A 67 8.415 35.586 101.921 1.00 12.28 H new ATOM 0 HG23 THR A 67 8.438 36.646 103.097 1.00 12.28 H new ATOM 489 N GLN A 68 6.171 36.103 105.638 1.00 17.64 N ATOM 490 CA GLN A 68 5.611 37.323 106.211 1.00 19.11 C ATOM 491 C GLN A 68 4.080 37.451 106.048 1.00 18.44 C ATOM 492 O GLN A 68 3.534 38.537 106.239 1.00 23.34 O ATOM 493 CB GLN A 68 6.325 38.555 105.614 1.00 18.98 C ATOM 494 CG GLN A 68 7.867 38.475 105.597 1.00 19.60 C ATOM 495 CD GLN A 68 8.509 38.503 106.984 1.00 20.81 C ATOM 496 OE1 GLN A 68 7.703 38.754 108.007 1.00 22.16 O flip ATOM 497 NE2 GLN A 68 9.724 38.307 107.124 1.00 19.97 N flip ATOM 0 H GLN A 68 6.425 35.535 106.232 1.00 17.64 H new ATOM 0 HA GLN A 68 5.768 37.274 107.167 1.00 19.11 H new ATOM 0 HB2 GLN A 68 6.012 38.684 104.705 1.00 18.98 H new ATOM 0 HB3 GLN A 68 6.061 39.340 106.119 1.00 18.98 H new ATOM 0 HG2 GLN A 68 8.134 37.660 105.144 1.00 19.60 H new ATOM 0 HG3 GLN A 68 8.214 39.216 105.076 1.00 19.60 H new ATOM 0 HE21 GLN A 68 10.216 38.147 106.437 1.00 19.97 H new ATOM 0 HE22 GLN A 68 10.076 38.331 107.908 1.00 19.97 H new ATOM 498 N THR A 69 3.381 36.361 105.720 1.00 19.21 N ATOM 499 CA THR A 69 1.916 36.421 105.540 1.00 18.89 C ATOM 500 C THR A 69 1.070 35.751 106.629 1.00 19.28 C ATOM 501 O THR A 69 -0.143 35.612 106.463 1.00 19.96 O ATOM 502 CB THR A 69 1.440 35.793 104.204 1.00 19.93 C ATOM 503 OG1 THR A 69 1.648 34.372 104.229 1.00 19.76 O ATOM 504 CG2 THR A 69 2.166 36.422 103.029 1.00 19.14 C ATOM 0 H THR A 69 3.727 35.583 105.597 1.00 19.21 H new ATOM 0 HA THR A 69 1.771 37.380 105.572 1.00 18.89 H new ATOM 0 HB THR A 69 0.492 35.966 104.097 1.00 19.93 H new ATOM 0 HG1 THR A 69 2.452 34.203 104.056 1.00 19.76 H new ATOM 0 HG21 THR A 69 1.856 36.018 102.203 1.00 19.14 H new ATOM 0 HG22 THR A 69 1.986 37.375 103.010 1.00 19.14 H new ATOM 0 HG23 THR A 69 3.120 36.276 103.122 1.00 19.14 H new ATOM 505 N ALA A 70 1.687 35.323 107.725 1.00 19.13 N ATOM 506 CA ALA A 70 0.922 34.671 108.783 1.00 19.77 C ATOM 507 C ALA A 70 -0.262 35.526 109.237 1.00 21.23 C ATOM 508 O ALA A 70 -0.112 36.724 109.506 1.00 22.05 O ATOM 509 CB ALA A 70 1.831 34.351 109.967 1.00 20.04 C ATOM 0 H ALA A 70 2.531 35.398 107.875 1.00 19.13 H new ATOM 0 HA ALA A 70 0.564 33.845 108.423 1.00 19.77 H new ATOM 0 HB1 ALA A 70 1.314 33.918 110.664 1.00 20.04 H new ATOM 0 HB2 ALA A 70 2.543 33.759 109.678 1.00 20.04 H new ATOM 0 HB3 ALA A 70 2.215 35.172 110.312 1.00 20.04 H new ATOM 510 N GLY A 71 -1.435 34.899 109.310 1.00 20.04 N ATOM 511 CA GLY A 71 -2.634 35.588 109.737 1.00 21.01 C ATOM 512 C GLY A 71 -3.403 36.302 108.636 1.00 21.71 C ATOM 513 O GLY A 71 -4.437 36.910 108.915 1.00 22.92 O ATOM 0 H GLY A 71 -1.551 34.070 109.114 1.00 20.04 H new ATOM 0 HA2 GLY A 71 -3.225 34.945 110.159 1.00 21.01 H new ATOM 0 HA3 GLY A 71 -2.391 36.238 110.415 1.00 21.01 H new ATOM 514 N GLN A 72 -2.921 36.233 107.396 1.00 22.92 N ATOM 515 CA GLN A 72 -3.595 36.908 106.279 1.00 23.57 C ATOM 516 C GLN A 72 -4.210 35.942 105.257 1.00 23.99 C ATOM 517 O GLN A 72 -3.490 35.205 104.581 1.00 22.93 O ATOM 518 CB GLN A 72 -2.609 37.809 105.528 1.00 24.50 C ATOM 519 CG GLN A 72 -1.696 38.649 106.397 1.00 26.08 C ATOM 520 CD GLN A 72 -0.746 39.499 105.568 1.00 28.11 C ATOM 521 OE1 GLN A 72 -0.339 39.111 104.466 1.00 27.20 O ATOM 522 NE2 GLN A 72 -0.381 40.661 106.097 1.00 29.55 N ATOM 0 H GLN A 72 -2.209 35.803 107.178 1.00 22.92 H new ATOM 0 HA GLN A 72 -4.313 37.420 106.683 1.00 23.57 H new ATOM 0 HB2 GLN A 72 -2.060 37.252 104.954 1.00 24.50 H new ATOM 0 HB3 GLN A 72 -3.114 38.402 104.950 1.00 24.50 H new ATOM 0 HG2 GLN A 72 -2.231 39.224 106.966 1.00 26.08 H new ATOM 0 HG3 GLN A 72 -1.184 38.069 106.982 1.00 26.08 H new ATOM 0 HE21 GLN A 72 -0.685 40.898 106.866 1.00 29.55 H new ATOM 0 HE22 GLN A 72 0.159 41.177 105.671 1.00 29.55 H new ATOM 523 N PRO A 73 -5.550 35.923 105.132 1.00 24.15 N ATOM 524 CA PRO A 73 -6.538 36.722 105.866 1.00 23.64 C ATOM 525 C PRO A 73 -6.952 36.042 107.174 1.00 23.48 C ATOM 526 O PRO A 73 -7.656 36.633 107.996 1.00 23.97 O ATOM 527 CB PRO A 73 -7.698 36.828 104.877 1.00 23.07 C ATOM 528 CG PRO A 73 -7.630 35.505 104.157 1.00 23.77 C ATOM 529 CD PRO A 73 -6.149 35.351 103.908 1.00 23.99 C ATOM 0 HA PRO A 73 -6.202 37.589 106.143 1.00 23.64 H new ATOM 0 HB2 PRO A 73 -8.548 36.951 105.328 1.00 23.07 H new ATOM 0 HB3 PRO A 73 -7.588 37.576 104.270 1.00 23.07 H new ATOM 0 HG2 PRO A 73 -7.984 34.781 104.697 1.00 23.77 H new ATOM 0 HG3 PRO A 73 -8.137 35.516 103.330 1.00 23.77 H new ATOM 0 HD2 PRO A 73 -5.899 34.422 103.785 1.00 23.99 H new ATOM 0 HD3 PRO A 73 -5.866 35.828 103.112 1.00 23.99 H new ATOM 530 N ASN A 74 -6.505 34.801 107.365 1.00 22.57 N ATOM 531 CA ASN A 74 -6.838 34.047 108.571 1.00 22.26 C ATOM 532 C ASN A 74 -5.639 33.264 109.103 1.00 21.84 C ATOM 533 O ASN A 74 -4.676 33.022 108.377 1.00 21.10 O ATOM 534 CB ASN A 74 -7.981 33.071 108.281 1.00 23.01 C ATOM 535 CG ASN A 74 -9.233 33.767 107.777 1.00 24.66 C ATOM 536 OD1 ASN A 74 -9.823 34.598 108.473 1.00 26.23 O ATOM 537 ND2 ASN A 74 -9.645 33.431 106.561 1.00 25.17 N ATOM 0 H ASN A 74 -6.007 34.378 106.806 1.00 22.57 H new ATOM 0 HA ASN A 74 -7.108 34.689 109.246 1.00 22.26 H new ATOM 0 HB2 ASN A 74 -7.688 32.423 107.621 1.00 23.01 H new ATOM 0 HB3 ASN A 74 -8.193 32.578 109.089 1.00 23.01 H new ATOM 0 HD21 ASN A 74 -10.349 33.797 106.229 1.00 25.17 H new ATOM 0 HD22 ASN A 74 -9.208 32.847 106.105 1.00 25.17 H new ATOM 538 N TRP A 75 -5.706 32.885 110.376 1.00 21.09 N ATOM 539 CA TRP A 75 -4.650 32.104 111.019 1.00 21.30 C ATOM 540 C TRP A 75 -4.909 30.603 110.907 1.00 21.10 C ATOM 541 O TRP A 75 -6.060 30.150 110.872 1.00 21.01 O ATOM 542 CB TRP A 75 -4.532 32.442 112.515 1.00 22.05 C ATOM 543 CG TRP A 75 -3.913 33.769 112.823 1.00 22.10 C ATOM 544 CD1 TRP A 75 -4.558 34.968 112.956 1.00 23.09 C ATOM 545 CD2 TRP A 75 -2.520 34.040 112.988 1.00 21.39 C ATOM 546 NE1 TRP A 75 -3.646 35.972 113.190 1.00 21.31 N ATOM 547 CE2 TRP A 75 -2.388 35.429 113.215 1.00 23.22 C ATOM 548 CE3 TRP A 75 -1.365 33.244 112.966 1.00 23.26 C ATOM 549 CZ2 TRP A 75 -1.147 36.042 113.418 1.00 22.96 C ATOM 550 CZ3 TRP A 75 -0.130 33.855 113.168 1.00 23.33 C ATOM 551 CH2 TRP A 75 -0.033 35.241 113.391 1.00 23.73 C ATOM 0 H TRP A 75 -6.366 33.073 110.894 1.00 21.09 H new ATOM 0 HA TRP A 75 -3.829 32.335 110.556 1.00 21.30 H new ATOM 0 HB2 TRP A 75 -5.418 32.416 112.908 1.00 22.05 H new ATOM 0 HB3 TRP A 75 -4.009 31.749 112.948 1.00 22.05 H new ATOM 0 HD1 TRP A 75 -5.478 35.087 112.897 1.00 23.09 H new ATOM 0 HE1 TRP A 75 -3.835 36.804 113.302 1.00 21.31 H new ATOM 0 HE3 TRP A 75 -1.423 32.327 112.820 1.00 23.26 H new ATOM 0 HZ2 TRP A 75 -1.079 36.958 113.566 1.00 22.96 H new ATOM 0 HZ3 TRP A 75 0.643 33.339 113.155 1.00 23.33 H new ATOM 0 HH2 TRP A 75 0.805 35.623 113.523 1.00 23.73 H new ATOM 552 N ASN A 76 -3.823 29.838 110.854 1.00 20.69 N ATOM 553 CA ASN A 76 -3.885 28.380 110.802 1.00 20.70 C ATOM 554 C ASN A 76 -4.132 27.982 112.263 1.00 21.69 C ATOM 555 O ASN A 76 -3.191 27.886 113.052 1.00 22.54 O ATOM 556 CB ASN A 76 -2.538 27.831 110.312 1.00 19.05 C ATOM 557 CG ASN A 76 -2.468 26.321 110.355 1.00 20.19 C ATOM 558 OD1 ASN A 76 -3.343 25.664 110.910 1.00 18.93 O ATOM 559 ND2 ASN A 76 -1.407 25.762 109.781 1.00 19.18 N ATOM 0 H ASN A 76 -3.023 30.153 110.847 1.00 20.69 H new ATOM 0 HA ASN A 76 -4.566 28.038 110.202 1.00 20.70 H new ATOM 0 HB2 ASN A 76 -2.383 28.132 109.403 1.00 19.05 H new ATOM 0 HB3 ASN A 76 -1.826 28.199 110.858 1.00 19.05 H new ATOM 0 HD21 ASN A 76 -1.314 24.907 109.790 1.00 19.18 H new ATOM 0 HD22 ASN A 76 -0.814 26.255 109.401 1.00 19.18 H new ATOM 560 N GLN A 77 -5.395 27.757 112.618 1.00 21.68 N ATOM 561 CA GLN A 77 -5.760 27.424 113.993 1.00 23.20 C ATOM 562 C GLN A 77 -5.307 26.065 114.491 1.00 22.10 C ATOM 563 O GLN A 77 -4.866 25.930 115.639 1.00 23.97 O ATOM 564 CB GLN A 77 -7.276 27.522 114.173 1.00 25.11 C ATOM 565 CG GLN A 77 -7.861 28.873 113.823 1.00 29.00 C ATOM 566 CD GLN A 77 -7.121 30.007 114.491 1.00 29.37 C ATOM 567 OE1 GLN A 77 -6.820 31.052 113.725 1.00 33.36 O flip ATOM 568 NE2 GLN A 77 -6.827 29.951 115.683 1.00 30.35 N flip ATOM 0 H GLN A 77 -6.060 27.793 112.073 1.00 21.68 H new ATOM 0 HA GLN A 77 -5.282 28.077 114.528 1.00 23.20 H new ATOM 0 HB2 GLN A 77 -7.700 26.846 113.622 1.00 25.11 H new ATOM 0 HB3 GLN A 77 -7.495 27.316 115.095 1.00 25.11 H new ATOM 0 HG2 GLN A 77 -7.836 28.995 112.861 1.00 29.00 H new ATOM 0 HG3 GLN A 77 -8.794 28.898 114.088 1.00 29.00 H new ATOM 0 HE21 GLN A 77 -7.039 29.258 116.146 1.00 30.35 H new ATOM 0 HE22 GLN A 77 -6.410 30.605 116.054 1.00 30.35 H new ATOM 569 N SER A 78 -5.411 25.053 113.638 1.00 19.99 N ATOM 570 CA SER A 78 -5.044 23.702 114.046 1.00 20.07 C ATOM 571 C SER A 78 -3.549 23.440 114.078 1.00 19.61 C ATOM 572 O SER A 78 -3.103 22.459 114.677 1.00 19.45 O ATOM 573 CB SER A 78 -5.712 22.676 113.127 1.00 18.80 C ATOM 574 OG SER A 78 -5.231 22.793 111.799 1.00 18.96 O ATOM 0 H SER A 78 -5.689 25.125 112.827 1.00 19.99 H new ATOM 0 HA SER A 78 -5.359 23.613 114.959 1.00 20.07 H new ATOM 0 HB2 SER A 78 -5.541 21.781 113.459 1.00 18.80 H new ATOM 0 HB3 SER A 78 -6.673 22.804 113.139 1.00 18.80 H new ATOM 0 HG SER A 78 -5.614 23.436 111.418 1.00 18.96 H new ATOM 575 N GLY A 79 -2.777 24.311 113.435 1.00 17.27 N ATOM 576 CA GLY A 79 -1.342 24.117 113.398 1.00 17.17 C ATOM 577 C GLY A 79 -0.959 22.880 112.605 1.00 16.84 C ATOM 578 O GLY A 79 0.013 22.200 112.939 1.00 16.12 O ATOM 0 H GLY A 79 -3.063 25.009 113.021 1.00 17.27 H new ATOM 0 HA2 GLY A 79 -0.920 24.897 113.004 1.00 17.17 H new ATOM 0 HA3 GLY A 79 -1.003 24.038 114.303 1.00 17.17 H new ATOM 579 N THR A 80 -1.715 22.587 111.551 1.00 16.88 N ATOM 580 CA THR A 80 -1.435 21.422 110.716 1.00 16.06 C ATOM 581 C THR A 80 -1.045 21.824 109.298 1.00 16.34 C ATOM 582 O THR A 80 -1.335 22.936 108.851 1.00 16.65 O ATOM 583 CB THR A 80 -2.658 20.480 110.601 1.00 17.00 C ATOM 584 OG1 THR A 80 -3.716 21.158 109.913 1.00 18.78 O ATOM 585 CG2 THR A 80 -3.157 20.059 111.975 1.00 16.83 C ATOM 0 H THR A 80 -2.395 23.050 111.302 1.00 16.88 H new ATOM 0 HA THR A 80 -0.701 20.964 111.154 1.00 16.06 H new ATOM 0 HB THR A 80 -2.386 19.688 110.112 1.00 17.00 H new ATOM 0 HG1 THR A 80 -4.159 21.616 110.461 1.00 18.78 H new ATOM 0 HG21 THR A 80 -3.922 19.471 111.875 1.00 16.83 H new ATOM 0 HG22 THR A 80 -2.450 19.592 112.447 1.00 16.83 H new ATOM 0 HG23 THR A 80 -3.418 20.845 112.480 1.00 16.83 H new ATOM 586 N LEU A 81 -0.384 20.904 108.598 1.00 15.74 N ATOM 587 CA LEU A 81 0.025 21.121 107.214 1.00 16.32 C ATOM 588 C LEU A 81 -1.205 21.375 106.350 1.00 17.30 C ATOM 589 O LEU A 81 -1.229 22.297 105.529 1.00 16.08 O ATOM 590 CB LEU A 81 0.755 19.880 106.684 1.00 16.28 C ATOM 591 CG LEU A 81 0.969 19.830 105.166 1.00 15.47 C ATOM 592 CD1 LEU A 81 2.012 20.868 104.762 1.00 17.77 C ATOM 593 CD2 LEU A 81 1.428 18.448 104.745 1.00 15.32 C ATOM 0 H LEU A 81 -0.160 20.136 108.914 1.00 15.74 H new ATOM 0 HA LEU A 81 0.618 21.888 107.179 1.00 16.32 H new ATOM 0 HB2 LEU A 81 1.621 19.825 107.118 1.00 16.28 H new ATOM 0 HB3 LEU A 81 0.254 19.093 106.949 1.00 16.28 H new ATOM 0 HG LEU A 81 0.129 20.027 104.722 1.00 15.47 H new ATOM 0 HD11 LEU A 81 2.146 20.835 103.802 1.00 17.77 H new ATOM 0 HD12 LEU A 81 1.704 21.752 105.015 1.00 17.77 H new ATOM 0 HD13 LEU A 81 2.850 20.677 105.212 1.00 17.77 H new ATOM 0 HD21 LEU A 81 1.560 18.429 103.784 1.00 15.32 H new ATOM 0 HD22 LEU A 81 2.263 18.235 105.190 1.00 15.32 H new ATOM 0 HD23 LEU A 81 0.755 17.794 104.991 1.00 15.32 H new ATOM 594 N PHE A 82 -2.237 20.565 106.561 1.00 16.31 N ATOM 595 CA PHE A 82 -3.459 20.645 105.776 1.00 16.41 C ATOM 596 C PHE A 82 -4.193 21.964 105.925 1.00 16.86 C ATOM 597 O PHE A 82 -4.610 22.556 104.926 1.00 16.82 O ATOM 598 CB PHE A 82 -4.342 19.455 106.141 1.00 17.35 C ATOM 599 CG PHE A 82 -3.605 18.148 106.101 1.00 19.21 C ATOM 600 CD1 PHE A 82 -3.302 17.462 107.279 1.00 19.57 C ATOM 601 CD2 PHE A 82 -3.144 17.636 104.889 1.00 18.71 C ATOM 602 CE1 PHE A 82 -2.549 16.289 107.244 1.00 20.26 C ATOM 603 CE2 PHE A 82 -2.389 16.467 104.842 1.00 20.18 C ATOM 604 CZ PHE A 82 -2.091 15.793 106.022 1.00 20.03 C ATOM 0 H PHE A 82 -2.247 19.953 107.165 1.00 16.31 H new ATOM 0 HA PHE A 82 -3.221 20.608 104.836 1.00 16.41 H new ATOM 0 HB2 PHE A 82 -4.706 19.589 107.030 1.00 17.35 H new ATOM 0 HB3 PHE A 82 -5.094 19.416 105.529 1.00 17.35 H new ATOM 0 HD1 PHE A 82 -3.605 17.791 108.094 1.00 19.57 H new ATOM 0 HD2 PHE A 82 -3.344 18.083 104.098 1.00 18.71 H new ATOM 0 HE1 PHE A 82 -2.352 15.838 108.033 1.00 20.26 H new ATOM 0 HE2 PHE A 82 -2.086 16.139 104.026 1.00 20.18 H new ATOM 0 HZ PHE A 82 -1.587 15.012 105.997 1.00 20.03 H new ATOM 605 N GLU A 83 -4.346 22.451 107.152 1.00 16.59 N ATOM 606 CA GLU A 83 -5.021 23.732 107.302 1.00 16.83 C ATOM 607 C GLU A 83 -4.105 24.816 106.738 1.00 17.40 C ATOM 608 O GLU A 83 -4.576 25.800 106.178 1.00 18.06 O ATOM 609 CB GLU A 83 -5.360 24.059 108.763 1.00 16.87 C ATOM 610 CG GLU A 83 -6.206 25.331 108.833 1.00 16.73 C ATOM 611 CD GLU A 83 -6.606 25.736 110.229 1.00 18.71 C ATOM 612 OE1 GLU A 83 -6.692 24.854 111.116 1.00 19.09 O ATOM 613 OE2 GLU A 83 -6.855 26.944 110.427 1.00 21.03 O ATOM 0 H GLU A 83 -4.080 22.076 107.879 1.00 16.59 H new ATOM 0 HA GLU A 83 -5.863 23.689 106.823 1.00 16.83 H new ATOM 0 HB2 GLU A 83 -5.842 23.319 109.164 1.00 16.87 H new ATOM 0 HB3 GLU A 83 -4.544 24.176 109.274 1.00 16.87 H new ATOM 0 HG2 GLU A 83 -5.710 26.059 108.426 1.00 16.73 H new ATOM 0 HG3 GLU A 83 -7.008 25.203 108.303 1.00 16.73 H new ATOM 614 N GLY A 84 -2.794 24.626 106.883 1.00 17.01 N ATOM 615 CA GLY A 84 -1.845 25.598 106.359 1.00 17.05 C ATOM 616 C GLY A 84 -2.029 25.811 104.863 1.00 16.95 C ATOM 617 O GLY A 84 -2.020 26.947 104.373 1.00 16.52 O ATOM 0 H GLY A 84 -2.440 23.949 107.277 1.00 17.01 H new ATOM 0 HA2 GLY A 84 -1.956 26.443 106.823 1.00 17.05 H new ATOM 0 HA3 GLY A 84 -0.940 25.295 106.535 1.00 17.05 H new ATOM 618 N ILE A 85 -2.202 24.721 104.123 1.00 16.90 N ATOM 619 CA ILE A 85 -2.401 24.829 102.679 1.00 17.78 C ATOM 620 C ILE A 85 -3.714 25.562 102.376 1.00 19.02 C ATOM 621 O ILE A 85 -3.787 26.347 101.427 1.00 17.97 O ATOM 622 CB ILE A 85 -2.389 23.427 102.012 1.00 18.44 C ATOM 623 CG1 ILE A 85 -0.952 22.906 101.918 1.00 19.39 C ATOM 624 CG2 ILE A 85 -2.923 23.508 100.582 1.00 18.73 C ATOM 625 CD1 ILE A 85 -0.219 22.809 103.209 1.00 25.10 C ATOM 0 H ILE A 85 -2.208 23.918 104.431 1.00 16.90 H new ATOM 0 HA ILE A 85 -1.667 25.343 102.307 1.00 17.78 H new ATOM 0 HB ILE A 85 -2.942 22.841 102.552 1.00 18.44 H new ATOM 0 HG12 ILE A 85 -0.970 22.027 101.507 1.00 19.39 H new ATOM 0 HG13 ILE A 85 -0.452 23.487 101.323 1.00 19.39 H new ATOM 0 HG21 ILE A 85 -2.909 22.625 100.181 1.00 18.73 H new ATOM 0 HG22 ILE A 85 -3.834 23.842 100.595 1.00 18.73 H new ATOM 0 HG23 ILE A 85 -2.366 24.108 100.062 1.00 18.73 H new ATOM 0 HD11 ILE A 85 0.676 22.472 103.049 1.00 25.10 H new ATOM 0 HD12 ILE A 85 -0.165 23.687 103.617 1.00 25.10 H new ATOM 0 HD13 ILE A 85 -0.690 22.205 103.804 1.00 25.10 H new ATOM 626 N GLU A 86 -4.744 25.317 103.184 1.00 18.46 N ATOM 627 CA GLU A 86 -6.033 25.986 102.994 1.00 19.91 C ATOM 628 C GLU A 86 -5.910 27.490 103.256 1.00 19.11 C ATOM 629 O GLU A 86 -6.442 28.309 102.494 1.00 18.31 O ATOM 630 CB GLU A 86 -7.092 25.382 103.923 1.00 22.62 C ATOM 631 CG GLU A 86 -8.492 25.964 103.732 1.00 28.94 C ATOM 632 CD GLU A 86 -8.917 26.001 102.272 1.00 32.87 C ATOM 633 OE1 GLU A 86 -8.711 27.048 101.609 1.00 35.45 O ATOM 634 OE2 GLU A 86 -9.448 24.979 101.783 1.00 35.72 O ATOM 0 H GLU A 86 -4.719 24.769 103.846 1.00 18.46 H new ATOM 0 HA GLU A 86 -6.307 25.853 102.073 1.00 19.91 H new ATOM 0 HB2 GLU A 86 -7.128 24.424 103.777 1.00 22.62 H new ATOM 0 HB3 GLU A 86 -6.818 25.519 104.843 1.00 22.62 H new ATOM 0 HG2 GLU A 86 -9.130 25.436 104.237 1.00 28.94 H new ATOM 0 HG3 GLU A 86 -8.517 26.863 104.095 1.00 28.94 H new ATOM 635 N ARG A 87 -5.212 27.858 104.330 1.00 18.51 N ATOM 636 CA ARG A 87 -5.015 29.264 104.656 1.00 19.28 C ATOM 637 C ARG A 87 -4.168 29.928 103.569 1.00 18.57 C ATOM 638 O ARG A 87 -4.403 31.086 103.207 1.00 19.23 O ATOM 639 CB ARG A 87 -4.322 29.400 106.018 1.00 19.87 C ATOM 640 CG ARG A 87 -5.176 28.969 107.220 1.00 20.62 C ATOM 641 CD ARG A 87 -6.335 29.933 107.468 1.00 23.18 C ATOM 642 NE ARG A 87 -7.496 29.671 106.620 1.00 23.84 N ATOM 643 CZ ARG A 87 -8.369 28.686 106.829 1.00 25.37 C ATOM 644 NH1 ARG A 87 -8.217 27.862 107.861 1.00 25.56 N ATOM 645 NH2 ARG A 87 -9.404 28.524 106.015 1.00 26.79 N ATOM 0 H ARG A 87 -4.846 27.308 104.880 1.00 18.51 H new ATOM 0 HA ARG A 87 -5.879 29.703 104.702 1.00 19.28 H new ATOM 0 HB2 ARG A 87 -3.509 28.870 106.008 1.00 19.87 H new ATOM 0 HB3 ARG A 87 -4.056 30.325 106.141 1.00 19.87 H new ATOM 0 HG2 ARG A 87 -5.525 28.077 107.066 1.00 20.62 H new ATOM 0 HG3 ARG A 87 -4.619 28.923 108.013 1.00 20.62 H new ATOM 0 HD2 ARG A 87 -6.602 29.875 108.399 1.00 23.18 H new ATOM 0 HD3 ARG A 87 -6.030 30.841 107.317 1.00 23.18 H new ATOM 0 HE ARG A 87 -7.624 30.185 105.943 1.00 23.84 H new ATOM 0 HH11 ARG A 87 -7.553 27.963 108.398 1.00 25.56 H new ATOM 0 HH12 ARG A 87 -8.783 27.228 107.992 1.00 25.56 H new ATOM 0 HH21 ARG A 87 -9.514 29.056 105.348 1.00 26.79 H new ATOM 0 HH22 ARG A 87 -9.965 27.887 106.154 1.00 26.79 H new ATOM 646 N TRP A 88 -3.176 29.205 103.050 1.00 17.89 N ATOM 647 CA TRP A 88 -2.338 29.753 101.990 1.00 18.40 C ATOM 648 C TRP A 88 -3.161 29.972 100.721 1.00 18.76 C ATOM 649 O TRP A 88 -2.986 30.981 100.036 1.00 18.90 O ATOM 650 CB TRP A 88 -1.153 28.825 101.694 1.00 17.44 C ATOM 651 CG TRP A 88 -0.435 29.164 100.408 1.00 16.91 C ATOM 652 CD1 TRP A 88 -0.276 28.351 99.328 1.00 17.73 C ATOM 653 CD2 TRP A 88 0.161 30.422 100.053 1.00 17.55 C ATOM 654 NE1 TRP A 88 0.375 29.019 98.316 1.00 16.56 N ATOM 655 CE2 TRP A 88 0.655 30.292 98.733 1.00 17.15 C ATOM 656 CE3 TRP A 88 0.322 31.645 100.717 1.00 18.01 C ATOM 657 CZ2 TRP A 88 1.299 31.341 98.063 1.00 19.23 C ATOM 658 CZ3 TRP A 88 0.963 32.690 100.051 1.00 18.81 C ATOM 659 CH2 TRP A 88 1.444 32.527 98.736 1.00 18.76 C ATOM 0 H TRP A 88 -2.975 28.406 103.295 1.00 17.89 H new ATOM 0 HA TRP A 88 -1.991 30.607 102.292 1.00 18.40 H new ATOM 0 HB2 TRP A 88 -0.523 28.870 102.430 1.00 17.44 H new ATOM 0 HB3 TRP A 88 -1.471 27.910 101.648 1.00 17.44 H new ATOM 0 HD1 TRP A 88 -0.566 27.469 99.281 1.00 17.73 H new ATOM 0 HE1 TRP A 88 0.574 28.690 97.547 1.00 16.56 H new ATOM 0 HE3 TRP A 88 0.008 31.758 101.585 1.00 18.01 H new ATOM 0 HZ2 TRP A 88 1.616 31.237 97.195 1.00 19.23 H new ATOM 0 HZ3 TRP A 88 1.075 33.507 100.481 1.00 18.81 H new ATOM 0 HH2 TRP A 88 1.869 33.239 98.316 1.00 18.76 H new ATOM 660 N ALA A 89 -4.058 29.040 100.400 1.00 17.90 N ATOM 661 CA ALA A 89 -4.888 29.189 99.205 1.00 18.78 C ATOM 662 C ALA A 89 -5.667 30.504 99.256 1.00 18.96 C ATOM 663 O ALA A 89 -5.829 31.179 98.236 1.00 20.76 O ATOM 664 CB ALA A 89 -5.851 28.000 99.078 1.00 18.93 C ATOM 0 H ALA A 89 -4.200 28.323 100.854 1.00 17.90 H new ATOM 0 HA ALA A 89 -4.310 29.206 98.426 1.00 18.78 H new ATOM 0 HB1 ALA A 89 -6.396 28.108 98.283 1.00 18.93 H new ATOM 0 HB2 ALA A 89 -5.342 27.177 99.011 1.00 18.93 H new ATOM 0 HB3 ALA A 89 -6.424 27.962 99.860 1.00 18.93 H new ATOM 665 N GLU A 90 -6.136 30.880 100.443 1.00 19.47 N ATOM 666 CA GLU A 90 -6.884 32.128 100.591 1.00 19.65 C ATOM 667 C GLU A 90 -5.971 33.323 100.321 1.00 19.97 C ATOM 668 O GLU A 90 -6.388 34.297 99.691 1.00 21.81 O ATOM 669 CB GLU A 90 -7.492 32.227 102.000 1.00 20.12 C ATOM 670 CG GLU A 90 -8.386 31.046 102.338 1.00 22.47 C ATOM 671 CD GLU A 90 -8.912 31.062 103.763 1.00 23.84 C ATOM 672 OE1 GLU A 90 -8.172 31.487 104.677 1.00 24.44 O ATOM 673 OE2 GLU A 90 -10.066 30.624 103.972 1.00 26.69 O ATOM 0 H GLU A 90 -6.034 30.432 101.170 1.00 19.47 H new ATOM 0 HA GLU A 90 -7.607 32.135 99.944 1.00 19.65 H new ATOM 0 HB2 GLU A 90 -6.777 32.284 102.653 1.00 20.12 H new ATOM 0 HB3 GLU A 90 -8.006 33.047 102.069 1.00 20.12 H new ATOM 0 HG2 GLU A 90 -9.138 31.035 101.725 1.00 22.47 H new ATOM 0 HG3 GLU A 90 -7.890 30.225 102.194 1.00 22.47 H new ATOM 674 N ARG A 91 -4.725 33.239 100.783 1.00 19.30 N ATOM 675 CA ARG A 91 -3.754 34.314 100.582 1.00 18.37 C ATOM 676 C ARG A 91 -3.250 34.340 99.142 1.00 18.78 C ATOM 677 O ARG A 91 -2.988 35.414 98.587 1.00 19.12 O ATOM 678 CB ARG A 91 -2.564 34.141 101.538 1.00 18.19 C ATOM 679 CG ARG A 91 -1.538 35.280 101.503 1.00 18.99 C ATOM 680 CD ARG A 91 -2.180 36.613 101.895 1.00 18.73 C ATOM 681 NE ARG A 91 -1.216 37.698 102.114 1.00 19.33 N ATOM 682 CZ ARG A 91 -0.559 38.338 101.149 1.00 18.38 C ATOM 683 NH1 ARG A 91 0.287 39.313 101.455 1.00 16.43 N ATOM 684 NH2 ARG A 91 -0.744 37.998 99.883 1.00 19.82 N ATOM 0 H ARG A 91 -4.420 32.563 101.218 1.00 19.30 H new ATOM 0 HA ARG A 91 -4.200 35.155 100.768 1.00 18.37 H new ATOM 0 HB2 ARG A 91 -2.903 34.056 102.443 1.00 18.19 H new ATOM 0 HB3 ARG A 91 -2.112 33.310 101.324 1.00 18.19 H new ATOM 0 HG2 ARG A 91 -0.807 35.079 102.108 1.00 18.99 H new ATOM 0 HG3 ARG A 91 -1.158 35.350 100.613 1.00 18.99 H new ATOM 0 HD2 ARG A 91 -2.801 36.880 101.199 1.00 18.73 H new ATOM 0 HD3 ARG A 91 -2.699 36.486 102.704 1.00 18.73 H new ATOM 0 HE ARG A 91 -1.064 37.938 102.926 1.00 19.33 H new ATOM 0 HH11 ARG A 91 0.411 39.532 102.277 1.00 16.43 H new ATOM 0 HH12 ARG A 91 0.711 39.726 100.831 1.00 16.43 H new ATOM 0 HH21 ARG A 91 -1.289 37.363 99.683 1.00 19.82 H new ATOM 0 HH22 ARG A 91 -0.319 38.412 99.260 1.00 19.82 H new ATOM 685 N LYS A 92 -3.125 33.161 98.535 1.00 19.13 N ATOM 686 CA LYS A 92 -2.638 33.052 97.163 1.00 18.82 C ATOM 687 C LYS A 92 -3.550 33.800 96.189 1.00 19.49 C ATOM 688 O LYS A 92 -3.086 34.380 95.202 1.00 19.07 O ATOM 689 CB LYS A 92 -2.505 31.571 96.768 1.00 17.76 C ATOM 690 CG LYS A 92 -2.079 31.345 95.316 1.00 19.25 C ATOM 691 CD LYS A 92 -1.561 29.924 95.065 1.00 18.23 C ATOM 692 CE LYS A 92 -2.557 28.849 95.493 1.00 17.88 C ATOM 693 NZ LYS A 92 -2.114 27.478 95.103 1.00 16.08 N ATOM 0 H LYS A 92 -3.318 32.409 98.904 1.00 19.13 H new ATOM 0 HA LYS A 92 -1.762 33.466 97.115 1.00 18.82 H new ATOM 0 HB2 LYS A 92 -1.858 31.147 97.354 1.00 17.76 H new ATOM 0 HB3 LYS A 92 -3.356 31.129 96.917 1.00 17.76 H new ATOM 0 HG2 LYS A 92 -2.833 31.518 94.731 1.00 19.25 H new ATOM 0 HG3 LYS A 92 -1.387 31.983 95.083 1.00 19.25 H new ATOM 0 HD2 LYS A 92 -1.362 29.818 94.121 1.00 18.23 H new ATOM 0 HD3 LYS A 92 -0.728 29.798 95.546 1.00 18.23 H new ATOM 0 HE2 LYS A 92 -2.677 28.887 96.455 1.00 17.88 H new ATOM 0 HE3 LYS A 92 -3.421 29.034 95.092 1.00 17.88 H new ATOM 0 HZ1 LYS A 92 -2.740 26.888 95.331 1.00 16.08 H new ATOM 0 HZ2 LYS A 92 -1.984 27.447 94.223 1.00 16.08 H new ATOM 0 HZ3 LYS A 92 -1.354 27.281 95.522 1.00 16.08 H new ATOM 694 N ALA A 93 -4.846 33.809 96.480 1.00 20.12 N ATOM 695 CA ALA A 93 -5.805 34.498 95.622 1.00 21.02 C ATOM 696 C ALA A 93 -5.644 36.018 95.679 1.00 21.72 C ATOM 697 O ALA A 93 -6.163 36.728 94.817 1.00 23.36 O ATOM 698 CB ALA A 93 -7.227 34.111 96.022 1.00 21.95 C ATOM 0 H ALA A 93 -5.191 33.424 97.167 1.00 20.12 H new ATOM 0 HA ALA A 93 -5.631 34.222 94.709 1.00 21.02 H new ATOM 0 HB1 ALA A 93 -7.861 34.571 95.450 1.00 21.95 H new ATOM 0 HB2 ALA A 93 -7.341 33.153 95.925 1.00 21.95 H new ATOM 0 HB3 ALA A 93 -7.384 34.363 96.945 1.00 21.95 H new ATOM 699 N LEU A 94 -4.919 36.515 96.678 1.00 21.47 N ATOM 700 CA LEU A 94 -4.719 37.959 96.856 1.00 21.65 C ATOM 701 C LEU A 94 -3.327 38.438 96.460 1.00 22.22 C ATOM 702 O LEU A 94 -2.999 39.612 96.635 1.00 23.49 O ATOM 703 CB LEU A 94 -4.943 38.336 98.318 1.00 22.69 C ATOM 704 CG LEU A 94 -6.203 37.821 99.000 1.00 23.67 C ATOM 705 CD1 LEU A 94 -6.082 38.002 100.505 1.00 22.80 C ATOM 706 CD2 LEU A 94 -7.408 38.557 98.440 1.00 23.77 C ATOM 0 H LEU A 94 -4.529 36.030 97.271 1.00 21.47 H new ATOM 0 HA LEU A 94 -5.360 38.389 96.269 1.00 21.65 H new ATOM 0 HB2 LEU A 94 -4.179 38.022 98.827 1.00 22.69 H new ATOM 0 HB3 LEU A 94 -4.946 39.304 98.379 1.00 22.69 H new ATOM 0 HG LEU A 94 -6.318 36.874 98.826 1.00 23.67 H new ATOM 0 HD11 LEU A 94 -6.886 37.673 100.936 1.00 22.80 H new ATOM 0 HD12 LEU A 94 -5.315 37.505 100.830 1.00 22.80 H new ATOM 0 HD13 LEU A 94 -5.968 38.943 100.710 1.00 22.80 H new ATOM 0 HD21 LEU A 94 -8.214 38.233 98.871 1.00 23.77 H new ATOM 0 HD22 LEU A 94 -7.313 39.508 98.606 1.00 23.77 H new ATOM 0 HD23 LEU A 94 -7.468 38.401 97.485 1.00 23.77 H new ATOM 707 N LEU A 95 -2.507 37.538 95.936 1.00 20.72 N ATOM 708 CA LEU A 95 -1.149 37.898 95.556 1.00 20.66 C ATOM 709 C LEU A 95 -1.025 38.958 94.482 1.00 19.72 C ATOM 710 O LEU A 95 -1.844 39.030 93.569 1.00 22.05 O ATOM 711 CB LEU A 95 -0.394 36.669 95.052 1.00 20.33 C ATOM 712 CG LEU A 95 -0.086 35.558 96.044 1.00 19.71 C ATOM 713 CD1 LEU A 95 0.644 34.433 95.310 1.00 21.00 C ATOM 714 CD2 LEU A 95 0.774 36.111 97.173 1.00 19.61 C ATOM 0 H LEU A 95 -2.716 36.716 95.792 1.00 20.72 H new ATOM 0 HA LEU A 95 -0.775 38.267 96.372 1.00 20.66 H new ATOM 0 HB2 LEU A 95 -0.908 36.283 94.325 1.00 20.33 H new ATOM 0 HB3 LEU A 95 0.447 36.972 94.676 1.00 20.33 H new ATOM 0 HG LEU A 95 -0.906 35.209 96.426 1.00 19.71 H new ATOM 0 HD11 LEU A 95 0.846 33.718 95.933 1.00 21.00 H new ATOM 0 HD12 LEU A 95 0.080 34.092 94.598 1.00 21.00 H new ATOM 0 HD13 LEU A 95 1.469 34.775 94.932 1.00 21.00 H new ATOM 0 HD21 LEU A 95 0.971 35.403 97.806 1.00 19.61 H new ATOM 0 HD22 LEU A 95 1.603 36.458 96.808 1.00 19.61 H new ATOM 0 HD23 LEU A 95 0.296 36.824 97.624 1.00 19.61 H new ATOM 715 N THR A 96 0.004 39.789 94.617 1.00 20.01 N ATOM 716 CA THR A 96 0.336 40.767 93.593 1.00 17.71 C ATOM 717 C THR A 96 1.845 40.678 93.455 1.00 17.17 C ATOM 718 O THR A 96 2.563 40.284 94.383 1.00 16.53 O ATOM 719 CB THR A 96 -0.025 42.245 93.924 1.00 18.14 C ATOM 720 OG1 THR A 96 0.880 42.772 94.900 1.00 19.31 O ATOM 721 CG2 THR A 96 -1.466 42.359 94.391 1.00 20.36 C ATOM 0 H THR A 96 0.525 39.800 95.301 1.00 20.01 H new ATOM 0 HA THR A 96 -0.178 40.557 92.798 1.00 17.71 H new ATOM 0 HB THR A 96 0.063 42.772 93.115 1.00 18.14 H new ATOM 0 HG1 THR A 96 0.677 43.569 95.069 1.00 19.31 H new ATOM 0 HG21 THR A 96 -1.669 43.286 94.591 1.00 20.36 H new ATOM 0 HG22 THR A 96 -2.059 42.042 93.692 1.00 20.36 H new ATOM 0 HG23 THR A 96 -1.591 41.821 95.189 1.00 20.36 H new ATOM 722 N HIS A 97 2.316 41.041 92.277 1.00 15.22 N ATOM 723 CA HIS A 97 3.726 41.024 91.941 1.00 14.49 C ATOM 724 C HIS A 97 4.587 41.747 92.978 1.00 14.62 C ATOM 725 O HIS A 97 5.527 41.174 93.548 1.00 13.20 O ATOM 726 CB HIS A 97 3.882 41.692 90.578 1.00 14.82 C ATOM 727 CG HIS A 97 5.262 41.623 90.016 1.00 13.28 C ATOM 728 ND1 HIS A 97 5.733 40.521 89.335 1.00 14.24 N ATOM 729 CD2 HIS A 97 6.262 42.535 90.002 1.00 14.35 C ATOM 730 CE1 HIS A 97 6.965 40.760 88.922 1.00 13.57 C ATOM 731 NE2 HIS A 97 7.309 41.974 89.314 1.00 13.47 N ATOM 0 H HIS A 97 1.813 41.311 91.634 1.00 15.22 H new ATOM 0 HA HIS A 97 4.033 40.104 91.925 1.00 14.49 H new ATOM 0 HB2 HIS A 97 3.268 41.275 89.953 1.00 14.82 H new ATOM 0 HB3 HIS A 97 3.621 42.623 90.654 1.00 14.82 H new ATOM 0 HD2 HIS A 97 6.243 43.382 90.386 1.00 14.35 H new ATOM 0 HE1 HIS A 97 7.500 40.173 88.437 1.00 13.57 H new ATOM 0 HE2 HIS A 97 8.067 42.352 89.163 1.00 13.47 H new ATOM 732 N ASP A 98 4.263 43.007 93.229 1.00 14.43 N ATOM 733 CA ASP A 98 5.025 43.819 94.167 1.00 16.22 C ATOM 734 C ASP A 98 4.984 43.302 95.594 1.00 15.88 C ATOM 735 O ASP A 98 5.975 43.408 96.316 1.00 16.76 O ATOM 736 CB ASP A 98 4.534 45.270 94.148 1.00 18.74 C ATOM 737 CG ASP A 98 4.924 46.008 92.881 1.00 23.76 C ATOM 738 OD1 ASP A 98 4.416 47.133 92.689 1.00 26.73 O ATOM 739 OD2 ASP A 98 5.736 45.482 92.088 1.00 24.98 O ATOM 0 H ASP A 98 3.600 43.414 92.863 1.00 14.43 H new ATOM 0 HA ASP A 98 5.946 43.767 93.867 1.00 16.22 H new ATOM 0 HB2 ASP A 98 3.568 45.281 94.239 1.00 18.74 H new ATOM 0 HB3 ASP A 98 4.897 45.740 94.915 1.00 18.74 H new ATOM 740 N ASP A 99 3.847 42.755 96.004 1.00 16.15 N ATOM 741 CA ASP A 99 3.762 42.241 97.365 1.00 16.25 C ATOM 742 C ASP A 99 4.688 41.043 97.554 1.00 15.28 C ATOM 743 O ASP A 99 5.354 40.924 98.590 1.00 14.81 O ATOM 744 CB ASP A 99 2.338 41.846 97.722 1.00 18.07 C ATOM 745 CG ASP A 99 2.249 41.240 99.105 1.00 20.61 C ATOM 746 OD1 ASP A 99 2.616 41.920 100.087 1.00 23.74 O ATOM 747 OD2 ASP A 99 1.819 40.092 99.191 1.00 22.05 O ATOM 0 H ASP A 99 3.135 42.673 95.529 1.00 16.15 H new ATOM 0 HA ASP A 99 4.042 42.955 97.959 1.00 16.25 H new ATOM 0 HB2 ASP A 99 1.765 42.627 97.674 1.00 18.07 H new ATOM 0 HB3 ASP A 99 2.006 41.210 97.069 1.00 18.07 H new ATOM 748 N VAL A 100 4.732 40.154 96.569 1.00 13.97 N ATOM 749 CA VAL A 100 5.617 39.000 96.675 1.00 13.12 C ATOM 750 C VAL A 100 7.072 39.470 96.722 1.00 13.44 C ATOM 751 O VAL A 100 7.856 39.002 97.542 1.00 12.17 O ATOM 752 CB VAL A 100 5.421 38.014 95.492 1.00 13.04 C ATOM 753 CG1 VAL A 100 6.524 36.943 95.501 1.00 12.36 C ATOM 754 CG2 VAL A 100 4.051 37.365 95.585 1.00 12.95 C ATOM 0 H VAL A 100 4.269 40.197 95.846 1.00 13.97 H new ATOM 0 HA VAL A 100 5.395 38.528 97.493 1.00 13.12 H new ATOM 0 HB VAL A 100 5.480 38.506 94.658 1.00 13.04 H new ATOM 0 HG11 VAL A 100 6.390 36.334 94.758 1.00 12.36 H new ATOM 0 HG12 VAL A 100 7.391 37.370 95.416 1.00 12.36 H new ATOM 0 HG13 VAL A 100 6.488 36.448 96.334 1.00 12.36 H new ATOM 0 HG21 VAL A 100 3.933 36.750 94.844 1.00 12.95 H new ATOM 0 HG22 VAL A 100 3.979 36.880 96.422 1.00 12.95 H new ATOM 0 HG23 VAL A 100 3.365 38.050 95.548 1.00 12.95 H new ATOM 755 N LYS A 101 7.440 40.416 95.863 1.00 12.24 N ATOM 756 CA LYS A 101 8.813 40.881 95.854 1.00 12.35 C ATOM 757 C LYS A 101 9.206 41.539 97.164 1.00 11.32 C ATOM 758 O LYS A 101 10.301 41.297 97.682 1.00 12.41 O ATOM 759 CB LYS A 101 9.055 41.847 94.685 1.00 12.68 C ATOM 760 CG LYS A 101 8.900 41.195 93.315 1.00 13.27 C ATOM 761 CD LYS A 101 9.238 42.157 92.177 1.00 15.73 C ATOM 762 CE LYS A 101 10.726 42.424 92.092 1.00 15.51 C ATOM 763 NZ LYS A 101 11.034 43.383 90.966 1.00 15.32 N ATOM 0 H LYS A 101 6.920 40.792 95.291 1.00 12.24 H new ATOM 0 HA LYS A 101 9.373 40.098 95.740 1.00 12.35 H new ATOM 0 HB2 LYS A 101 8.434 42.589 94.754 1.00 12.68 H new ATOM 0 HB3 LYS A 101 9.949 42.217 94.760 1.00 12.68 H new ATOM 0 HG2 LYS A 101 9.477 40.417 93.261 1.00 13.27 H new ATOM 0 HG3 LYS A 101 7.989 40.879 93.210 1.00 13.27 H new ATOM 0 HD2 LYS A 101 8.927 41.786 91.336 1.00 15.73 H new ATOM 0 HD3 LYS A 101 8.766 42.994 92.310 1.00 15.73 H new ATOM 0 HE2 LYS A 101 11.041 42.792 92.932 1.00 15.51 H new ATOM 0 HE3 LYS A 101 11.201 41.590 91.952 1.00 15.51 H new ATOM 0 HZ1 LYS A 101 11.906 43.562 90.958 1.00 15.32 H new ATOM 0 HZ2 LYS A 101 10.800 43.015 90.190 1.00 15.32 H new ATOM 0 HZ3 LYS A 101 10.578 44.138 91.085 1.00 15.32 H new ATOM 764 N GLN A 102 8.308 42.352 97.710 1.00 12.76 N ATOM 765 CA GLN A 102 8.611 43.043 98.956 1.00 13.91 C ATOM 766 C GLN A 102 8.823 42.077 100.116 1.00 12.61 C ATOM 767 O GLN A 102 9.795 42.210 100.856 1.00 14.28 O ATOM 768 CB GLN A 102 7.494 44.026 99.315 1.00 15.32 C ATOM 769 CG GLN A 102 7.919 45.096 100.323 1.00 22.45 C ATOM 770 CD GLN A 102 7.977 44.601 101.760 1.00 24.68 C ATOM 771 OE1 GLN A 102 7.189 43.576 102.070 1.00 29.09 O flip ATOM 772 NE2 GLN A 102 8.710 45.152 102.590 1.00 27.42 N flip ATOM 0 H GLN A 102 7.530 42.515 97.381 1.00 12.76 H new ATOM 0 HA GLN A 102 9.439 43.526 98.811 1.00 13.91 H new ATOM 0 HB2 GLN A 102 7.183 44.461 98.505 1.00 15.32 H new ATOM 0 HB3 GLN A 102 6.742 43.531 99.678 1.00 15.32 H new ATOM 0 HG2 GLN A 102 8.792 45.436 100.072 1.00 22.45 H new ATOM 0 HG3 GLN A 102 7.299 45.841 100.271 1.00 22.45 H new ATOM 0 HE21 GLN A 102 9.207 45.813 102.353 1.00 27.42 H new ATOM 0 HE22 GLN A 102 8.723 44.874 103.404 1.00 27.42 H new ATOM 773 N ARG A 103 7.910 41.121 100.269 1.00 13.22 N ATOM 774 CA ARG A 103 8.024 40.152 101.359 1.00 12.30 C ATOM 775 C ARG A 103 9.244 39.245 101.189 1.00 12.51 C ATOM 776 O ARG A 103 9.959 38.977 102.158 1.00 13.02 O ATOM 777 CB ARG A 103 6.743 39.330 101.461 1.00 12.58 C ATOM 778 CG ARG A 103 5.556 40.139 102.008 1.00 12.91 C ATOM 779 CD ARG A 103 4.312 39.293 102.197 1.00 13.91 C ATOM 780 NE ARG A 103 3.728 38.840 100.939 1.00 13.18 N ATOM 781 CZ ARG A 103 3.931 37.651 100.373 1.00 14.22 C ATOM 782 NH1 ARG A 103 4.723 36.748 100.953 1.00 13.69 N ATOM 783 NH2 ARG A 103 3.337 37.350 99.226 1.00 14.65 N ATOM 0 H ARG A 103 7.225 41.016 99.760 1.00 13.22 H new ATOM 0 HA ARG A 103 8.150 40.644 102.186 1.00 12.30 H new ATOM 0 HB2 ARG A 103 6.516 38.983 100.584 1.00 12.58 H new ATOM 0 HB3 ARG A 103 6.900 38.565 102.036 1.00 12.58 H new ATOM 0 HG2 ARG A 103 5.804 40.537 102.857 1.00 12.91 H new ATOM 0 HG3 ARG A 103 5.358 40.868 101.400 1.00 12.91 H new ATOM 0 HD2 ARG A 103 4.533 38.521 102.741 1.00 13.91 H new ATOM 0 HD3 ARG A 103 3.651 39.806 102.688 1.00 13.91 H new ATOM 0 HE ARG A 103 3.208 39.388 100.527 1.00 13.18 H new ATOM 0 HH11 ARG A 103 5.109 36.931 101.700 1.00 13.69 H new ATOM 0 HH12 ARG A 103 4.848 35.983 100.580 1.00 13.69 H new ATOM 0 HH21 ARG A 103 2.820 37.923 98.846 1.00 14.65 H new ATOM 0 HH22 ARG A 103 3.469 36.582 98.862 1.00 14.65 H new ATOM 784 N ALA A 104 9.502 38.788 99.967 1.00 11.31 N ATOM 785 CA ALA A 104 10.663 37.929 99.730 1.00 11.03 C ATOM 786 C ALA A 104 11.940 38.686 100.084 1.00 11.34 C ATOM 787 O ALA A 104 12.830 38.152 100.755 1.00 11.60 O ATOM 788 CB ALA A 104 10.707 37.468 98.272 1.00 10.88 C ATOM 0 H ALA A 104 9.027 38.959 99.271 1.00 11.31 H new ATOM 0 HA ALA A 104 10.590 37.142 100.293 1.00 11.03 H new ATOM 0 HB1 ALA A 104 11.482 36.901 98.135 1.00 10.88 H new ATOM 0 HB2 ALA A 104 9.901 36.969 98.066 1.00 10.88 H new ATOM 0 HB3 ALA A 104 10.766 38.241 97.690 1.00 10.88 H new ATOM 789 N TRP A 105 12.043 39.938 99.629 1.00 11.57 N ATOM 790 CA TRP A 105 13.218 40.737 99.921 1.00 11.80 C ATOM 791 C TRP A 105 13.410 40.997 101.418 1.00 11.64 C ATOM 792 O TRP A 105 14.546 41.068 101.880 1.00 12.34 O ATOM 793 CB TRP A 105 13.155 42.064 99.148 1.00 12.21 C ATOM 794 CG TRP A 105 14.058 42.094 97.956 1.00 12.41 C ATOM 795 CD1 TRP A 105 13.688 42.153 96.638 1.00 12.66 C ATOM 796 CD2 TRP A 105 15.488 42.116 97.973 1.00 12.31 C ATOM 797 NE1 TRP A 105 14.803 42.222 95.837 1.00 13.59 N ATOM 798 CE2 TRP A 105 15.922 42.199 96.627 1.00 12.92 C ATOM 799 CE3 TRP A 105 16.451 42.080 98.995 1.00 12.83 C ATOM 800 CZ2 TRP A 105 17.278 42.249 96.279 1.00 13.96 C ATOM 801 CZ3 TRP A 105 17.801 42.132 98.647 1.00 12.69 C ATOM 802 CH2 TRP A 105 18.202 42.216 97.299 1.00 13.49 C ATOM 0 H TRP A 105 11.445 40.334 99.154 1.00 11.57 H new ATOM 0 HA TRP A 105 13.989 40.225 99.631 1.00 11.80 H new ATOM 0 HB2 TRP A 105 12.242 42.220 98.859 1.00 12.21 H new ATOM 0 HB3 TRP A 105 13.392 42.791 99.745 1.00 12.21 H new ATOM 0 HD1 TRP A 105 12.810 42.147 96.330 1.00 12.66 H new ATOM 0 HE1 TRP A 105 14.799 42.272 94.978 1.00 13.59 H new ATOM 0 HE3 TRP A 105 16.193 42.023 99.887 1.00 12.83 H new ATOM 0 HZ2 TRP A 105 17.545 42.303 95.390 1.00 13.96 H new ATOM 0 HZ3 TRP A 105 18.447 42.111 99.316 1.00 12.69 H new ATOM 0 HH2 TRP A 105 19.109 42.250 97.094 1.00 13.49 H new ATOM 803 N GLN A 106 12.316 41.118 102.169 1.00 12.12 N ATOM 804 CA GLN A 106 12.421 41.346 103.612 1.00 13.38 C ATOM 805 C GLN A 106 13.137 40.157 104.274 1.00 12.05 C ATOM 806 O GLN A 106 14.076 40.328 105.059 1.00 13.84 O ATOM 807 CB GLN A 106 11.028 41.536 104.215 1.00 15.26 C ATOM 808 CG GLN A 106 11.016 41.662 105.736 1.00 18.96 C ATOM 809 CD GLN A 106 9.664 42.092 106.288 1.00 22.47 C ATOM 810 OE1 GLN A 106 8.610 41.710 105.771 1.00 24.84 O ATOM 811 NE2 GLN A 106 9.690 42.876 107.361 1.00 25.07 N ATOM 0 H GLN A 106 11.512 41.072 101.868 1.00 12.12 H new ATOM 0 HA GLN A 106 12.938 42.151 103.773 1.00 13.38 H new ATOM 0 HB2 GLN A 106 10.626 42.331 103.832 1.00 15.26 H new ATOM 0 HB3 GLN A 106 10.470 40.785 103.958 1.00 15.26 H new ATOM 0 HG2 GLN A 106 11.263 40.810 106.128 1.00 18.96 H new ATOM 0 HG3 GLN A 106 11.690 42.305 106.007 1.00 18.96 H new ATOM 0 HE21 GLN A 106 10.443 43.123 107.695 1.00 25.07 H new ATOM 0 HE22 GLN A 106 8.954 43.136 107.721 1.00 25.07 H new ATOM 812 N THR A 107 12.690 38.950 103.945 1.00 11.73 N ATOM 813 CA THR A 107 13.311 37.762 104.505 1.00 11.47 C ATOM 814 C THR A 107 14.716 37.559 103.948 1.00 10.99 C ATOM 815 O THR A 107 15.620 37.153 104.685 1.00 11.65 O ATOM 816 CB THR A 107 12.414 36.543 104.262 1.00 11.29 C ATOM 817 OG1 THR A 107 11.217 36.718 105.028 1.00 11.68 O ATOM 818 CG2 THR A 107 13.110 35.245 104.689 1.00 11.18 C ATOM 0 H THR A 107 12.037 38.800 103.406 1.00 11.73 H new ATOM 0 HA THR A 107 13.407 37.879 105.463 1.00 11.47 H new ATOM 0 HB THR A 107 12.216 36.474 103.315 1.00 11.29 H new ATOM 0 HG1 THR A 107 10.703 36.066 104.898 1.00 11.68 H new ATOM 0 HG21 THR A 107 12.521 34.492 104.524 1.00 11.18 H new ATOM 0 HG22 THR A 107 13.927 35.133 104.179 1.00 11.18 H new ATOM 0 HG23 THR A 107 13.323 35.288 105.634 1.00 11.18 H new ATOM 819 N LEU A 108 14.930 37.857 102.667 1.00 11.29 N ATOM 820 CA LEU A 108 16.272 37.707 102.111 1.00 10.91 C ATOM 821 C LEU A 108 17.282 38.610 102.825 1.00 11.31 C ATOM 822 O LEU A 108 18.431 38.216 103.033 1.00 11.71 O ATOM 823 CB LEU A 108 16.279 37.993 100.604 1.00 11.78 C ATOM 824 CG LEU A 108 15.672 36.881 99.732 1.00 10.84 C ATOM 825 CD1 LEU A 108 15.241 37.446 98.377 1.00 12.24 C ATOM 826 CD2 LEU A 108 16.678 35.769 99.539 1.00 11.87 C ATOM 0 H LEU A 108 14.331 38.139 102.118 1.00 11.29 H new ATOM 0 HA LEU A 108 16.539 36.785 102.253 1.00 10.91 H new ATOM 0 HB2 LEU A 108 15.792 38.816 100.442 1.00 11.78 H new ATOM 0 HB3 LEU A 108 17.194 38.145 100.321 1.00 11.78 H new ATOM 0 HG LEU A 108 14.890 36.523 100.180 1.00 10.84 H new ATOM 0 HD11 LEU A 108 14.860 36.736 97.837 1.00 12.24 H new ATOM 0 HD12 LEU A 108 14.577 38.140 98.512 1.00 12.24 H new ATOM 0 HD13 LEU A 108 16.012 37.820 97.922 1.00 12.24 H new ATOM 0 HD21 LEU A 108 16.288 35.072 98.989 1.00 11.87 H new ATOM 0 HD22 LEU A 108 17.470 36.121 99.102 1.00 11.87 H new ATOM 0 HD23 LEU A 108 16.922 35.400 100.402 1.00 11.87 H new ATOM 827 N LYS A 109 16.869 39.817 103.202 1.00 11.22 N ATOM 828 CA LYS A 109 17.794 40.697 103.913 1.00 12.30 C ATOM 829 C LYS A 109 18.178 40.098 105.267 1.00 11.30 C ATOM 830 O LYS A 109 19.343 40.205 105.680 1.00 12.21 O ATOM 831 CB LYS A 109 17.204 42.097 104.081 1.00 12.50 C ATOM 832 CG LYS A 109 17.141 42.863 102.760 1.00 13.78 C ATOM 833 CD LYS A 109 16.580 44.252 102.955 1.00 16.04 C ATOM 834 CE LYS A 109 16.432 44.952 101.610 1.00 18.08 C ATOM 835 NZ LYS A 109 15.926 46.346 101.784 1.00 21.27 N ATOM 0 H LYS A 109 16.084 40.139 103.062 1.00 11.22 H new ATOM 0 HA LYS A 109 18.600 40.779 103.379 1.00 12.30 H new ATOM 0 HB2 LYS A 109 16.312 42.027 104.454 1.00 12.50 H new ATOM 0 HB3 LYS A 109 17.739 42.597 104.717 1.00 12.50 H new ATOM 0 HG2 LYS A 109 18.030 42.922 102.376 1.00 13.78 H new ATOM 0 HG3 LYS A 109 16.590 42.376 102.127 1.00 13.78 H new ATOM 0 HD2 LYS A 109 15.718 44.201 103.397 1.00 16.04 H new ATOM 0 HD3 LYS A 109 17.165 44.767 103.533 1.00 16.04 H new ATOM 0 HE2 LYS A 109 17.289 44.970 101.155 1.00 18.08 H new ATOM 0 HE3 LYS A 109 15.822 44.451 101.046 1.00 18.08 H new ATOM 0 HZ1 LYS A 109 15.902 46.754 100.994 1.00 21.27 H new ATOM 0 HZ2 LYS A 109 15.107 46.324 102.131 1.00 21.27 H new ATOM 0 HZ3 LYS A 109 16.467 46.792 102.332 1.00 21.27 H new ATOM 836 N TRP A 110 17.220 39.459 105.950 1.00 11.85 N ATOM 837 CA TRP A 110 17.520 38.804 107.227 1.00 11.06 C ATOM 838 C TRP A 110 18.522 37.678 106.952 1.00 11.66 C ATOM 839 O TRP A 110 19.459 37.454 107.720 1.00 11.53 O ATOM 840 CB TRP A 110 16.253 38.199 107.847 1.00 11.83 C ATOM 841 CG TRP A 110 15.216 39.184 108.277 1.00 10.82 C ATOM 842 CD1 TRP A 110 15.265 40.546 108.139 1.00 13.05 C ATOM 843 CD2 TRP A 110 13.956 38.888 108.890 1.00 11.60 C ATOM 844 NE1 TRP A 110 14.113 41.110 108.626 1.00 13.13 N ATOM 845 CE2 TRP A 110 13.289 40.120 109.093 1.00 12.72 C ATOM 846 CE3 TRP A 110 13.322 37.698 109.290 1.00 11.91 C ATOM 847 CZ2 TRP A 110 12.017 40.200 109.675 1.00 13.13 C ATOM 848 CZ3 TRP A 110 12.059 37.774 109.871 1.00 12.85 C ATOM 849 CH2 TRP A 110 11.419 39.019 110.058 1.00 12.72 C ATOM 0 H TRP A 110 16.401 39.394 105.694 1.00 11.85 H new ATOM 0 HA TRP A 110 17.880 39.458 107.846 1.00 11.06 H new ATOM 0 HB2 TRP A 110 15.854 37.593 107.203 1.00 11.83 H new ATOM 0 HB3 TRP A 110 16.510 37.667 108.616 1.00 11.83 H new ATOM 0 HD1 TRP A 110 15.975 41.019 107.769 1.00 13.05 H new ATOM 0 HE1 TRP A 110 13.936 41.952 108.636 1.00 13.13 H new ATOM 0 HE3 TRP A 110 13.739 36.875 109.169 1.00 11.91 H new ATOM 0 HZ2 TRP A 110 11.593 41.018 109.798 1.00 13.13 H new ATOM 0 HZ3 TRP A 110 11.631 36.994 110.140 1.00 12.85 H new ATOM 0 HH2 TRP A 110 10.575 39.042 110.448 1.00 12.72 H new ATOM 850 N GLN A 111 18.340 36.973 105.843 1.00 10.38 N ATOM 851 CA GLN A 111 19.251 35.883 105.508 1.00 10.32 C ATOM 852 C GLN A 111 20.663 36.393 105.227 1.00 10.35 C ATOM 853 O GLN A 111 21.643 35.782 105.658 1.00 11.39 O ATOM 854 CB GLN A 111 18.705 35.084 104.320 1.00 10.65 C ATOM 855 CG GLN A 111 17.435 34.323 104.686 1.00 10.39 C ATOM 856 CD GLN A 111 16.849 33.571 103.520 1.00 10.76 C ATOM 857 OE1 GLN A 111 16.588 34.147 102.461 1.00 11.83 O ATOM 858 NE2 GLN A 111 16.626 32.272 103.702 1.00 11.24 N ATOM 0 H GLN A 111 17.706 37.105 105.277 1.00 10.38 H new ATOM 0 HA GLN A 111 19.310 35.294 106.276 1.00 10.32 H new ATOM 0 HB2 GLN A 111 18.520 35.686 103.583 1.00 10.65 H new ATOM 0 HB3 GLN A 111 19.380 34.459 104.013 1.00 10.65 H new ATOM 0 HG2 GLN A 111 17.632 33.699 105.402 1.00 10.39 H new ATOM 0 HG3 GLN A 111 16.776 34.947 105.027 1.00 10.39 H new ATOM 0 HE21 GLN A 111 16.821 31.904 104.454 1.00 11.24 H new ATOM 0 HE22 GLN A 111 16.287 31.801 103.067 1.00 11.24 H new ATOM 859 N ILE A 112 20.774 37.512 104.507 1.00 11.33 N ATOM 860 CA ILE A 112 22.093 38.084 104.221 1.00 11.52 C ATOM 861 C ILE A 112 22.773 38.451 105.553 1.00 10.98 C ATOM 862 O ILE A 112 23.959 38.175 105.769 1.00 11.14 O ATOM 863 CB ILE A 112 21.966 39.352 103.333 1.00 11.97 C ATOM 864 CG1 ILE A 112 21.377 38.974 101.971 1.00 11.87 C ATOM 865 CG2 ILE A 112 23.337 39.994 103.137 1.00 13.18 C ATOM 866 CD1 ILE A 112 20.995 40.191 101.096 1.00 12.03 C ATOM 0 H ILE A 112 20.110 37.949 104.180 1.00 11.33 H new ATOM 0 HA ILE A 112 22.624 37.430 103.740 1.00 11.52 H new ATOM 0 HB ILE A 112 21.379 39.986 103.773 1.00 11.97 H new ATOM 0 HG12 ILE A 112 22.020 38.430 101.490 1.00 11.87 H new ATOM 0 HG13 ILE A 112 20.589 38.426 102.110 1.00 11.87 H new ATOM 0 HG21 ILE A 112 23.248 40.784 102.582 1.00 13.18 H new ATOM 0 HG22 ILE A 112 23.703 40.245 103.999 1.00 13.18 H new ATOM 0 HG23 ILE A 112 23.932 39.361 102.705 1.00 13.18 H new ATOM 0 HD11 ILE A 112 20.630 39.881 100.252 1.00 12.03 H new ATOM 0 HD12 ILE A 112 20.331 40.726 101.558 1.00 12.03 H new ATOM 0 HD13 ILE A 112 21.784 40.730 100.928 1.00 12.03 H new ATOM 867 N ALA A 113 21.994 39.043 106.448 1.00 11.66 N ATOM 868 CA ALA A 113 22.476 39.445 107.769 1.00 11.24 C ATOM 869 C ALA A 113 22.945 38.231 108.575 1.00 11.56 C ATOM 870 O ALA A 113 23.842 38.338 109.423 1.00 12.94 O ATOM 871 CB ALA A 113 21.363 40.166 108.518 1.00 11.93 C ATOM 0 H ALA A 113 21.165 39.225 106.308 1.00 11.66 H new ATOM 0 HA ALA A 113 23.232 40.041 107.654 1.00 11.24 H new ATOM 0 HB1 ALA A 113 21.682 40.433 109.394 1.00 11.93 H new ATOM 0 HB2 ALA A 113 21.094 40.953 108.019 1.00 11.93 H new ATOM 0 HB3 ALA A 113 20.603 39.572 108.619 1.00 11.93 H new ATOM 872 N ASN A 114 22.316 37.086 108.312 1.00 11.53 N ATOM 873 CA ASN A 114 22.637 35.842 108.998 1.00 11.69 C ATOM 874 C ASN A 114 23.648 34.963 108.269 1.00 11.04 C ATOM 875 O ASN A 114 23.723 33.755 108.509 1.00 11.37 O ATOM 876 CB ASN A 114 21.352 35.058 109.278 1.00 11.62 C ATOM 877 CG ASN A 114 20.433 35.777 110.231 1.00 12.77 C ATOM 878 OD1 ASN A 114 20.871 36.626 111.016 1.00 15.55 O ATOM 879 ND2 ASN A 114 19.148 35.433 110.185 1.00 14.26 N ATOM 0 H ASN A 114 21.689 37.012 107.728 1.00 11.53 H new ATOM 0 HA ASN A 114 23.068 36.096 109.829 1.00 11.69 H new ATOM 0 HB2 ASN A 114 20.886 34.898 108.443 1.00 11.62 H new ATOM 0 HB3 ASN A 114 21.580 34.190 109.646 1.00 11.62 H new ATOM 0 HD21 ASN A 114 18.584 35.806 110.716 1.00 14.26 H new ATOM 0 HD22 ASN A 114 18.882 34.838 109.624 1.00 14.26 H new ATOM 880 N GLY A 115 24.419 35.567 107.367 1.00 10.76 N ATOM 881 CA GLY A 115 25.463 34.849 106.662 1.00 10.58 C ATOM 882 C GLY A 115 25.046 33.770 105.684 1.00 9.08 C ATOM 883 O GLY A 115 25.838 32.884 105.361 1.00 10.68 O ATOM 0 H GLY A 115 24.349 36.397 107.152 1.00 10.76 H new ATOM 0 HA2 GLY A 115 25.996 35.499 106.178 1.00 10.58 H new ATOM 0 HA3 GLY A 115 26.043 34.442 107.324 1.00 10.58 H new ATOM 884 N ILE A 116 23.803 33.843 105.204 1.00 10.63 N ATOM 885 CA ILE A 116 23.290 32.865 104.247 1.00 10.15 C ATOM 886 C ILE A 116 23.498 33.404 102.830 1.00 10.04 C ATOM 887 O ILE A 116 22.944 34.441 102.481 1.00 10.99 O ATOM 888 CB ILE A 116 21.788 32.596 104.494 1.00 11.61 C ATOM 889 CG1 ILE A 116 21.617 31.938 105.858 1.00 11.70 C ATOM 890 CG2 ILE A 116 21.234 31.669 103.432 1.00 10.54 C ATOM 891 CD1 ILE A 116 21.723 32.877 106.983 1.00 22.78 C ATOM 0 H ILE A 116 23.240 34.455 105.422 1.00 10.63 H new ATOM 0 HA ILE A 116 23.768 32.028 104.357 1.00 10.15 H new ATOM 0 HB ILE A 116 21.309 33.439 104.461 1.00 11.61 H new ATOM 0 HG12 ILE A 116 20.751 31.502 105.892 1.00 11.70 H new ATOM 0 HG13 ILE A 116 22.288 31.245 105.961 1.00 11.70 H new ATOM 0 HG21 ILE A 116 20.292 31.510 103.600 1.00 10.54 H new ATOM 0 HG22 ILE A 116 21.342 32.077 102.558 1.00 10.54 H new ATOM 0 HG23 ILE A 116 21.713 30.826 103.456 1.00 10.54 H new ATOM 0 HD11 ILE A 116 21.605 32.397 107.818 1.00 22.78 H new ATOM 0 HD12 ILE A 116 22.597 33.297 106.973 1.00 22.78 H new ATOM 0 HD13 ILE A 116 21.036 33.558 106.903 1.00 22.78 H new ATOM 892 N GLN A 117 24.292 32.694 102.035 1.00 10.23 N ATOM 893 CA GLN A 117 24.592 33.111 100.662 1.00 10.20 C ATOM 894 C GLN A 117 23.997 32.204 99.589 1.00 10.41 C ATOM 895 O GLN A 117 24.129 32.473 98.383 1.00 11.35 O ATOM 896 CB GLN A 117 26.111 33.219 100.469 1.00 10.51 C ATOM 897 CG GLN A 117 26.728 34.380 101.239 1.00 11.48 C ATOM 898 CD GLN A 117 28.209 34.563 100.948 1.00 11.59 C ATOM 899 OE1 GLN A 117 28.678 34.288 99.847 1.00 12.86 O ATOM 900 NE2 GLN A 117 28.948 35.049 101.941 1.00 12.67 N ATOM 0 H GLN A 117 24.672 31.960 102.272 1.00 10.23 H new ATOM 0 HA GLN A 117 24.169 33.976 100.547 1.00 10.20 H new ATOM 0 HB2 GLN A 117 26.528 32.391 100.754 1.00 10.51 H new ATOM 0 HB3 GLN A 117 26.305 33.324 99.525 1.00 10.51 H new ATOM 0 HG2 GLN A 117 26.256 35.197 101.016 1.00 11.48 H new ATOM 0 HG3 GLN A 117 26.606 34.233 102.190 1.00 11.48 H new ATOM 0 HE21 GLN A 117 28.584 35.230 102.699 1.00 12.67 H new ATOM 0 HE22 GLN A 117 29.790 35.182 101.825 1.00 12.67 H new ATOM 901 N HIS A 118 23.333 31.134 100.025 1.00 9.79 N ATOM 902 CA HIS A 118 22.705 30.176 99.113 1.00 10.53 C ATOM 903 C HIS A 118 21.335 29.855 99.666 1.00 10.04 C ATOM 904 O HIS A 118 21.209 29.455 100.830 1.00 10.58 O ATOM 905 CB HIS A 118 23.546 28.903 99.019 1.00 11.09 C ATOM 906 CG HIS A 118 24.908 29.128 98.442 1.00 12.80 C ATOM 907 ND1 HIS A 118 25.121 29.273 97.087 1.00 15.25 N ATOM 908 CD2 HIS A 118 26.111 29.305 99.037 1.00 15.09 C ATOM 909 CE1 HIS A 118 26.399 29.534 96.874 1.00 17.06 C ATOM 910 NE2 HIS A 118 27.020 29.561 98.038 1.00 15.82 N ATOM 0 H HIS A 118 23.234 30.943 100.858 1.00 9.79 H new ATOM 0 HA HIS A 118 22.635 30.552 98.222 1.00 10.53 H new ATOM 0 HB2 HIS A 118 23.637 28.518 99.905 1.00 11.09 H new ATOM 0 HB3 HIS A 118 23.075 28.253 98.475 1.00 11.09 H new ATOM 0 HD1 HIS A 118 24.518 29.204 96.478 1.00 15.25 H new ATOM 0 HD2 HIS A 118 26.289 29.262 99.949 1.00 15.09 H new ATOM 0 HE1 HIS A 118 26.794 29.675 96.044 1.00 17.06 H new ATOM 911 N VAL A 119 20.305 30.029 98.843 1.00 9.27 N ATOM 912 CA VAL A 119 18.935 29.804 99.281 1.00 9.29 C ATOM 913 C VAL A 119 18.141 29.090 98.209 1.00 9.55 C ATOM 914 O VAL A 119 18.232 29.439 97.028 1.00 10.87 O ATOM 915 CB VAL A 119 18.218 31.153 99.573 1.00 8.21 C ATOM 916 CG1 VAL A 119 16.754 30.923 99.940 1.00 8.84 C ATOM 917 CG2 VAL A 119 18.942 31.900 100.692 1.00 9.44 C ATOM 0 H VAL A 119 20.381 30.278 98.023 1.00 9.27 H new ATOM 0 HA VAL A 119 18.979 29.265 100.086 1.00 9.29 H new ATOM 0 HB VAL A 119 18.243 31.695 98.769 1.00 8.21 H new ATOM 0 HG11 VAL A 119 16.327 31.776 100.118 1.00 8.84 H new ATOM 0 HG12 VAL A 119 16.301 30.482 99.204 1.00 8.84 H new ATOM 0 HG13 VAL A 119 16.702 30.365 100.732 1.00 8.84 H new ATOM 0 HG21 VAL A 119 18.488 32.739 100.867 1.00 9.44 H new ATOM 0 HG22 VAL A 119 18.941 31.358 101.497 1.00 9.44 H new ATOM 0 HG23 VAL A 119 19.857 32.077 100.424 1.00 9.44 H new ATOM 918 N ARG A 120 17.381 28.070 98.613 1.00 9.21 N ATOM 919 CA ARG A 120 16.497 27.360 97.698 1.00 9.14 C ATOM 920 C ARG A 120 15.082 27.653 98.189 1.00 8.74 C ATOM 921 O ARG A 120 14.687 27.249 99.301 1.00 9.33 O ATOM 922 CB ARG A 120 16.741 25.855 97.716 1.00 8.60 C ATOM 923 CG ARG A 120 15.664 25.077 96.935 1.00 9.25 C ATOM 924 CD ARG A 120 15.968 23.579 96.885 1.00 9.22 C ATOM 925 NE ARG A 120 17.044 23.251 95.950 1.00 9.70 N ATOM 926 CZ ARG A 120 17.535 22.025 95.763 1.00 9.86 C ATOM 927 NH1 ARG A 120 17.052 20.992 96.450 1.00 11.46 N ATOM 928 NH2 ARG A 120 18.504 21.823 94.872 1.00 10.94 N ATOM 0 H ARG A 120 17.366 27.775 99.421 1.00 9.21 H new ATOM 0 HA ARG A 120 16.649 27.652 96.786 1.00 9.14 H new ATOM 0 HB2 ARG A 120 17.613 25.666 97.335 1.00 8.60 H new ATOM 0 HB3 ARG A 120 16.759 25.544 98.634 1.00 8.60 H new ATOM 0 HG2 ARG A 120 14.799 25.218 97.350 1.00 9.25 H new ATOM 0 HG3 ARG A 120 15.605 25.425 96.032 1.00 9.25 H new ATOM 0 HD2 ARG A 120 16.212 23.273 97.773 1.00 9.22 H new ATOM 0 HD3 ARG A 120 15.165 23.098 96.629 1.00 9.22 H new ATOM 0 HE ARG A 120 17.383 23.893 95.489 1.00 9.70 H new ATOM 0 HH11 ARG A 120 16.419 21.113 97.019 1.00 11.46 H new ATOM 0 HH12 ARG A 120 17.373 20.204 96.324 1.00 11.46 H new ATOM 0 HH21 ARG A 120 18.814 22.483 94.417 1.00 10.94 H new ATOM 0 HH22 ARG A 120 18.820 21.032 94.752 1.00 10.94 H new ATOM 929 N THR A 121 14.332 28.403 97.386 1.00 9.59 N ATOM 930 CA THR A 121 12.964 28.712 97.739 1.00 9.42 C ATOM 931 C THR A 121 11.990 27.939 96.869 1.00 8.99 C ATOM 932 O THR A 121 12.188 27.793 95.655 1.00 9.80 O ATOM 933 CB THR A 121 12.629 30.240 97.593 1.00 9.49 C ATOM 934 OG1 THR A 121 11.278 30.466 98.019 1.00 9.87 O ATOM 935 CG2 THR A 121 12.767 30.727 96.135 1.00 11.00 C ATOM 0 H THR A 121 14.599 28.737 96.640 1.00 9.59 H new ATOM 0 HA THR A 121 12.871 28.457 98.670 1.00 9.42 H new ATOM 0 HB THR A 121 13.260 30.733 98.141 1.00 9.49 H new ATOM 0 HG1 THR A 121 10.911 31.021 97.506 1.00 9.87 H new ATOM 0 HG21 THR A 121 12.552 31.672 96.088 1.00 11.00 H new ATOM 0 HG22 THR A 121 13.678 30.587 95.832 1.00 11.00 H new ATOM 0 HG23 THR A 121 12.158 30.229 95.568 1.00 11.00 H new ATOM 936 N HIS A 122 10.961 27.404 97.508 1.00 9.19 N ATOM 937 CA HIS A 122 9.903 26.736 96.781 1.00 10.24 C ATOM 938 C HIS A 122 8.942 27.867 96.459 1.00 11.55 C ATOM 939 O HIS A 122 8.850 28.844 97.212 1.00 14.22 O ATOM 940 CB HIS A 122 9.251 25.670 97.668 1.00 11.20 C ATOM 941 CG HIS A 122 10.172 24.533 97.977 1.00 9.74 C ATOM 942 ND1 HIS A 122 10.123 23.325 97.312 1.00 10.78 N ATOM 943 CD2 HIS A 122 11.214 24.449 98.838 1.00 10.76 C ATOM 944 CE1 HIS A 122 11.096 22.546 97.753 1.00 11.37 C ATOM 945 NE2 HIS A 122 11.772 23.205 98.678 1.00 9.82 N ATOM 0 H HIS A 122 10.859 27.418 98.362 1.00 9.19 H new ATOM 0 HA HIS A 122 10.202 26.269 95.986 1.00 10.24 H new ATOM 0 HB2 HIS A 122 8.959 26.079 98.498 1.00 11.20 H new ATOM 0 HB3 HIS A 122 8.458 25.328 97.226 1.00 11.20 H new ATOM 0 HD2 HIS A 122 11.498 25.110 99.427 1.00 10.76 H new ATOM 0 HE1 HIS A 122 11.274 21.681 97.462 1.00 11.37 H new ATOM 0 HE2 HIS A 122 12.452 22.903 99.110 1.00 9.82 H new ATOM 946 N VAL A 123 8.281 27.780 95.310 1.00 9.22 N ATOM 947 CA VAL A 123 7.293 28.782 94.903 1.00 10.17 C ATOM 948 C VAL A 123 6.098 27.991 94.395 1.00 9.00 C ATOM 949 O VAL A 123 6.242 27.126 93.529 1.00 9.26 O ATOM 950 CB VAL A 123 7.814 29.699 93.775 1.00 10.02 C ATOM 951 CG1 VAL A 123 6.696 30.647 93.335 1.00 11.70 C ATOM 952 CG2 VAL A 123 9.030 30.502 94.255 1.00 11.86 C ATOM 0 H VAL A 123 8.390 27.142 94.744 1.00 9.22 H new ATOM 0 HA VAL A 123 7.078 29.362 95.650 1.00 10.17 H new ATOM 0 HB VAL A 123 8.088 29.152 93.022 1.00 10.02 H new ATOM 0 HG11 VAL A 123 7.021 31.224 92.626 1.00 11.70 H new ATOM 0 HG12 VAL A 123 5.942 30.130 93.010 1.00 11.70 H new ATOM 0 HG13 VAL A 123 6.415 31.189 94.089 1.00 11.70 H new ATOM 0 HG21 VAL A 123 9.345 31.072 93.537 1.00 11.86 H new ATOM 0 HG22 VAL A 123 8.777 31.050 95.015 1.00 11.86 H new ATOM 0 HG23 VAL A 123 9.737 29.892 94.518 1.00 11.86 H new ATOM 953 N ASP A 124 4.927 28.276 94.952 1.00 9.92 N ATOM 954 CA ASP A 124 3.701 27.567 94.577 1.00 9.85 C ATOM 955 C ASP A 124 3.319 27.871 93.129 1.00 9.39 C ATOM 956 O ASP A 124 3.076 29.028 92.786 1.00 12.01 O ATOM 957 CB ASP A 124 2.590 27.992 95.554 1.00 11.74 C ATOM 958 CG ASP A 124 1.285 27.253 95.339 1.00 12.90 C ATOM 959 OD1 ASP A 124 0.361 27.452 96.154 1.00 15.10 O ATOM 960 OD2 ASP A 124 1.174 26.482 94.374 1.00 13.76 O ATOM 0 H ASP A 124 4.817 28.880 95.554 1.00 9.92 H new ATOM 0 HA ASP A 124 3.836 26.608 94.634 1.00 9.85 H new ATOM 0 HB2 ASP A 124 2.893 27.842 96.463 1.00 11.74 H new ATOM 0 HB3 ASP A 124 2.434 28.945 95.461 1.00 11.74 H new ATOM 961 N VAL A 125 3.292 26.837 92.285 1.00 8.96 N ATOM 962 CA VAL A 125 2.919 26.996 90.878 1.00 10.01 C ATOM 963 C VAL A 125 1.563 26.369 90.559 1.00 10.85 C ATOM 964 O VAL A 125 1.250 26.089 89.402 1.00 10.31 O ATOM 965 CB VAL A 125 4.030 26.468 89.920 1.00 10.07 C ATOM 966 CG1 VAL A 125 5.272 27.341 90.076 1.00 11.31 C ATOM 967 CG2 VAL A 125 4.350 25.006 90.204 1.00 10.17 C ATOM 0 H VAL A 125 3.488 26.030 92.510 1.00 8.96 H new ATOM 0 HA VAL A 125 2.830 27.950 90.725 1.00 10.01 H new ATOM 0 HB VAL A 125 3.714 26.518 89.004 1.00 10.07 H new ATOM 0 HG11 VAL A 125 5.970 27.020 89.483 1.00 11.31 H new ATOM 0 HG12 VAL A 125 5.053 28.259 89.850 1.00 11.31 H new ATOM 0 HG13 VAL A 125 5.584 27.300 90.994 1.00 11.31 H new ATOM 0 HG21 VAL A 125 5.042 24.702 89.596 1.00 10.17 H new ATOM 0 HG22 VAL A 125 4.660 24.914 91.119 1.00 10.17 H new ATOM 0 HG23 VAL A 125 3.552 24.469 90.078 1.00 10.17 H new ATOM 968 N SER A 126 0.760 26.136 91.599 1.00 12.03 N ATOM 969 CA SER A 126 -0.611 25.644 91.414 1.00 11.80 C ATOM 970 C SER A 126 -1.375 26.953 91.340 1.00 13.68 C ATOM 971 O SER A 126 -2.137 27.307 92.237 1.00 13.44 O ATOM 972 CB SER A 126 -1.102 24.843 92.624 1.00 12.00 C ATOM 973 OG SER A 126 -0.402 23.624 92.779 1.00 12.96 O ATOM 0 H SER A 126 0.988 26.256 92.420 1.00 12.03 H new ATOM 0 HA SER A 126 -0.707 25.051 90.652 1.00 11.80 H new ATOM 0 HB2 SER A 126 -0.999 25.377 93.427 1.00 12.00 H new ATOM 0 HB3 SER A 126 -2.049 24.660 92.525 1.00 12.00 H new ATOM 0 HG SER A 126 -0.427 23.193 92.058 1.00 12.96 H new ATOM 974 N ASP A 127 -1.157 27.679 90.253 1.00 13.55 N ATOM 975 CA ASP A 127 -1.760 28.993 90.069 1.00 14.15 C ATOM 976 C ASP A 127 -1.584 29.335 88.600 1.00 14.50 C ATOM 977 O ASP A 127 -0.460 29.542 88.140 1.00 13.71 O ATOM 978 CB ASP A 127 -1.011 29.994 90.957 1.00 16.36 C ATOM 979 CG ASP A 127 -1.483 31.421 90.785 1.00 16.45 C ATOM 980 OD1 ASP A 127 -0.989 32.288 91.531 1.00 18.77 O ATOM 981 OD2 ASP A 127 -2.333 31.690 89.918 1.00 17.00 O ATOM 0 H ASP A 127 -0.656 27.426 89.601 1.00 13.55 H new ATOM 0 HA ASP A 127 -2.699 29.015 90.311 1.00 14.15 H new ATOM 0 HB2 ASP A 127 -1.118 29.735 91.886 1.00 16.36 H new ATOM 0 HB3 ASP A 127 -0.063 29.948 90.757 1.00 16.36 H new ATOM 982 N ALA A 128 -2.693 29.387 87.868 1.00 14.95 N ATOM 983 CA ALA A 128 -2.647 29.680 86.441 1.00 15.45 C ATOM 984 C ALA A 128 -1.958 31.001 86.111 1.00 14.19 C ATOM 985 O ALA A 128 -1.387 31.140 85.032 1.00 15.63 O ATOM 986 CB ALA A 128 -4.059 29.668 85.864 1.00 14.72 C ATOM 0 H ALA A 128 -3.483 29.255 88.180 1.00 14.95 H new ATOM 0 HA ALA A 128 -2.110 28.983 86.033 1.00 15.45 H new ATOM 0 HB1 ALA A 128 -4.022 29.863 84.915 1.00 14.72 H new ATOM 0 HB2 ALA A 128 -4.456 28.793 85.999 1.00 14.72 H new ATOM 0 HB3 ALA A 128 -4.597 30.339 86.311 1.00 14.72 H new ATOM 987 N THR A 129 -1.992 31.959 87.031 1.00 13.88 N ATOM 988 CA THR A 129 -1.370 33.259 86.784 1.00 13.40 C ATOM 989 C THR A 129 0.130 33.266 87.054 1.00 13.76 C ATOM 990 O THR A 129 0.828 34.178 86.624 1.00 14.23 O ATOM 991 CB THR A 129 -1.990 34.373 87.656 1.00 14.75 C ATOM 992 OG1 THR A 129 -1.590 34.193 89.026 1.00 15.86 O ATOM 993 CG2 THR A 129 -3.507 34.350 87.556 1.00 16.88 C ATOM 0 H THR A 129 -2.367 31.879 87.801 1.00 13.88 H new ATOM 0 HA THR A 129 -1.533 33.428 85.843 1.00 13.40 H new ATOM 0 HB THR A 129 -1.673 35.232 87.335 1.00 14.75 H new ATOM 0 HG1 THR A 129 -1.893 33.464 89.313 1.00 15.86 H new ATOM 0 HG21 THR A 129 -3.879 35.055 88.109 1.00 16.88 H new ATOM 0 HG22 THR A 129 -3.773 34.489 86.634 1.00 16.88 H new ATOM 0 HG23 THR A 129 -3.839 33.491 87.862 1.00 16.88 H new ATOM 994 N LEU A 130 0.609 32.255 87.779 1.00 12.23 N ATOM 995 CA LEU A 130 2.024 32.148 88.158 1.00 11.32 C ATOM 996 C LEU A 130 2.549 33.487 88.687 1.00 10.37 C ATOM 997 O LEU A 130 3.693 33.868 88.455 1.00 10.67 O ATOM 998 CB LEU A 130 2.871 31.634 86.978 1.00 11.74 C ATOM 999 CG LEU A 130 2.513 30.214 86.501 1.00 11.58 C ATOM 1000 CD1 LEU A 130 3.283 29.871 85.233 1.00 12.92 C ATOM 1001 CD2 LEU A 130 2.847 29.191 87.600 1.00 12.38 C ATOM 0 H LEU A 130 0.122 31.608 88.067 1.00 12.23 H new ATOM 0 HA LEU A 130 2.099 31.500 88.876 1.00 11.32 H new ATOM 0 HB2 LEU A 130 2.772 32.247 86.233 1.00 11.74 H new ATOM 0 HB3 LEU A 130 3.806 31.650 87.236 1.00 11.74 H new ATOM 0 HG LEU A 130 1.562 30.183 86.311 1.00 11.58 H new ATOM 0 HD11 LEU A 130 3.048 28.975 84.944 1.00 12.92 H new ATOM 0 HD12 LEU A 130 3.056 30.505 84.535 1.00 12.92 H new ATOM 0 HD13 LEU A 130 4.236 29.914 85.411 1.00 12.92 H new ATOM 0 HD21 LEU A 130 2.619 28.300 87.293 1.00 12.38 H new ATOM 0 HD22 LEU A 130 3.795 29.230 87.802 1.00 12.38 H new ATOM 0 HD23 LEU A 130 2.338 29.397 88.400 1.00 12.38 H new ATOM 1002 N THR A 131 1.718 34.170 89.468 1.00 12.00 N ATOM 1003 CA THR A 131 2.092 35.475 89.985 1.00 11.79 C ATOM 1004 C THR A 131 3.369 35.479 90.823 1.00 12.30 C ATOM 1005 O THR A 131 4.300 36.248 90.556 1.00 13.69 O ATOM 1006 CB THR A 131 0.935 36.092 90.790 1.00 13.38 C ATOM 1007 OG1 THR A 131 -0.181 36.325 89.915 1.00 15.09 O ATOM 1008 CG2 THR A 131 1.366 37.402 91.420 1.00 14.60 C ATOM 0 H THR A 131 0.939 33.896 89.707 1.00 12.00 H new ATOM 0 HA THR A 131 2.282 36.016 89.202 1.00 11.79 H new ATOM 0 HB THR A 131 0.679 35.477 91.495 1.00 13.38 H new ATOM 0 HG1 THR A 131 -0.534 35.591 89.709 1.00 15.09 H new ATOM 0 HG21 THR A 131 0.627 37.778 91.923 1.00 14.60 H new ATOM 0 HG22 THR A 131 2.115 37.244 92.016 1.00 14.60 H new ATOM 0 HG23 THR A 131 1.632 38.024 90.725 1.00 14.60 H new ATOM 1009 N ALA A 132 3.429 34.609 91.826 1.00 12.64 N ATOM 1010 CA ALA A 132 4.600 34.566 92.688 1.00 11.22 C ATOM 1011 C ALA A 132 5.850 34.129 91.935 1.00 9.82 C ATOM 1012 O ALA A 132 6.932 34.639 92.202 1.00 11.39 O ATOM 1013 CB ALA A 132 4.343 33.641 93.881 1.00 11.90 C ATOM 0 H ALA A 132 2.811 34.043 92.021 1.00 12.64 H new ATOM 0 HA ALA A 132 4.759 35.467 93.010 1.00 11.22 H new ATOM 0 HB1 ALA A 132 5.129 33.619 94.449 1.00 11.90 H new ATOM 0 HB2 ALA A 132 3.586 33.971 94.390 1.00 11.90 H new ATOM 0 HB3 ALA A 132 4.151 32.746 93.561 1.00 11.90 H new ATOM 1014 N LEU A 133 5.715 33.186 91.005 1.00 10.52 N ATOM 1015 CA LEU A 133 6.875 32.749 90.248 1.00 11.29 C ATOM 1016 C LEU A 133 7.495 33.897 89.438 1.00 11.13 C ATOM 1017 O LEU A 133 8.715 34.086 89.444 1.00 11.76 O ATOM 1018 CB LEU A 133 6.505 31.599 89.307 1.00 11.23 C ATOM 1019 CG LEU A 133 7.694 31.140 88.456 1.00 10.82 C ATOM 1020 CD1 LEU A 133 8.781 30.521 89.328 1.00 13.68 C ATOM 1021 CD2 LEU A 133 7.218 30.149 87.402 1.00 12.88 C ATOM 0 H LEU A 133 4.976 32.796 90.803 1.00 10.52 H new ATOM 0 HA LEU A 133 7.534 32.441 90.890 1.00 11.29 H new ATOM 0 HB2 LEU A 133 6.175 30.851 89.828 1.00 11.23 H new ATOM 0 HB3 LEU A 133 5.782 31.880 88.724 1.00 11.23 H new ATOM 0 HG LEU A 133 8.077 31.913 88.012 1.00 10.82 H new ATOM 0 HD11 LEU A 133 9.522 30.238 88.770 1.00 13.68 H new ATOM 0 HD12 LEU A 133 9.093 31.177 89.971 1.00 13.68 H new ATOM 0 HD13 LEU A 133 8.420 29.753 89.799 1.00 13.68 H new ATOM 0 HD21 LEU A 133 7.972 29.860 86.865 1.00 12.88 H new ATOM 0 HD22 LEU A 133 6.819 29.380 87.838 1.00 12.88 H new ATOM 0 HD23 LEU A 133 6.559 30.575 86.831 1.00 12.88 H new ATOM 1022 N LYS A 134 6.657 34.663 88.741 1.00 12.24 N ATOM 1023 CA LYS A 134 7.172 35.776 87.942 1.00 11.73 C ATOM 1024 C LYS A 134 7.889 36.785 88.831 1.00 11.94 C ATOM 1025 O LYS A 134 8.951 37.312 88.465 1.00 12.29 O ATOM 1026 CB LYS A 134 6.029 36.434 87.157 1.00 12.08 C ATOM 1027 CG LYS A 134 5.496 35.524 86.043 1.00 12.10 C ATOM 1028 CD LYS A 134 4.374 36.168 85.236 1.00 14.02 C ATOM 1029 CE LYS A 134 3.121 36.345 86.074 1.00 13.47 C ATOM 1030 NZ LYS A 134 1.985 36.904 85.271 1.00 16.66 N ATOM 0 H LYS A 134 5.804 34.559 88.716 1.00 12.24 H new ATOM 0 HA LYS A 134 7.818 35.435 87.304 1.00 11.73 H new ATOM 0 HB2 LYS A 134 5.307 36.656 87.765 1.00 12.08 H new ATOM 0 HB3 LYS A 134 6.341 37.267 86.771 1.00 12.08 H new ATOM 0 HG2 LYS A 134 6.224 35.290 85.446 1.00 12.10 H new ATOM 0 HG3 LYS A 134 5.173 34.697 86.434 1.00 12.10 H new ATOM 0 HD2 LYS A 134 4.667 37.031 84.903 1.00 14.02 H new ATOM 0 HD3 LYS A 134 4.173 35.618 84.462 1.00 14.02 H new ATOM 0 HE2 LYS A 134 2.860 35.490 86.450 1.00 13.47 H new ATOM 0 HE3 LYS A 134 3.312 36.936 86.819 1.00 13.47 H new ATOM 0 HZ1 LYS A 134 1.292 37.062 85.807 1.00 16.66 H new ATOM 0 HZ2 LYS A 134 2.240 37.664 84.884 1.00 16.66 H new ATOM 0 HZ3 LYS A 134 1.747 36.318 84.645 1.00 16.66 H new ATOM 1031 N ALA A 135 7.325 37.044 90.005 1.00 11.04 N ATOM 1032 CA ALA A 135 7.961 37.963 90.934 1.00 10.77 C ATOM 1033 C ALA A 135 9.295 37.400 91.441 1.00 11.16 C ATOM 1034 O ALA A 135 10.305 38.103 91.477 1.00 11.75 O ATOM 1035 CB ALA A 135 7.035 38.234 92.105 1.00 12.05 C ATOM 0 H ALA A 135 6.585 36.703 90.279 1.00 11.04 H new ATOM 0 HA ALA A 135 8.141 38.793 90.466 1.00 10.77 H new ATOM 0 HB1 ALA A 135 7.464 38.848 92.722 1.00 12.05 H new ATOM 0 HB2 ALA A 135 6.209 38.627 91.781 1.00 12.05 H new ATOM 0 HB3 ALA A 135 6.839 37.401 92.562 1.00 12.05 H new ATOM 1036 N MET A 136 9.302 36.117 91.808 1.00 10.59 N ATOM 1037 CA MET A 136 10.517 35.509 92.332 1.00 9.96 C ATOM 1038 C MET A 136 11.650 35.444 91.314 1.00 9.73 C ATOM 1039 O MET A 136 12.828 35.535 91.676 1.00 10.35 O ATOM 1040 CB MET A 136 10.214 34.104 92.866 1.00 10.30 C ATOM 1041 CG MET A 136 11.174 33.675 93.977 1.00 11.42 C ATOM 1042 SD MET A 136 11.105 34.720 95.465 1.00 12.54 S ATOM 1043 CE MET A 136 9.465 34.398 96.019 1.00 14.42 C ATOM 0 H MET A 136 8.623 35.592 91.761 1.00 10.59 H new ATOM 0 HA MET A 136 10.823 36.083 93.052 1.00 9.96 H new ATOM 0 HB2 MET A 136 9.304 34.079 93.202 1.00 10.30 H new ATOM 0 HB3 MET A 136 10.264 33.467 92.136 1.00 10.30 H new ATOM 0 HG2 MET A 136 10.975 32.759 94.227 1.00 11.42 H new ATOM 0 HG3 MET A 136 12.080 33.683 93.630 1.00 11.42 H new ATOM 0 HE1 MET A 136 9.357 34.734 96.923 1.00 14.42 H new ATOM 0 HE2 MET A 136 8.832 34.841 95.432 1.00 14.42 H new ATOM 0 HE3 MET A 136 9.301 33.442 96.008 1.00 14.42 H new ATOM 1044 N LEU A 137 11.317 35.290 90.033 1.00 10.93 N ATOM 1045 CA LEU A 137 12.360 35.240 89.011 1.00 11.32 C ATOM 1046 C LEU A 137 13.067 36.600 88.949 1.00 10.69 C ATOM 1047 O LEU A 137 14.276 36.670 88.681 1.00 12.18 O ATOM 1048 CB LEU A 137 11.759 34.848 87.658 1.00 11.52 C ATOM 1049 CG LEU A 137 11.407 33.352 87.563 1.00 11.02 C ATOM 1050 CD1 LEU A 137 10.425 33.100 86.422 1.00 11.86 C ATOM 1051 CD2 LEU A 137 12.681 32.543 87.365 1.00 12.40 C ATOM 0 H LEU A 137 10.512 35.214 89.740 1.00 10.93 H new ATOM 0 HA LEU A 137 13.017 34.564 89.239 1.00 11.32 H new ATOM 0 HB2 LEU A 137 10.959 35.373 87.501 1.00 11.52 H new ATOM 0 HB3 LEU A 137 12.388 35.072 86.954 1.00 11.52 H new ATOM 0 HG LEU A 137 10.980 33.074 88.388 1.00 11.02 H new ATOM 0 HD11 LEU A 137 10.216 32.154 86.378 1.00 11.86 H new ATOM 0 HD12 LEU A 137 9.611 33.604 86.578 1.00 11.86 H new ATOM 0 HD13 LEU A 137 10.823 33.382 85.584 1.00 11.86 H new ATOM 0 HD21 LEU A 137 12.460 31.600 87.305 1.00 12.40 H new ATOM 0 HD22 LEU A 137 13.119 32.825 86.547 1.00 12.40 H new ATOM 0 HD23 LEU A 137 13.277 32.688 88.117 1.00 12.40 H new ATOM 1052 N GLU A 138 12.325 37.676 89.203 1.00 11.32 N ATOM 1053 CA GLU A 138 12.938 39.002 89.237 1.00 12.15 C ATOM 1054 C GLU A 138 13.779 39.138 90.511 1.00 12.01 C ATOM 1055 O GLU A 138 14.901 39.635 90.461 1.00 12.15 O ATOM 1056 CB GLU A 138 11.877 40.105 89.169 1.00 12.13 C ATOM 1057 CG GLU A 138 11.199 40.178 87.806 1.00 12.11 C ATOM 1058 CD GLU A 138 10.200 41.304 87.686 1.00 12.54 C ATOM 1059 OE1 GLU A 138 10.043 42.094 88.637 1.00 12.80 O ATOM 1060 OE2 GLU A 138 9.554 41.396 86.619 1.00 14.71 O ATOM 0 H GLU A 138 11.479 37.662 89.356 1.00 11.32 H new ATOM 0 HA GLU A 138 13.511 39.102 88.461 1.00 12.15 H new ATOM 0 HB2 GLU A 138 11.207 39.948 89.852 1.00 12.13 H new ATOM 0 HB3 GLU A 138 12.290 40.960 89.368 1.00 12.13 H new ATOM 0 HG2 GLU A 138 11.878 40.284 87.121 1.00 12.11 H new ATOM 0 HG3 GLU A 138 10.749 39.337 87.632 1.00 12.11 H new ATOM 1061 N VAL A 139 13.243 38.695 91.653 1.00 10.86 N ATOM 1062 CA VAL A 139 13.993 38.753 92.908 1.00 11.58 C ATOM 1063 C VAL A 139 15.319 37.997 92.775 1.00 10.85 C ATOM 1064 O VAL A 139 16.359 38.465 93.250 1.00 11.26 O ATOM 1065 CB VAL A 139 13.168 38.156 94.059 1.00 10.62 C ATOM 1066 CG1 VAL A 139 14.015 38.059 95.320 1.00 12.03 C ATOM 1067 CG2 VAL A 139 11.945 39.022 94.314 1.00 12.33 C ATOM 0 H VAL A 139 12.454 38.361 91.720 1.00 10.86 H new ATOM 0 HA VAL A 139 14.179 39.684 93.106 1.00 11.58 H new ATOM 0 HB VAL A 139 12.880 37.263 93.812 1.00 10.62 H new ATOM 0 HG11 VAL A 139 13.484 37.681 96.038 1.00 12.03 H new ATOM 0 HG12 VAL A 139 14.782 37.490 95.152 1.00 12.03 H new ATOM 0 HG13 VAL A 139 14.319 38.944 95.574 1.00 12.03 H new ATOM 0 HG21 VAL A 139 11.426 38.643 95.041 1.00 12.33 H new ATOM 0 HG22 VAL A 139 12.227 39.919 94.552 1.00 12.33 H new ATOM 0 HG23 VAL A 139 11.400 39.057 93.512 1.00 12.33 H new ATOM 1068 N LYS A 140 15.292 36.835 92.119 1.00 9.94 N ATOM 1069 CA LYS A 140 16.511 36.057 91.926 1.00 10.77 C ATOM 1070 C LYS A 140 17.610 36.895 91.269 1.00 11.77 C ATOM 1071 O LYS A 140 18.769 36.857 91.682 1.00 12.01 O ATOM 1072 CB LYS A 140 16.217 34.819 91.073 1.00 11.29 C ATOM 1073 CG LYS A 140 17.447 34.022 90.679 1.00 11.07 C ATOM 1074 CD LYS A 140 17.065 32.775 89.893 1.00 11.32 C ATOM 1075 CE LYS A 140 18.297 32.047 89.405 1.00 13.52 C ATOM 1076 NZ LYS A 140 17.965 30.786 88.704 1.00 16.58 N ATOM 0 H LYS A 140 14.583 36.484 91.782 1.00 9.94 H new ATOM 0 HA LYS A 140 16.827 35.778 92.799 1.00 10.77 H new ATOM 0 HB2 LYS A 140 15.612 34.239 91.562 1.00 11.29 H new ATOM 0 HB3 LYS A 140 15.754 35.097 90.267 1.00 11.29 H new ATOM 0 HG2 LYS A 140 18.037 34.576 90.145 1.00 11.07 H new ATOM 0 HG3 LYS A 140 17.940 33.768 91.475 1.00 11.07 H new ATOM 0 HD2 LYS A 140 16.536 32.185 90.452 1.00 11.32 H new ATOM 0 HD3 LYS A 140 16.510 33.022 89.137 1.00 11.32 H new ATOM 0 HE2 LYS A 140 18.796 32.625 88.807 1.00 13.52 H new ATOM 0 HE3 LYS A 140 18.875 31.853 90.159 1.00 13.52 H new ATOM 0 HZ1 LYS A 140 18.708 30.427 88.371 1.00 16.58 H new ATOM 0 HZ2 LYS A 140 17.592 30.217 89.277 1.00 16.58 H new ATOM 0 HZ3 LYS A 140 17.395 30.955 88.042 1.00 16.58 H new ATOM 1077 N GLN A 141 17.239 37.648 90.239 1.00 13.04 N ATOM 1078 CA GLN A 141 18.209 38.487 89.542 1.00 14.27 C ATOM 1079 C GLN A 141 18.677 39.633 90.419 1.00 13.03 C ATOM 1080 O GLN A 141 19.870 39.948 90.458 1.00 14.14 O ATOM 1081 CB GLN A 141 17.581 39.064 88.273 1.00 16.43 C ATOM 1082 CG GLN A 141 17.367 38.067 87.162 1.00 22.38 C ATOM 1083 CD GLN A 141 16.600 38.672 85.998 1.00 26.60 C ATOM 1084 OE1 GLN A 141 15.890 39.767 86.259 1.00 31.38 O flip ATOM 1085 NE2 GLN A 141 16.636 38.155 84.881 1.00 29.55 N flip ATOM 0 H GLN A 141 16.438 37.688 89.929 1.00 13.04 H new ATOM 0 HA GLN A 141 18.972 37.932 89.317 1.00 14.27 H new ATOM 0 HB2 GLN A 141 16.726 39.462 88.502 1.00 16.43 H new ATOM 0 HB3 GLN A 141 18.147 39.779 87.944 1.00 16.43 H new ATOM 0 HG2 GLN A 141 18.226 37.743 86.849 1.00 22.38 H new ATOM 0 HG3 GLN A 141 16.882 37.300 87.505 1.00 22.38 H new ATOM 0 HE21 GLN A 141 17.106 37.447 84.750 1.00 29.55 H new ATOM 0 HE22 GLN A 141 16.191 38.502 84.232 1.00 29.55 H new ATOM 1086 N GLU A 142 17.739 40.251 91.127 1.00 11.81 N ATOM 1087 CA GLU A 142 18.057 41.386 91.985 1.00 12.36 C ATOM 1088 C GLU A 142 18.952 41.058 93.161 1.00 12.65 C ATOM 1089 O GLU A 142 19.797 41.858 93.541 1.00 13.37 O ATOM 1090 CB GLU A 142 16.763 42.012 92.500 1.00 12.38 C ATOM 1091 CG GLU A 142 15.918 42.623 91.390 1.00 14.11 C ATOM 1092 CD GLU A 142 14.518 43.001 91.835 1.00 15.58 C ATOM 1093 OE1 GLU A 142 13.736 43.477 90.978 1.00 17.17 O ATOM 1094 OE2 GLU A 142 14.180 42.833 93.025 1.00 15.41 O ATOM 0 H GLU A 142 16.909 40.028 91.125 1.00 11.81 H new ATOM 0 HA GLU A 142 18.558 42.004 91.430 1.00 12.36 H new ATOM 0 HB2 GLU A 142 16.243 41.335 92.961 1.00 12.38 H new ATOM 0 HB3 GLU A 142 16.978 42.698 93.152 1.00 12.38 H new ATOM 0 HG2 GLU A 142 16.366 43.413 91.050 1.00 14.11 H new ATOM 0 HG3 GLU A 142 15.857 41.993 90.655 1.00 14.11 H new ATOM 1095 N VAL A 143 18.765 39.879 93.746 1.00 11.15 N ATOM 1096 CA VAL A 143 19.542 39.513 94.918 1.00 12.01 C ATOM 1097 C VAL A 143 20.853 38.798 94.614 1.00 11.57 C ATOM 1098 O VAL A 143 21.655 38.577 95.518 1.00 11.50 O ATOM 1099 CB VAL A 143 18.676 38.640 95.880 1.00 11.48 C ATOM 1100 CG1 VAL A 143 18.591 37.203 95.367 1.00 11.11 C ATOM 1101 CG2 VAL A 143 19.242 38.692 97.284 1.00 12.53 C ATOM 0 H VAL A 143 18.201 39.286 93.483 1.00 11.15 H new ATOM 0 HA VAL A 143 19.789 40.351 95.339 1.00 12.01 H new ATOM 0 HB VAL A 143 17.775 38.998 95.906 1.00 11.48 H new ATOM 0 HG11 VAL A 143 18.051 36.674 95.974 1.00 11.11 H new ATOM 0 HG12 VAL A 143 18.186 37.197 94.486 1.00 11.11 H new ATOM 0 HG13 VAL A 143 19.483 36.825 95.315 1.00 11.11 H new ATOM 0 HG21 VAL A 143 18.697 38.147 97.873 1.00 12.53 H new ATOM 0 HG22 VAL A 143 20.151 38.353 97.279 1.00 12.53 H new ATOM 0 HG23 VAL A 143 19.241 39.609 97.600 1.00 12.53 H new ATOM 1102 N ALA A 144 21.083 38.485 93.339 1.00 11.28 N ATOM 1103 CA ALA A 144 22.274 37.755 92.907 1.00 11.70 C ATOM 1104 C ALA A 144 23.629 38.227 93.448 1.00 12.40 C ATOM 1105 O ALA A 144 24.511 37.405 93.687 1.00 13.60 O ATOM 1106 CB ALA A 144 22.312 37.676 91.376 1.00 12.84 C ATOM 0 H ALA A 144 20.549 38.692 92.697 1.00 11.28 H new ATOM 0 HA ALA A 144 22.165 36.880 93.312 1.00 11.70 H new ATOM 0 HB1 ALA A 144 23.104 37.191 91.096 1.00 12.84 H new ATOM 0 HB2 ALA A 144 21.521 37.215 91.056 1.00 12.84 H new ATOM 0 HB3 ALA A 144 22.335 38.572 91.006 1.00 12.84 H new ATOM 1107 N PRO A 145 23.825 39.548 93.635 1.00 13.14 N ATOM 1108 CA PRO A 145 25.138 39.941 94.159 1.00 13.73 C ATOM 1109 C PRO A 145 25.412 39.429 95.578 1.00 14.22 C ATOM 1110 O PRO A 145 26.569 39.350 95.999 1.00 15.67 O ATOM 1111 CB PRO A 145 25.083 41.468 94.126 1.00 15.14 C ATOM 1112 CG PRO A 145 24.163 41.756 92.969 1.00 13.93 C ATOM 1113 CD PRO A 145 23.061 40.729 93.190 1.00 13.22 C ATOM 0 HA PRO A 145 25.859 39.560 93.634 1.00 13.73 H new ATOM 0 HB2 PRO A 145 24.739 41.832 94.957 1.00 15.14 H new ATOM 0 HB3 PRO A 145 25.962 41.855 93.990 1.00 15.14 H new ATOM 0 HG2 PRO A 145 23.824 42.665 92.990 1.00 13.93 H new ATOM 0 HG3 PRO A 145 24.605 41.638 92.114 1.00 13.93 H new ATOM 0 HD2 PRO A 145 22.422 41.021 93.859 1.00 13.22 H new ATOM 0 HD3 PRO A 145 22.561 40.553 92.378 1.00 13.22 H new ATOM 1114 N TRP A 146 24.351 39.068 96.299 1.00 13.02 N ATOM 1115 CA TRP A 146 24.469 38.636 97.693 1.00 12.70 C ATOM 1116 C TRP A 146 24.074 37.189 97.977 1.00 12.15 C ATOM 1117 O TRP A 146 24.646 36.557 98.864 1.00 11.97 O ATOM 1118 CB TRP A 146 23.618 39.564 98.566 1.00 13.80 C ATOM 1119 CG TRP A 146 23.993 41.001 98.408 1.00 14.66 C ATOM 1120 CD1 TRP A 146 25.055 41.634 98.988 1.00 16.73 C ATOM 1121 CD2 TRP A 146 23.400 41.947 97.509 1.00 15.47 C ATOM 1122 NE1 TRP A 146 25.169 42.914 98.496 1.00 17.31 N ATOM 1123 CE2 TRP A 146 24.167 43.133 97.588 1.00 16.32 C ATOM 1124 CE3 TRP A 146 22.299 41.907 96.638 1.00 16.17 C ATOM 1125 CZ2 TRP A 146 23.870 44.273 96.829 1.00 16.98 C ATOM 1126 CZ3 TRP A 146 22.003 43.045 95.880 1.00 16.56 C ATOM 1127 CH2 TRP A 146 22.789 44.209 95.984 1.00 16.56 C ATOM 0 H TRP A 146 23.546 39.066 95.996 1.00 13.02 H new ATOM 0 HA TRP A 146 25.415 38.686 97.901 1.00 12.70 H new ATOM 0 HB2 TRP A 146 22.682 39.450 98.337 1.00 13.80 H new ATOM 0 HB3 TRP A 146 23.716 39.308 99.496 1.00 13.80 H new ATOM 0 HD1 TRP A 146 25.619 41.255 99.623 1.00 16.73 H new ATOM 0 HE1 TRP A 146 25.772 43.484 98.722 1.00 17.31 H new ATOM 0 HE3 TRP A 146 21.778 41.140 96.567 1.00 16.17 H new ATOM 0 HZ2 TRP A 146 24.386 45.044 96.895 1.00 16.98 H new ATOM 0 HZ3 TRP A 146 21.277 43.033 95.299 1.00 16.56 H new ATOM 0 HH2 TRP A 146 22.571 44.952 95.468 1.00 16.56 H new ATOM 1128 N ILE A 147 23.102 36.677 97.232 1.00 11.99 N ATOM 1129 CA ILE A 147 22.606 35.320 97.444 1.00 11.25 C ATOM 1130 C ILE A 147 22.339 34.651 96.114 1.00 10.53 C ATOM 1131 O ILE A 147 21.752 35.274 95.213 1.00 11.90 O ATOM 1132 CB ILE A 147 21.255 35.343 98.235 1.00 11.05 C ATOM 1133 CG1 ILE A 147 21.509 35.689 99.703 1.00 10.44 C ATOM 1134 CG2 ILE A 147 20.522 33.993 98.108 1.00 11.62 C ATOM 1135 CD1 ILE A 147 20.248 35.814 100.553 1.00 10.96 C ATOM 0 H ILE A 147 22.713 37.101 96.593 1.00 11.99 H new ATOM 0 HA ILE A 147 23.281 34.836 97.945 1.00 11.25 H new ATOM 0 HB ILE A 147 20.685 36.028 97.851 1.00 11.05 H new ATOM 0 HG12 ILE A 147 22.079 35.007 100.090 1.00 10.44 H new ATOM 0 HG13 ILE A 147 21.998 36.525 99.746 1.00 10.44 H new ATOM 0 HG21 ILE A 147 19.689 34.029 98.604 1.00 11.62 H new ATOM 0 HG22 ILE A 147 20.334 33.814 97.174 1.00 11.62 H new ATOM 0 HG23 ILE A 147 21.081 33.286 98.466 1.00 11.62 H new ATOM 0 HD11 ILE A 147 20.493 36.034 101.465 1.00 10.96 H new ATOM 0 HD12 ILE A 147 19.683 36.515 100.193 1.00 10.96 H new ATOM 0 HD13 ILE A 147 19.765 34.973 100.542 1.00 10.96 H new ATOM 1136 N ASP A 148 22.793 33.410 95.976 1.00 10.68 N ATOM 1137 CA ASP A 148 22.501 32.615 94.786 1.00 12.02 C ATOM 1138 C ASP A 148 21.177 31.918 95.156 1.00 11.71 C ATOM 1139 O ASP A 148 21.140 30.994 95.987 1.00 11.35 O ATOM 1140 CB ASP A 148 23.593 31.571 94.537 1.00 15.42 C ATOM 1141 CG ASP A 148 23.445 30.883 93.194 1.00 21.40 C ATOM 1142 OD1 ASP A 148 22.328 30.904 92.635 1.00 24.63 O ATOM 1143 OD2 ASP A 148 24.444 30.319 92.692 1.00 26.46 O ATOM 0 H ASP A 148 23.275 33.007 96.563 1.00 10.68 H new ATOM 0 HA ASP A 148 22.452 33.149 93.978 1.00 12.02 H new ATOM 0 HB2 ASP A 148 24.462 31.999 94.583 1.00 15.42 H new ATOM 0 HB3 ASP A 148 23.567 30.906 95.242 1.00 15.42 H new ATOM 1144 N LEU A 149 20.093 32.376 94.547 1.00 10.35 N ATOM 1145 CA LEU A 149 18.761 31.843 94.827 1.00 10.59 C ATOM 1146 C LEU A 149 18.303 30.818 93.802 1.00 11.43 C ATOM 1147 O LEU A 149 18.296 31.093 92.597 1.00 12.56 O ATOM 1148 CB LEU A 149 17.744 32.995 94.863 1.00 11.19 C ATOM 1149 CG LEU A 149 16.280 32.670 95.211 1.00 10.49 C ATOM 1150 CD1 LEU A 149 16.178 32.224 96.676 1.00 11.82 C ATOM 1151 CD2 LEU A 149 15.406 33.904 94.986 1.00 11.74 C ATOM 0 H LEU A 149 20.105 33.004 93.960 1.00 10.35 H new ATOM 0 HA LEU A 149 18.814 31.395 95.686 1.00 10.59 H new ATOM 0 HB2 LEU A 149 18.062 33.649 95.505 1.00 11.19 H new ATOM 0 HB3 LEU A 149 17.752 33.424 93.993 1.00 11.19 H new ATOM 0 HG LEU A 149 15.971 31.952 94.637 1.00 10.49 H new ATOM 0 HD11 LEU A 149 15.254 32.021 96.889 1.00 11.82 H new ATOM 0 HD12 LEU A 149 16.722 31.433 96.812 1.00 11.82 H new ATOM 0 HD13 LEU A 149 16.493 32.936 97.254 1.00 11.82 H new ATOM 0 HD21 LEU A 149 14.485 33.693 95.207 1.00 11.74 H new ATOM 0 HD22 LEU A 149 15.716 34.628 95.552 1.00 11.74 H new ATOM 0 HD23 LEU A 149 15.461 34.175 94.056 1.00 11.74 H new ATOM 1152 N GLN A 150 17.933 29.632 94.278 1.00 10.37 N ATOM 1153 CA GLN A 150 17.382 28.576 93.429 1.00 10.23 C ATOM 1154 C GLN A 150 15.872 28.615 93.625 1.00 9.79 C ATOM 1155 O GLN A 150 15.383 28.806 94.739 1.00 10.63 O ATOM 1156 CB GLN A 150 17.890 27.188 93.852 1.00 10.59 C ATOM 1157 CG GLN A 150 19.351 26.939 93.512 1.00 10.86 C ATOM 1158 CD GLN A 150 19.816 25.517 93.808 1.00 10.97 C ATOM 1159 OE1 GLN A 150 18.884 24.637 94.177 1.00 13.75 O flip ATOM 1160 NE2 GLN A 150 21.014 25.215 93.692 1.00 9.42 N flip ATOM 0 H GLN A 150 17.995 29.415 95.108 1.00 10.37 H new ATOM 0 HA GLN A 150 17.648 28.721 92.508 1.00 10.23 H new ATOM 0 HB2 GLN A 150 17.767 27.086 94.809 1.00 10.59 H new ATOM 0 HB3 GLN A 150 17.346 26.509 93.422 1.00 10.59 H new ATOM 0 HG2 GLN A 150 19.492 27.128 92.571 1.00 10.86 H new ATOM 0 HG3 GLN A 150 19.902 27.561 94.012 1.00 10.86 H new ATOM 0 HE21 GLN A 150 21.586 25.810 93.452 1.00 9.42 H new ATOM 0 HE22 GLN A 150 21.272 24.410 93.852 1.00 9.42 H new ATOM 1161 N ILE A 151 15.130 28.444 92.542 1.00 10.00 N ATOM 1162 CA ILE A 151 13.677 28.444 92.624 1.00 9.47 C ATOM 1163 C ILE A 151 13.116 27.077 92.272 1.00 9.28 C ATOM 1164 O ILE A 151 13.429 26.529 91.208 1.00 9.41 O ATOM 1165 CB ILE A 151 13.062 29.496 91.659 1.00 9.78 C ATOM 1166 CG1 ILE A 151 13.402 30.900 92.157 1.00 11.63 C ATOM 1167 CG2 ILE A 151 11.553 29.313 91.556 1.00 11.14 C ATOM 1168 CD1 ILE A 151 14.869 31.241 92.132 1.00 21.30 C ATOM 0 H ILE A 151 15.446 28.326 91.751 1.00 10.00 H new ATOM 0 HA ILE A 151 13.442 28.668 93.538 1.00 9.47 H new ATOM 0 HB ILE A 151 13.437 29.373 90.773 1.00 9.78 H new ATOM 0 HG12 ILE A 151 12.923 31.547 91.615 1.00 11.63 H new ATOM 0 HG13 ILE A 151 13.076 30.995 93.066 1.00 11.63 H new ATOM 0 HG21 ILE A 151 11.187 29.977 90.951 1.00 11.14 H new ATOM 0 HG22 ILE A 151 11.357 28.425 91.218 1.00 11.14 H new ATOM 0 HG23 ILE A 151 11.153 29.420 92.433 1.00 11.14 H new ATOM 0 HD11 ILE A 151 14.997 32.144 92.462 1.00 21.30 H new ATOM 0 HD12 ILE A 151 15.356 30.619 92.696 1.00 21.30 H new ATOM 0 HD13 ILE A 151 15.200 31.179 91.222 1.00 21.30 H new ATOM 1169 N VAL A 152 12.311 26.526 93.184 1.00 8.68 N ATOM 1170 CA VAL A 152 11.654 25.245 92.931 1.00 8.80 C ATOM 1171 C VAL A 152 10.229 25.521 92.472 1.00 8.61 C ATOM 1172 O VAL A 152 9.490 26.266 93.128 1.00 9.07 O ATOM 1173 CB VAL A 152 11.529 24.366 94.207 1.00 7.99 C ATOM 1174 CG1 VAL A 152 10.970 22.982 93.831 1.00 9.10 C ATOM 1175 CG2 VAL A 152 12.882 24.236 94.921 1.00 9.88 C ATOM 0 H VAL A 152 12.134 26.876 93.949 1.00 8.68 H new ATOM 0 HA VAL A 152 12.192 24.778 92.273 1.00 8.80 H new ATOM 0 HB VAL A 152 10.915 24.795 94.823 1.00 7.99 H new ATOM 0 HG11 VAL A 152 10.893 22.436 94.629 1.00 9.10 H new ATOM 0 HG12 VAL A 152 10.095 23.086 93.425 1.00 9.10 H new ATOM 0 HG13 VAL A 152 11.569 22.551 93.201 1.00 9.10 H new ATOM 0 HG21 VAL A 152 12.779 23.684 95.712 1.00 9.88 H new ATOM 0 HG22 VAL A 152 13.526 23.825 94.323 1.00 9.88 H new ATOM 0 HG23 VAL A 152 13.197 25.116 95.180 1.00 9.88 H new ATOM 1176 N ALA A 153 9.850 24.937 91.340 1.00 9.77 N ATOM 1177 CA ALA A 153 8.474 25.049 90.863 1.00 8.39 C ATOM 1178 C ALA A 153 7.737 23.994 91.703 1.00 9.17 C ATOM 1179 O ALA A 153 7.805 22.793 91.428 1.00 8.81 O ATOM 1180 CB ALA A 153 8.412 24.717 89.371 1.00 10.02 C ATOM 0 H ALA A 153 10.370 24.474 90.835 1.00 9.77 H new ATOM 0 HA ALA A 153 8.092 25.936 90.955 1.00 8.39 H new ATOM 0 HB1 ALA A 153 7.496 24.793 89.060 1.00 10.02 H new ATOM 0 HB2 ALA A 153 8.973 25.336 88.878 1.00 10.02 H new ATOM 0 HB3 ALA A 153 8.727 23.811 89.228 1.00 10.02 H new ATOM 1181 N PHE A 154 7.045 24.479 92.724 1.00 8.44 N ATOM 1182 CA PHE A 154 6.365 23.624 93.689 1.00 8.85 C ATOM 1183 C PHE A 154 4.865 23.566 93.434 1.00 7.61 C ATOM 1184 O PHE A 154 4.153 24.526 93.668 1.00 9.24 O ATOM 1185 CB PHE A 154 6.680 24.179 95.090 1.00 10.17 C ATOM 1186 CG PHE A 154 5.927 23.522 96.208 1.00 9.55 C ATOM 1187 CD1 PHE A 154 5.848 22.136 96.306 1.00 9.97 C ATOM 1188 CD2 PHE A 154 5.335 24.302 97.194 1.00 10.56 C ATOM 1189 CE1 PHE A 154 5.183 21.536 97.381 1.00 9.93 C ATOM 1190 CE2 PHE A 154 4.675 23.716 98.268 1.00 11.41 C ATOM 1191 CZ PHE A 154 4.600 22.326 98.356 1.00 10.75 C ATOM 0 H PHE A 154 6.955 25.320 92.879 1.00 8.44 H new ATOM 0 HA PHE A 154 6.681 22.710 93.608 1.00 8.85 H new ATOM 0 HB2 PHE A 154 7.631 24.083 95.256 1.00 10.17 H new ATOM 0 HB3 PHE A 154 6.485 25.129 95.100 1.00 10.17 H new ATOM 0 HD1 PHE A 154 6.240 21.604 95.652 1.00 9.97 H new ATOM 0 HD2 PHE A 154 5.381 25.229 97.135 1.00 10.56 H new ATOM 0 HE1 PHE A 154 5.133 20.609 97.440 1.00 9.93 H new ATOM 0 HE2 PHE A 154 4.286 24.248 98.924 1.00 11.41 H new ATOM 0 HZ PHE A 154 4.157 21.929 99.071 1.00 10.75 H new ATOM 1192 N PRO A 155 4.361 22.417 92.959 1.00 7.74 N ATOM 1193 CA PRO A 155 2.916 22.302 92.688 1.00 8.15 C ATOM 1194 C PRO A 155 2.206 21.966 93.994 1.00 9.66 C ATOM 1195 O PRO A 155 1.818 20.824 94.229 1.00 10.77 O ATOM 1196 CB PRO A 155 2.862 21.181 91.650 1.00 8.64 C ATOM 1197 CG PRO A 155 3.967 20.237 92.102 1.00 8.82 C ATOM 1198 CD PRO A 155 5.085 21.177 92.610 1.00 8.01 C ATOM 0 HA PRO A 155 2.479 23.102 92.357 1.00 8.15 H new ATOM 0 HB2 PRO A 155 1.997 20.742 91.641 1.00 8.64 H new ATOM 0 HB3 PRO A 155 3.020 21.515 90.753 1.00 8.64 H new ATOM 0 HG2 PRO A 155 3.659 19.641 92.803 1.00 8.82 H new ATOM 0 HG3 PRO A 155 4.278 19.679 91.372 1.00 8.82 H new ATOM 0 HD2 PRO A 155 5.544 20.803 93.378 1.00 8.01 H new ATOM 0 HD3 PRO A 155 5.756 21.335 91.928 1.00 8.01 H new ATOM 1199 N GLN A 156 2.043 22.988 94.833 1.00 10.09 N ATOM 1200 CA GLN A 156 1.465 22.840 96.168 1.00 10.58 C ATOM 1201 C GLN A 156 0.169 22.061 96.266 1.00 11.22 C ATOM 1202 O GLN A 156 -0.057 21.360 97.256 1.00 12.42 O ATOM 1203 CB GLN A 156 1.277 24.228 96.803 1.00 11.46 C ATOM 1204 CG GLN A 156 0.559 24.228 98.158 1.00 13.49 C ATOM 1205 CD GLN A 156 1.438 23.766 99.309 1.00 15.53 C ATOM 1206 OE1 GLN A 156 2.111 24.570 99.970 1.00 15.78 O ATOM 1207 NE2 GLN A 156 1.444 22.461 99.552 1.00 15.15 N ATOM 0 H GLN A 156 2.267 23.796 94.641 1.00 10.09 H new ATOM 0 HA GLN A 156 2.109 22.298 96.650 1.00 10.58 H new ATOM 0 HB2 GLN A 156 2.149 24.639 96.914 1.00 11.46 H new ATOM 0 HB3 GLN A 156 0.777 24.786 96.187 1.00 11.46 H new ATOM 0 HG2 GLN A 156 0.237 25.124 98.345 1.00 13.49 H new ATOM 0 HG3 GLN A 156 -0.220 23.652 98.104 1.00 13.49 H new ATOM 0 HE21 GLN A 156 0.964 21.932 99.073 1.00 15.15 H new ATOM 0 HE22 GLN A 156 1.928 22.144 100.189 1.00 15.15 H new ATOM 1208 N GLU A 157 -0.684 22.165 95.259 1.00 10.51 N ATOM 1209 CA GLU A 157 -1.954 21.457 95.321 1.00 11.41 C ATOM 1210 C GLU A 157 -1.987 20.171 94.514 1.00 11.16 C ATOM 1211 O GLU A 157 -3.048 19.585 94.266 1.00 10.95 O ATOM 1212 CB GLU A 157 -3.086 22.419 94.952 1.00 13.01 C ATOM 1213 CG GLU A 157 -3.123 23.592 95.947 1.00 16.92 C ATOM 1214 CD GLU A 157 -4.320 24.490 95.794 1.00 18.52 C ATOM 1215 OE1 GLU A 157 -5.429 23.961 95.591 1.00 20.03 O ATOM 1216 OE2 GLU A 157 -4.156 25.726 95.900 1.00 19.25 O ATOM 0 H GLU A 157 -0.553 22.628 94.546 1.00 10.51 H new ATOM 0 HA GLU A 157 -2.079 21.156 96.235 1.00 11.41 H new ATOM 0 HB2 GLU A 157 -2.956 22.753 94.051 1.00 13.01 H new ATOM 0 HB3 GLU A 157 -3.935 21.950 94.961 1.00 13.01 H new ATOM 0 HG2 GLU A 157 -3.110 23.238 96.850 1.00 16.92 H new ATOM 0 HG3 GLU A 157 -2.318 24.121 95.838 1.00 16.92 H new ATOM 1217 N GLY A 158 -0.796 19.708 94.155 1.00 10.92 N ATOM 1218 CA GLY A 158 -0.673 18.476 93.406 1.00 10.70 C ATOM 1219 C GLY A 158 -0.478 18.680 91.919 1.00 10.82 C ATOM 1220 O GLY A 158 -0.832 19.720 91.354 1.00 12.46 O ATOM 0 H GLY A 158 -0.050 20.095 94.337 1.00 10.92 H new ATOM 0 HA2 GLY A 158 0.077 17.969 93.755 1.00 10.70 H new ATOM 0 HA3 GLY A 158 -1.469 17.940 93.549 1.00 10.70 H new ATOM 1221 N ILE A 159 0.091 17.668 91.286 1.00 10.20 N ATOM 1222 CA ILE A 159 0.318 17.678 89.854 1.00 11.61 C ATOM 1223 C ILE A 159 -0.889 17.099 89.141 1.00 11.47 C ATOM 1224 O ILE A 159 -1.430 17.716 88.230 1.00 14.45 O ATOM 1225 CB ILE A 159 1.564 16.869 89.499 1.00 10.88 C ATOM 1226 CG1 ILE A 159 2.784 17.591 90.062 1.00 11.15 C ATOM 1227 CG2 ILE A 159 1.691 16.724 87.975 1.00 11.84 C ATOM 1228 CD1 ILE A 159 3.038 18.909 89.389 1.00 21.03 C ATOM 0 H ILE A 159 0.358 16.951 91.679 1.00 10.20 H new ATOM 0 HA ILE A 159 0.454 18.595 89.569 1.00 11.61 H new ATOM 0 HB ILE A 159 1.499 15.980 89.881 1.00 10.88 H new ATOM 0 HG12 ILE A 159 2.659 17.736 91.013 1.00 11.15 H new ATOM 0 HG13 ILE A 159 3.565 17.025 89.962 1.00 11.15 H new ATOM 0 HG21 ILE A 159 2.485 16.209 87.764 1.00 11.84 H new ATOM 0 HG22 ILE A 159 0.909 16.268 87.627 1.00 11.84 H new ATOM 0 HG23 ILE A 159 1.759 17.603 87.571 1.00 11.84 H new ATOM 0 HD11 ILE A 159 3.821 19.327 89.781 1.00 21.03 H new ATOM 0 HD12 ILE A 159 3.189 18.765 88.442 1.00 21.03 H new ATOM 0 HD13 ILE A 159 2.269 19.488 89.509 1.00 21.03 H new ATOM 1229 N LEU A 160 -1.331 15.928 89.573 1.00 11.76 N ATOM 1230 CA LEU A 160 -2.475 15.283 88.950 1.00 12.27 C ATOM 1231 C LEU A 160 -3.789 15.654 89.613 1.00 12.12 C ATOM 1232 O LEU A 160 -4.854 15.465 89.021 1.00 15.20 O ATOM 1233 CB LEU A 160 -2.298 13.762 88.983 1.00 14.44 C ATOM 1234 CG LEU A 160 -1.074 13.261 88.219 1.00 18.40 C ATOM 1235 CD1 LEU A 160 -1.029 11.750 88.291 1.00 21.72 C ATOM 1236 CD2 LEU A 160 -1.118 13.751 86.764 1.00 20.74 C ATOM 0 H LEU A 160 -0.983 15.490 90.226 1.00 11.76 H new ATOM 0 HA LEU A 160 -2.513 15.598 88.033 1.00 12.27 H new ATOM 0 HB2 LEU A 160 -2.231 13.474 89.907 1.00 14.44 H new ATOM 0 HB3 LEU A 160 -3.092 13.345 88.612 1.00 14.44 H new ATOM 0 HG LEU A 160 -0.266 13.616 88.622 1.00 18.40 H new ATOM 0 HD11 LEU A 160 -0.253 11.426 87.807 1.00 21.72 H new ATOM 0 HD12 LEU A 160 -0.971 11.472 89.218 1.00 21.72 H new ATOM 0 HD13 LEU A 160 -1.834 11.383 87.894 1.00 21.72 H new ATOM 0 HD21 LEU A 160 -0.337 13.427 86.289 1.00 20.74 H new ATOM 0 HD22 LEU A 160 -1.920 13.415 86.333 1.00 20.74 H new ATOM 0 HD23 LEU A 160 -1.126 14.721 86.749 1.00 20.74 H new ATOM 1237 N SER A 161 -3.725 16.223 90.812 1.00 11.47 N ATOM 1238 CA SER A 161 -4.930 16.563 91.561 1.00 11.52 C ATOM 1239 C SER A 161 -5.372 18.019 91.472 1.00 11.91 C ATOM 1240 O SER A 161 -6.306 18.423 92.157 1.00 13.18 O ATOM 1241 CB SER A 161 -4.736 16.178 93.037 1.00 11.22 C ATOM 1242 OG SER A 161 -4.330 14.823 93.148 1.00 10.66 O ATOM 0 H SER A 161 -2.990 16.421 91.211 1.00 11.47 H new ATOM 0 HA SER A 161 -5.643 16.055 91.143 1.00 11.52 H new ATOM 0 HB2 SER A 161 -4.070 16.755 93.443 1.00 11.22 H new ATOM 0 HB3 SER A 161 -5.564 16.314 93.524 1.00 11.22 H new ATOM 0 HG SER A 161 -3.511 14.761 92.973 1.00 10.66 H new ATOM 1243 N TYR A 162 -4.708 18.803 90.622 1.00 13.11 N ATOM 1244 CA TYR A 162 -5.037 20.218 90.453 1.00 13.25 C ATOM 1245 C TYR A 162 -5.226 20.457 88.952 1.00 12.92 C ATOM 1246 O TYR A 162 -4.497 19.897 88.141 1.00 12.67 O ATOM 1247 CB TYR A 162 -3.892 21.080 91.012 1.00 14.12 C ATOM 1248 CG TYR A 162 -4.167 22.567 91.003 1.00 14.31 C ATOM 1249 CD1 TYR A 162 -3.685 23.381 89.977 1.00 13.61 C ATOM 1250 CD2 TYR A 162 -4.937 23.153 92.001 1.00 15.61 C ATOM 1251 CE1 TYR A 162 -3.973 24.741 89.947 1.00 14.84 C ATOM 1252 CE2 TYR A 162 -5.230 24.522 91.982 1.00 15.10 C ATOM 1253 CZ TYR A 162 -4.744 25.301 90.949 1.00 14.79 C ATOM 1254 OH TYR A 162 -5.029 26.648 90.928 1.00 18.04 O ATOM 0 H TYR A 162 -4.058 18.531 90.130 1.00 13.11 H new ATOM 0 HA TYR A 162 -5.846 20.458 90.932 1.00 13.25 H new ATOM 0 HB2 TYR A 162 -3.708 20.802 91.923 1.00 14.12 H new ATOM 0 HB3 TYR A 162 -3.090 20.907 90.495 1.00 14.12 H new ATOM 0 HD1 TYR A 162 -3.163 23.008 89.303 1.00 13.61 H new ATOM 0 HD2 TYR A 162 -5.264 22.626 92.694 1.00 15.61 H new ATOM 0 HE1 TYR A 162 -3.648 25.272 89.256 1.00 14.84 H new ATOM 0 HE2 TYR A 162 -5.745 24.902 92.656 1.00 15.10 H new ATOM 0 HH TYR A 162 -4.380 27.077 91.244 1.00 18.04 H new ATOM 1255 N PRO A 163 -6.210 21.294 88.567 1.00 14.37 N ATOM 1256 CA PRO A 163 -6.445 21.552 87.142 1.00 15.04 C ATOM 1257 C PRO A 163 -5.209 22.075 86.411 1.00 13.54 C ATOM 1258 O PRO A 163 -4.623 23.077 86.817 1.00 13.80 O ATOM 1259 CB PRO A 163 -7.581 22.577 87.158 1.00 15.88 C ATOM 1260 CG PRO A 163 -8.293 22.299 88.459 1.00 17.53 C ATOM 1261 CD PRO A 163 -7.143 22.068 89.405 1.00 14.84 C ATOM 0 HA PRO A 163 -6.664 20.742 86.655 1.00 15.04 H new ATOM 0 HB2 PRO A 163 -7.242 23.485 87.124 1.00 15.88 H new ATOM 0 HB3 PRO A 163 -8.172 22.466 86.397 1.00 15.88 H new ATOM 0 HG2 PRO A 163 -8.846 23.046 88.736 1.00 17.53 H new ATOM 0 HG3 PRO A 163 -8.873 21.524 88.397 1.00 17.53 H new ATOM 0 HD2 PRO A 163 -6.751 22.901 89.711 1.00 14.84 H new ATOM 0 HD3 PRO A 163 -7.416 21.576 90.195 1.00 14.84 H new ATOM 1262 N ASN A 164 -4.824 21.381 85.343 1.00 13.84 N ATOM 1263 CA ASN A 164 -3.661 21.759 84.531 1.00 14.00 C ATOM 1264 C ASN A 164 -2.366 21.782 85.334 1.00 14.27 C ATOM 1265 O ASN A 164 -1.396 22.449 84.971 1.00 14.75 O ATOM 1266 CB ASN A 164 -3.886 23.126 83.883 1.00 16.34 C ATOM 1267 CG ASN A 164 -5.094 23.139 82.978 1.00 18.58 C ATOM 1268 OD1 ASN A 164 -5.305 22.214 82.198 1.00 21.25 O ATOM 1269 ND2 ASN A 164 -5.898 24.184 83.082 1.00 22.38 N ATOM 0 H ASN A 164 -5.229 20.675 85.065 1.00 13.84 H new ATOM 0 HA ASN A 164 -3.567 21.079 83.846 1.00 14.00 H new ATOM 0 HB2 ASN A 164 -3.996 23.796 84.576 1.00 16.34 H new ATOM 0 HB3 ASN A 164 -3.099 23.373 83.372 1.00 16.34 H new ATOM 0 HD21 ASN A 164 -6.602 24.235 82.591 1.00 22.38 H new ATOM 0 HD22 ASN A 164 -5.716 24.812 83.640 1.00 22.38 H new ATOM 1270 N GLY A 165 -2.344 21.014 86.413 1.00 12.81 N ATOM 1271 CA GLY A 165 -1.156 20.979 87.247 1.00 11.56 C ATOM 1272 C GLY A 165 0.132 20.645 86.515 1.00 11.02 C ATOM 1273 O GLY A 165 1.146 21.308 86.729 1.00 11.44 O ATOM 0 H GLY A 165 -2.993 20.515 86.676 1.00 12.81 H new ATOM 0 HA2 GLY A 165 -1.053 21.842 87.677 1.00 11.56 H new ATOM 0 HA3 GLY A 165 -1.291 20.326 87.951 1.00 11.56 H new ATOM 1274 N GLU A 166 0.120 19.622 85.664 1.00 11.66 N ATOM 1275 CA GLU A 166 1.337 19.246 84.959 1.00 13.35 C ATOM 1276 C GLU A 166 1.765 20.315 83.965 1.00 12.67 C ATOM 1277 O GLU A 166 2.952 20.611 83.853 1.00 12.10 O ATOM 1278 CB GLU A 166 1.191 17.903 84.227 1.00 16.54 C ATOM 1279 CG GLU A 166 2.557 17.340 83.807 1.00 20.23 C ATOM 1280 CD GLU A 166 2.498 16.010 83.069 1.00 22.00 C ATOM 1281 OE1 GLU A 166 1.404 15.422 82.958 1.00 23.95 O ATOM 1282 OE2 GLU A 166 3.572 15.558 82.604 1.00 24.62 O ATOM 0 H GLU A 166 -0.570 19.142 85.484 1.00 11.66 H new ATOM 0 HA GLU A 166 2.022 19.154 85.640 1.00 13.35 H new ATOM 0 HB2 GLU A 166 0.741 17.266 84.804 1.00 16.54 H new ATOM 0 HB3 GLU A 166 0.633 18.020 83.442 1.00 16.54 H new ATOM 0 HG2 GLU A 166 3.001 17.991 83.241 1.00 20.23 H new ATOM 0 HG3 GLU A 166 3.106 17.232 84.599 1.00 20.23 H new ATOM 1283 N ALA A 167 0.804 20.877 83.237 1.00 12.76 N ATOM 1284 CA ALA A 167 1.111 21.936 82.271 1.00 11.56 C ATOM 1285 C ALA A 167 1.704 23.154 82.981 1.00 10.96 C ATOM 1286 O ALA A 167 2.667 23.749 82.501 1.00 12.17 O ATOM 1287 CB ALA A 167 -0.148 22.332 81.504 1.00 12.39 C ATOM 0 H ALA A 167 -0.028 20.663 83.284 1.00 12.76 H new ATOM 0 HA ALA A 167 1.767 21.598 81.641 1.00 11.56 H new ATOM 0 HB1 ALA A 167 0.067 23.033 80.868 1.00 12.39 H new ATOM 0 HB2 ALA A 167 -0.494 21.560 81.029 1.00 12.39 H new ATOM 0 HB3 ALA A 167 -0.818 22.655 82.126 1.00 12.39 H new ATOM 1288 N LEU A 168 1.142 23.529 84.126 1.00 10.61 N ATOM 1289 CA LEU A 168 1.653 24.670 84.870 1.00 10.13 C ATOM 1290 C LEU A 168 3.068 24.404 85.415 1.00 9.35 C ATOM 1291 O LEU A 168 3.915 25.303 85.440 1.00 10.39 O ATOM 1292 CB LEU A 168 0.699 25.015 86.023 1.00 11.32 C ATOM 1293 CG LEU A 168 -0.598 25.677 85.550 1.00 12.02 C ATOM 1294 CD1 LEU A 168 -1.587 25.775 86.710 1.00 13.44 C ATOM 1295 CD2 LEU A 168 -0.275 27.065 85.001 1.00 14.44 C ATOM 0 H LEU A 168 0.467 23.137 84.486 1.00 10.61 H new ATOM 0 HA LEU A 168 1.708 25.422 84.260 1.00 10.13 H new ATOM 0 HB2 LEU A 168 0.483 24.205 86.511 1.00 11.32 H new ATOM 0 HB3 LEU A 168 1.151 25.608 86.644 1.00 11.32 H new ATOM 0 HG LEU A 168 -1.004 25.143 84.850 1.00 12.02 H new ATOM 0 HD11 LEU A 168 -2.406 26.195 86.403 1.00 13.44 H new ATOM 0 HD12 LEU A 168 -1.785 24.886 87.042 1.00 13.44 H new ATOM 0 HD13 LEU A 168 -1.199 26.307 87.422 1.00 13.44 H new ATOM 0 HD21 LEU A 168 -1.092 27.492 84.699 1.00 14.44 H new ATOM 0 HD22 LEU A 168 0.131 27.603 85.699 1.00 14.44 H new ATOM 0 HD23 LEU A 168 0.341 26.983 84.256 1.00 14.44 H new ATOM 1296 N LEU A 169 3.323 23.169 85.852 1.00 9.46 N ATOM 1297 CA LEU A 169 4.641 22.808 86.373 1.00 9.62 C ATOM 1298 C LEU A 169 5.662 22.959 85.236 1.00 9.51 C ATOM 1299 O LEU A 169 6.750 23.521 85.419 1.00 10.41 O ATOM 1300 CB LEU A 169 4.608 21.361 86.887 1.00 10.52 C ATOM 1301 CG LEU A 169 5.909 20.776 87.444 1.00 8.64 C ATOM 1302 CD1 LEU A 169 6.389 21.618 88.622 1.00 11.06 C ATOM 1303 CD2 LEU A 169 5.676 19.329 87.868 1.00 10.50 C ATOM 0 H LEU A 169 2.749 22.529 85.855 1.00 9.46 H new ATOM 0 HA LEU A 169 4.891 23.386 87.111 1.00 9.62 H new ATOM 0 HB2 LEU A 169 3.934 21.306 87.582 1.00 10.52 H new ATOM 0 HB3 LEU A 169 4.312 20.792 86.159 1.00 10.52 H new ATOM 0 HG LEU A 169 6.595 20.790 86.759 1.00 8.64 H new ATOM 0 HD11 LEU A 169 7.213 21.245 88.972 1.00 11.06 H new ATOM 0 HD12 LEU A 169 6.547 22.528 88.326 1.00 11.06 H new ATOM 0 HD13 LEU A 169 5.713 21.617 89.317 1.00 11.06 H new ATOM 0 HD21 LEU A 169 6.500 18.958 88.221 1.00 10.50 H new ATOM 0 HD22 LEU A 169 4.989 19.299 88.552 1.00 10.50 H new ATOM 0 HD23 LEU A 169 5.390 18.809 87.101 1.00 10.50 H new ATOM 1304 N GLU A 170 5.314 22.463 84.053 1.00 10.62 N ATOM 1305 CA GLU A 170 6.229 22.587 82.928 1.00 10.57 C ATOM 1306 C GLU A 170 6.391 24.046 82.499 1.00 10.43 C ATOM 1307 O GLU A 170 7.505 24.459 82.148 1.00 10.01 O ATOM 1308 CB GLU A 170 5.762 21.725 81.756 1.00 10.97 C ATOM 1309 CG GLU A 170 6.755 21.775 80.585 1.00 11.29 C ATOM 1310 CD GLU A 170 6.594 20.641 79.590 1.00 13.16 C ATOM 1311 OE1 GLU A 170 7.464 20.525 78.703 1.00 13.14 O ATOM 1312 OE2 GLU A 170 5.618 19.861 79.683 1.00 14.35 O ATOM 0 H GLU A 170 4.573 22.061 83.884 1.00 10.62 H new ATOM 0 HA GLU A 170 7.098 22.267 83.216 1.00 10.57 H new ATOM 0 HB2 GLU A 170 5.655 20.807 82.051 1.00 10.97 H new ATOM 0 HB3 GLU A 170 4.891 22.030 81.456 1.00 10.97 H new ATOM 0 HG2 GLU A 170 6.649 22.619 80.119 1.00 11.29 H new ATOM 0 HG3 GLU A 170 7.658 21.757 80.938 1.00 11.29 H new ATOM 1313 N GLU A 171 5.304 24.815 82.540 1.00 9.52 N ATOM 1314 CA GLU A 171 5.377 26.232 82.176 1.00 9.54 C ATOM 1315 C GLU A 171 6.382 26.922 83.109 1.00 9.29 C ATOM 1316 O GLU A 171 7.198 27.732 82.672 1.00 9.78 O ATOM 1317 CB GLU A 171 3.996 26.890 82.291 1.00 9.24 C ATOM 1318 CG GLU A 171 3.994 28.362 81.852 1.00 11.79 C ATOM 1319 CD GLU A 171 2.618 29.004 81.897 1.00 14.58 C ATOM 1320 OE1 GLU A 171 2.516 30.201 81.563 1.00 16.19 O ATOM 1321 OE2 GLU A 171 1.630 28.328 82.261 1.00 14.71 O ATOM 0 H GLU A 171 4.523 24.541 82.773 1.00 9.52 H new ATOM 0 HA GLU A 171 5.669 26.320 81.255 1.00 9.54 H new ATOM 0 HB2 GLU A 171 3.361 26.395 81.749 1.00 9.24 H new ATOM 0 HB3 GLU A 171 3.691 26.831 83.210 1.00 9.24 H new ATOM 0 HG2 GLU A 171 4.596 28.864 82.423 1.00 11.79 H new ATOM 0 HG3 GLU A 171 4.343 28.424 80.949 1.00 11.79 H new ATOM 1322 N ALA A 172 6.336 26.590 84.399 1.00 9.87 N ATOM 1323 CA ALA A 172 7.261 27.177 85.361 1.00 9.28 C ATOM 1324 C ALA A 172 8.720 26.859 85.016 1.00 9.07 C ATOM 1325 O ALA A 172 9.601 27.707 85.194 1.00 10.01 O ATOM 1326 CB ALA A 172 6.927 26.688 86.778 1.00 10.73 C ATOM 0 H ALA A 172 5.778 26.028 84.734 1.00 9.87 H new ATOM 0 HA ALA A 172 7.157 28.141 85.322 1.00 9.28 H new ATOM 0 HB1 ALA A 172 7.547 27.083 87.411 1.00 10.73 H new ATOM 0 HB2 ALA A 172 6.021 26.950 87.006 1.00 10.73 H new ATOM 0 HB3 ALA A 172 7.002 25.722 86.813 1.00 10.73 H new ATOM 1327 N LEU A 173 8.980 25.648 84.532 1.00 9.73 N ATOM 1328 CA LEU A 173 10.334 25.287 84.126 1.00 10.72 C ATOM 1329 C LEU A 173 10.724 26.074 82.874 1.00 11.08 C ATOM 1330 O LEU A 173 11.864 26.534 82.756 1.00 10.59 O ATOM 1331 CB LEU A 173 10.438 23.789 83.846 1.00 10.51 C ATOM 1332 CG LEU A 173 10.129 22.887 85.056 1.00 10.36 C ATOM 1333 CD1 LEU A 173 10.260 21.434 84.627 1.00 11.65 C ATOM 1334 CD2 LEU A 173 11.071 23.187 86.203 1.00 12.03 C ATOM 0 H LEU A 173 8.394 25.027 84.431 1.00 9.73 H new ATOM 0 HA LEU A 173 10.940 25.506 84.851 1.00 10.72 H new ATOM 0 HB2 LEU A 173 9.829 23.564 83.126 1.00 10.51 H new ATOM 0 HB3 LEU A 173 11.334 23.592 83.531 1.00 10.51 H new ATOM 0 HG LEU A 173 9.225 23.058 85.364 1.00 10.36 H new ATOM 0 HD11 LEU A 173 10.068 20.855 85.381 1.00 11.65 H new ATOM 0 HD12 LEU A 173 9.633 21.250 83.910 1.00 11.65 H new ATOM 0 HD13 LEU A 173 11.164 21.269 84.315 1.00 11.65 H new ATOM 0 HD21 LEU A 173 10.861 22.610 86.954 1.00 12.03 H new ATOM 0 HD22 LEU A 173 11.986 23.029 85.921 1.00 12.03 H new ATOM 0 HD23 LEU A 173 10.971 24.114 86.470 1.00 12.03 H new ATOM 1335 N ARG A 174 9.783 26.232 81.943 1.00 10.26 N ATOM 1336 CA ARG A 174 10.072 26.990 80.716 1.00 10.53 C ATOM 1337 C ARG A 174 10.362 28.457 81.044 1.00 10.64 C ATOM 1338 O ARG A 174 11.095 29.128 80.316 1.00 11.47 O ATOM 1339 CB ARG A 174 8.910 26.837 79.727 1.00 10.27 C ATOM 1340 CG ARG A 174 8.876 25.424 79.138 1.00 11.12 C ATOM 1341 CD ARG A 174 7.883 25.217 77.996 1.00 13.22 C ATOM 1342 NE ARG A 174 6.490 25.264 78.424 1.00 13.79 N ATOM 1343 CZ ARG A 174 5.729 26.353 78.369 1.00 13.94 C ATOM 1344 NH1 ARG A 174 4.466 26.303 78.776 1.00 14.09 N ATOM 1345 NH2 ARG A 174 6.232 27.498 77.907 1.00 14.20 N ATOM 0 H ARG A 174 8.985 25.917 81.996 1.00 10.26 H new ATOM 0 HA ARG A 174 10.869 26.632 80.295 1.00 10.53 H new ATOM 0 HB2 ARG A 174 8.071 27.024 80.176 1.00 10.27 H new ATOM 0 HB3 ARG A 174 9.001 27.487 79.013 1.00 10.27 H new ATOM 0 HG2 ARG A 174 9.764 25.201 78.819 1.00 11.12 H new ATOM 0 HG3 ARG A 174 8.664 24.798 79.848 1.00 11.12 H new ATOM 0 HD2 ARG A 174 8.030 25.898 77.321 1.00 13.22 H new ATOM 0 HD3 ARG A 174 8.057 24.360 77.577 1.00 13.22 H new ATOM 0 HE ARG A 174 6.138 24.542 78.731 1.00 13.79 H new ATOM 0 HH11 ARG A 174 4.140 25.566 79.075 1.00 14.09 H new ATOM 0 HH12 ARG A 174 3.974 27.008 78.740 1.00 14.09 H new ATOM 0 HH21 ARG A 174 7.050 27.533 77.644 1.00 14.20 H new ATOM 0 HH22 ARG A 174 5.738 28.201 77.872 1.00 14.20 H new ATOM 1346 N LEU A 175 9.811 28.960 82.144 1.00 9.55 N ATOM 1347 CA LEU A 175 10.071 30.326 82.570 1.00 9.81 C ATOM 1348 C LEU A 175 11.383 30.463 83.330 1.00 9.49 C ATOM 1349 O LEU A 175 11.810 31.581 83.636 1.00 11.73 O ATOM 1350 CB LEU A 175 8.922 30.853 83.425 1.00 10.59 C ATOM 1351 CG LEU A 175 7.637 31.114 82.631 1.00 9.68 C ATOM 1352 CD1 LEU A 175 6.452 31.285 83.573 1.00 11.34 C ATOM 1353 CD2 LEU A 175 7.826 32.382 81.774 1.00 10.79 C ATOM 0 H LEU A 175 9.280 28.521 82.659 1.00 9.55 H new ATOM 0 HA LEU A 175 10.145 30.857 81.762 1.00 9.81 H new ATOM 0 HB2 LEU A 175 8.734 30.214 84.130 1.00 10.59 H new ATOM 0 HB3 LEU A 175 9.200 31.676 83.856 1.00 10.59 H new ATOM 0 HG LEU A 175 7.455 30.355 82.055 1.00 9.68 H new ATOM 0 HD11 LEU A 175 5.648 31.449 83.056 1.00 11.34 H new ATOM 0 HD12 LEU A 175 6.338 30.478 84.100 1.00 11.34 H new ATOM 0 HD13 LEU A 175 6.614 32.036 84.164 1.00 11.34 H new ATOM 0 HD21 LEU A 175 7.017 32.554 81.268 1.00 10.79 H new ATOM 0 HD22 LEU A 175 8.013 33.138 82.352 1.00 10.79 H new ATOM 0 HD23 LEU A 175 8.568 32.252 81.162 1.00 10.79 H new ATOM 1354 N GLY A 176 12.001 29.329 83.675 1.00 9.64 N ATOM 1355 CA GLY A 176 13.288 29.381 84.346 1.00 9.96 C ATOM 1356 C GLY A 176 13.446 28.793 85.729 1.00 10.27 C ATOM 1357 O GLY A 176 14.511 28.960 86.329 1.00 11.98 O ATOM 0 H GLY A 176 11.694 28.539 83.530 1.00 9.64 H new ATOM 0 HA2 GLY A 176 13.931 28.939 83.770 1.00 9.96 H new ATOM 0 HA3 GLY A 176 13.548 30.314 84.398 1.00 9.96 H new ATOM 1358 N ALA A 177 12.429 28.132 86.267 1.00 9.96 N ATOM 1359 CA ALA A 177 12.615 27.551 87.598 1.00 9.82 C ATOM 1360 C ALA A 177 13.760 26.539 87.528 1.00 9.27 C ATOM 1361 O ALA A 177 13.876 25.779 86.569 1.00 10.69 O ATOM 1362 CB ALA A 177 11.331 26.888 88.072 1.00 10.46 C ATOM 0 H ALA A 177 11.659 28.010 85.904 1.00 9.96 H new ATOM 0 HA ALA A 177 12.836 28.247 88.237 1.00 9.82 H new ATOM 0 HB1 ALA A 177 11.469 26.508 88.954 1.00 10.46 H new ATOM 0 HB2 ALA A 177 10.621 27.548 88.112 1.00 10.46 H new ATOM 0 HB3 ALA A 177 11.082 26.184 87.453 1.00 10.46 H new ATOM 1363 N ASP A 178 14.588 26.516 88.575 1.00 8.95 N ATOM 1364 CA ASP A 178 15.770 25.666 88.635 1.00 10.06 C ATOM 1365 C ASP A 178 15.538 24.239 89.066 1.00 9.14 C ATOM 1366 O ASP A 178 16.329 23.345 88.757 1.00 9.05 O ATOM 1367 CB ASP A 178 16.774 26.267 89.620 1.00 9.86 C ATOM 1368 CG ASP A 178 17.089 27.715 89.323 1.00 11.79 C ATOM 1369 OD1 ASP A 178 17.775 27.953 88.309 1.00 13.57 O ATOM 1370 OD2 ASP A 178 16.661 28.607 90.084 1.00 11.59 O ATOM 0 H ASP A 178 14.474 27.001 89.276 1.00 8.95 H new ATOM 0 HA ASP A 178 16.088 25.635 87.719 1.00 10.06 H new ATOM 0 HB2 ASP A 178 16.420 26.195 90.520 1.00 9.86 H new ATOM 0 HB3 ASP A 178 17.594 25.750 89.595 1.00 9.86 H new ATOM 1371 N VAL A 179 14.446 24.040 89.784 1.00 9.21 N ATOM 1372 CA VAL A 179 14.169 22.735 90.379 1.00 9.35 C ATOM 1373 C VAL A 179 12.712 22.347 90.180 1.00 8.60 C ATOM 1374 O VAL A 179 11.828 23.204 90.244 1.00 9.56 O ATOM 1375 CB VAL A 179 14.456 22.801 91.921 1.00 8.82 C ATOM 1376 CG1 VAL A 179 14.421 21.413 92.542 1.00 9.62 C ATOM 1377 CG2 VAL A 179 15.802 23.478 92.191 1.00 9.98 C ATOM 0 H VAL A 179 13.852 24.642 89.941 1.00 9.21 H new ATOM 0 HA VAL A 179 14.736 22.076 89.949 1.00 9.35 H new ATOM 0 HB VAL A 179 13.757 23.333 92.333 1.00 8.82 H new ATOM 0 HG11 VAL A 179 14.601 21.479 93.493 1.00 9.62 H new ATOM 0 HG12 VAL A 179 13.545 21.019 92.405 1.00 9.62 H new ATOM 0 HG13 VAL A 179 15.095 20.854 92.124 1.00 9.62 H new ATOM 0 HG21 VAL A 179 15.962 23.510 93.147 1.00 9.98 H new ATOM 0 HG22 VAL A 179 16.510 22.973 91.761 1.00 9.98 H new ATOM 0 HG23 VAL A 179 15.788 24.380 91.836 1.00 9.98 H new ATOM 1378 N VAL A 180 12.475 21.062 89.934 1.00 9.17 N ATOM 1379 CA VAL A 180 11.119 20.538 89.767 1.00 9.20 C ATOM 1380 C VAL A 180 10.650 19.994 91.120 1.00 8.86 C ATOM 1381 O VAL A 180 11.342 19.167 91.736 1.00 9.46 O ATOM 1382 CB VAL A 180 11.058 19.360 88.753 1.00 8.53 C ATOM 1383 CG1 VAL A 180 9.612 19.123 88.329 1.00 9.68 C ATOM 1384 CG2 VAL A 180 11.945 19.630 87.544 1.00 10.72 C ATOM 0 H VAL A 180 13.093 20.469 89.859 1.00 9.17 H new ATOM 0 HA VAL A 180 10.562 21.260 89.436 1.00 9.20 H new ATOM 0 HB VAL A 180 11.394 18.559 89.184 1.00 8.53 H new ATOM 0 HG11 VAL A 180 9.576 18.388 87.697 1.00 9.68 H new ATOM 0 HG12 VAL A 180 9.078 18.905 89.109 1.00 9.68 H new ATOM 0 HG13 VAL A 180 9.261 19.925 87.912 1.00 9.68 H new ATOM 0 HG21 VAL A 180 11.890 18.883 86.928 1.00 10.72 H new ATOM 0 HG22 VAL A 180 11.647 20.438 87.098 1.00 10.72 H new ATOM 0 HG23 VAL A 180 12.864 19.741 87.835 1.00 10.72 H new ATOM 1385 N GLY A 181 9.480 20.447 91.565 1.00 8.31 N ATOM 1386 CA GLY A 181 8.913 19.967 92.821 1.00 8.83 C ATOM 1387 C GLY A 181 7.747 19.011 92.612 1.00 8.49 C ATOM 1388 O GLY A 181 7.293 18.807 91.489 1.00 10.01 O ATOM 0 H GLY A 181 9.000 21.031 91.155 1.00 8.31 H new ATOM 0 HA2 GLY A 181 9.605 19.520 93.334 1.00 8.83 H new ATOM 0 HA3 GLY A 181 8.614 20.725 93.347 1.00 8.83 H new ATOM 1389 N ALA A 182 7.266 18.428 93.711 1.00 9.19 N ATOM 1390 CA ALA A 182 6.129 17.512 93.702 1.00 9.19 C ATOM 1391 C ALA A 182 5.677 17.398 95.154 1.00 9.05 C ATOM 1392 O ALA A 182 6.376 17.850 96.063 1.00 9.46 O ATOM 1393 CB ALA A 182 6.528 16.132 93.160 1.00 9.77 C ATOM 0 H ALA A 182 7.598 18.557 94.494 1.00 9.19 H new ATOM 0 HA ALA A 182 5.422 17.842 93.125 1.00 9.19 H new ATOM 0 HB1 ALA A 182 5.755 15.546 93.166 1.00 9.77 H new ATOM 0 HB2 ALA A 182 6.857 16.223 92.252 1.00 9.77 H new ATOM 0 HB3 ALA A 182 7.224 15.753 93.719 1.00 9.77 H new ATOM 1394 N ILE A 183 4.515 16.793 95.370 1.00 8.59 N ATOM 1395 CA ILE A 183 3.961 16.621 96.724 1.00 8.69 C ATOM 1396 C ILE A 183 3.044 15.381 96.654 1.00 8.79 C ATOM 1397 O ILE A 183 1.820 15.452 96.821 1.00 8.45 O ATOM 1398 CB ILE A 183 3.211 17.918 97.143 1.00 7.52 C ATOM 1399 CG1 ILE A 183 2.777 17.808 98.608 1.00 9.25 C ATOM 1400 CG2 ILE A 183 2.059 18.229 96.170 1.00 9.78 C ATOM 1401 CD1 ILE A 183 2.162 19.099 99.152 1.00 11.26 C ATOM 0 H ILE A 183 4.022 16.469 94.744 1.00 8.59 H new ATOM 0 HA ILE A 183 4.642 16.478 97.400 1.00 8.69 H new ATOM 0 HB ILE A 183 3.807 18.681 97.083 1.00 7.52 H new ATOM 0 HG12 ILE A 183 2.133 17.088 98.695 1.00 9.25 H new ATOM 0 HG13 ILE A 183 3.545 17.569 99.150 1.00 9.25 H new ATOM 0 HG21 ILE A 183 1.608 19.040 96.451 1.00 9.78 H new ATOM 0 HG22 ILE A 183 2.414 18.351 95.276 1.00 9.78 H new ATOM 0 HG23 ILE A 183 1.428 17.492 96.169 1.00 9.78 H new ATOM 0 HD11 ILE A 183 1.907 18.971 100.079 1.00 11.26 H new ATOM 0 HD12 ILE A 183 2.811 19.817 99.092 1.00 11.26 H new ATOM 0 HD13 ILE A 183 1.377 19.329 98.630 1.00 11.26 H new ATOM 1402 N PRO A 184 3.659 14.200 96.454 1.00 8.67 N ATOM 1403 CA PRO A 184 2.879 12.968 96.324 1.00 9.05 C ATOM 1404 C PRO A 184 1.857 12.615 97.384 1.00 8.17 C ATOM 1405 O PRO A 184 0.788 12.113 97.040 1.00 8.97 O ATOM 1406 CB PRO A 184 3.951 11.885 96.114 1.00 9.21 C ATOM 1407 CG PRO A 184 5.154 12.437 96.791 1.00 9.07 C ATOM 1408 CD PRO A 184 5.106 13.915 96.436 1.00 9.68 C ATOM 0 HA PRO A 184 2.254 13.076 95.590 1.00 9.05 H new ATOM 0 HB2 PRO A 184 3.682 11.038 96.502 1.00 9.21 H new ATOM 0 HB3 PRO A 184 4.115 11.725 95.171 1.00 9.21 H new ATOM 0 HG2 PRO A 184 5.121 12.298 97.750 1.00 9.07 H new ATOM 0 HG3 PRO A 184 5.969 12.018 96.472 1.00 9.07 H new ATOM 0 HD2 PRO A 184 5.589 14.457 97.079 1.00 9.68 H new ATOM 0 HD3 PRO A 184 5.498 14.091 95.566 1.00 9.68 H new ATOM 1409 N HIS A 185 2.163 12.874 98.650 1.00 8.43 N ATOM 1410 CA HIS A 185 1.229 12.561 99.728 1.00 9.21 C ATOM 1411 C HIS A 185 -0.002 13.464 99.732 1.00 10.53 C ATOM 1412 O HIS A 185 -0.954 13.193 100.459 1.00 12.51 O ATOM 1413 CB HIS A 185 1.930 12.666 101.090 1.00 10.05 C ATOM 1414 CG HIS A 185 2.585 13.994 101.320 1.00 11.42 C ATOM 1415 ND1 HIS A 185 3.769 14.344 100.705 1.00 13.76 N ATOM 1416 CD2 HIS A 185 2.175 15.088 102.001 1.00 14.98 C ATOM 1417 CE1 HIS A 185 4.055 15.601 100.996 1.00 13.49 C ATOM 1418 NE2 HIS A 185 3.101 16.075 101.779 1.00 12.91 N ATOM 0 H HIS A 185 2.903 13.229 98.907 1.00 8.43 H new ATOM 0 HA HIS A 185 0.928 11.652 99.571 1.00 9.21 H new ATOM 0 HB2 HIS A 185 1.281 12.506 101.793 1.00 10.05 H new ATOM 0 HB3 HIS A 185 2.599 11.967 101.157 1.00 10.05 H new ATOM 0 HD1 HIS A 185 4.246 13.826 100.211 1.00 13.76 H new ATOM 0 HD2 HIS A 185 1.408 15.158 102.523 1.00 14.98 H new ATOM 0 HE1 HIS A 185 4.800 16.072 100.700 1.00 13.49 H new ATOM 1419 N PHE A 186 0.005 14.543 98.955 1.00 8.75 N ATOM 1420 CA PHE A 186 -1.163 15.431 98.904 1.00 9.77 C ATOM 1421 C PHE A 186 -2.038 15.095 97.693 1.00 9.01 C ATOM 1422 O PHE A 186 -3.151 15.600 97.581 1.00 10.54 O ATOM 1423 CB PHE A 186 -0.722 16.905 98.858 1.00 9.73 C ATOM 1424 CG PHE A 186 -1.828 17.900 99.150 1.00 10.47 C ATOM 1425 CD1 PHE A 186 -2.332 18.058 100.443 1.00 12.28 C ATOM 1426 CD2 PHE A 186 -2.343 18.704 98.134 1.00 11.40 C ATOM 1427 CE1 PHE A 186 -3.328 19.009 100.717 1.00 12.28 C ATOM 1428 CE2 PHE A 186 -3.341 19.656 98.406 1.00 12.24 C ATOM 1429 CZ PHE A 186 -3.829 19.803 99.704 1.00 13.08 C ATOM 0 H PHE A 186 0.663 14.780 98.455 1.00 8.75 H new ATOM 0 HA PHE A 186 -1.686 15.294 99.709 1.00 9.77 H new ATOM 0 HB2 PHE A 186 -0.006 17.037 99.499 1.00 9.73 H new ATOM 0 HB3 PHE A 186 -0.355 17.094 97.980 1.00 9.73 H new ATOM 0 HD1 PHE A 186 -2.004 17.526 101.132 1.00 12.28 H new ATOM 0 HD2 PHE A 186 -2.023 18.609 97.266 1.00 11.40 H new ATOM 0 HE1 PHE A 186 -3.652 19.105 101.584 1.00 12.28 H new ATOM 0 HE2 PHE A 186 -3.676 20.188 97.720 1.00 12.24 H new ATOM 0 HZ PHE A 186 -4.489 20.433 99.887 1.00 13.08 H new ATOM 1430 N GLU A 187 -1.540 14.255 96.780 1.00 8.86 N ATOM 1431 CA GLU A 187 -2.341 13.844 95.628 1.00 9.46 C ATOM 1432 C GLU A 187 -3.543 13.034 96.149 1.00 8.90 C ATOM 1433 O GLU A 187 -3.502 12.431 97.231 1.00 9.65 O ATOM 1434 CB GLU A 187 -1.514 12.984 94.668 1.00 9.40 C ATOM 1435 CG GLU A 187 -0.275 13.661 94.066 1.00 9.06 C ATOM 1436 CD GLU A 187 -0.550 14.681 92.966 1.00 9.38 C ATOM 1437 OE1 GLU A 187 0.443 15.279 92.500 1.00 10.50 O ATOM 1438 OE2 GLU A 187 -1.712 14.882 92.555 1.00 10.28 O ATOM 0 H GLU A 187 -0.750 13.917 96.810 1.00 8.86 H new ATOM 0 HA GLU A 187 -2.640 14.629 95.142 1.00 9.46 H new ATOM 0 HB2 GLU A 187 -1.229 12.186 95.139 1.00 9.40 H new ATOM 0 HB3 GLU A 187 -2.089 12.695 93.942 1.00 9.40 H new ATOM 0 HG2 GLU A 187 0.211 14.102 94.780 1.00 9.06 H new ATOM 0 HG3 GLU A 187 0.308 12.973 93.709 1.00 9.06 H new ATOM 1439 N PHE A 188 -4.620 13.020 95.374 1.00 9.55 N ATOM 1440 CA PHE A 188 -5.827 12.335 95.793 1.00 9.31 C ATOM 1441 C PHE A 188 -5.652 10.862 96.108 1.00 8.78 C ATOM 1442 O PHE A 188 -6.332 10.339 96.992 1.00 9.56 O ATOM 1443 CB PHE A 188 -6.914 12.454 94.713 1.00 9.07 C ATOM 1444 CG PHE A 188 -7.450 13.861 94.498 1.00 9.53 C ATOM 1445 CD1 PHE A 188 -7.365 14.842 95.480 1.00 10.49 C ATOM 1446 CD2 PHE A 188 -8.120 14.162 93.310 1.00 12.08 C ATOM 1447 CE1 PHE A 188 -7.944 16.103 95.284 1.00 11.67 C ATOM 1448 CE2 PHE A 188 -8.699 15.421 93.110 1.00 12.83 C ATOM 1449 CZ PHE A 188 -8.608 16.389 94.099 1.00 12.88 C ATOM 0 H PHE A 188 -4.670 13.401 94.604 1.00 9.55 H new ATOM 0 HA PHE A 188 -6.080 12.778 96.618 1.00 9.31 H new ATOM 0 HB2 PHE A 188 -6.555 12.127 93.873 1.00 9.07 H new ATOM 0 HB3 PHE A 188 -7.653 11.873 94.951 1.00 9.07 H new ATOM 0 HD1 PHE A 188 -6.919 14.659 96.275 1.00 10.49 H new ATOM 0 HD2 PHE A 188 -8.182 13.517 92.643 1.00 12.08 H new ATOM 0 HE1 PHE A 188 -7.883 16.750 95.949 1.00 11.67 H new ATOM 0 HE2 PHE A 188 -9.144 15.608 92.315 1.00 12.83 H new ATOM 0 HZ PHE A 188 -8.990 17.227 93.969 1.00 12.88 H new ATOM 1450 N THR A 189 -4.771 10.183 95.377 1.00 8.62 N ATOM 1451 CA THR A 189 -4.572 8.756 95.590 1.00 9.41 C ATOM 1452 C THR A 189 -3.113 8.375 95.549 1.00 9.51 C ATOM 1453 O THR A 189 -2.277 9.095 95.002 1.00 8.65 O ATOM 1454 CB THR A 189 -5.257 7.905 94.514 1.00 9.98 C ATOM 1455 OG1 THR A 189 -4.596 8.116 93.257 1.00 9.66 O ATOM 1456 CG2 THR A 189 -6.724 8.264 94.381 1.00 8.69 C ATOM 0 H THR A 189 -4.283 10.528 94.758 1.00 8.62 H new ATOM 0 HA THR A 189 -4.955 8.584 96.464 1.00 9.41 H new ATOM 0 HB THR A 189 -5.197 6.972 94.774 1.00 9.98 H new ATOM 0 HG1 THR A 189 -5.081 7.831 92.634 1.00 9.66 H new ATOM 0 HG21 THR A 189 -7.132 7.712 93.695 1.00 8.69 H new ATOM 0 HG22 THR A 189 -7.173 8.111 95.227 1.00 8.69 H new ATOM 0 HG23 THR A 189 -6.808 9.199 94.135 1.00 8.69 H new ATOM 1457 N ARG A 190 -2.821 7.207 96.102 1.00 8.96 N ATOM 1458 CA ARG A 190 -1.465 6.699 96.103 1.00 9.01 C ATOM 1459 C ARG A 190 -0.966 6.564 94.670 1.00 8.55 C ATOM 1460 O ARG A 190 0.208 6.840 94.391 1.00 8.72 O ATOM 1461 CB ARG A 190 -1.426 5.331 96.790 1.00 9.30 C ATOM 1462 CG ARG A 190 -0.023 4.820 97.057 1.00 10.51 C ATOM 1463 CD ARG A 190 -0.055 3.382 97.586 1.00 9.89 C ATOM 1464 NE ARG A 190 1.261 2.989 98.092 1.00 10.57 N ATOM 1465 CZ ARG A 190 2.281 2.589 97.335 1.00 10.84 C ATOM 1466 NH1 ARG A 190 3.437 2.279 97.913 1.00 10.85 N ATOM 1467 NH2 ARG A 190 2.146 2.454 96.019 1.00 10.77 N ATOM 0 H ARG A 190 -3.397 6.694 96.482 1.00 8.96 H new ATOM 0 HA ARG A 190 -0.894 7.317 96.585 1.00 9.01 H new ATOM 0 HB2 ARG A 190 -1.906 5.387 97.631 1.00 9.30 H new ATOM 0 HB3 ARG A 190 -1.896 4.687 96.237 1.00 9.30 H new ATOM 0 HG2 ARG A 190 0.499 4.856 96.240 1.00 10.51 H new ATOM 0 HG3 ARG A 190 0.418 5.396 97.701 1.00 10.51 H new ATOM 0 HD2 ARG A 190 -0.714 3.307 98.293 1.00 9.89 H new ATOM 0 HD3 ARG A 190 -0.328 2.778 96.878 1.00 9.89 H new ATOM 0 HE ARG A 190 1.385 3.019 98.943 1.00 10.57 H new ATOM 0 HH11 ARG A 190 3.520 2.338 98.767 1.00 10.85 H new ATOM 0 HH12 ARG A 190 4.102 2.020 97.433 1.00 10.85 H new ATOM 0 HH21 ARG A 190 1.391 2.626 95.644 1.00 10.77 H new ATOM 0 HH22 ARG A 190 2.813 2.195 95.543 1.00 10.77 H new ATOM 1468 N GLU A 191 -1.850 6.122 93.774 1.00 8.31 N ATOM 1469 CA GLU A 191 -1.483 5.948 92.372 1.00 8.52 C ATOM 1470 C GLU A 191 -1.123 7.291 91.742 1.00 9.17 C ATOM 1471 O GLU A 191 -0.144 7.371 90.999 1.00 9.29 O ATOM 1472 CB GLU A 191 -2.610 5.251 91.597 1.00 8.78 C ATOM 1473 CG GLU A 191 -2.793 3.760 91.963 1.00 9.99 C ATOM 1474 CD GLU A 191 -3.276 3.541 93.404 1.00 10.57 C ATOM 1475 OE1 GLU A 191 -4.134 4.313 93.870 1.00 10.02 O ATOM 1476 OE2 GLU A 191 -2.797 2.587 94.061 1.00 13.73 O ATOM 0 H GLU A 191 -2.665 5.918 93.959 1.00 8.31 H new ATOM 0 HA GLU A 191 -0.699 5.378 92.327 1.00 8.52 H new ATOM 0 HB2 GLU A 191 -3.443 5.720 91.763 1.00 8.78 H new ATOM 0 HB3 GLU A 191 -2.429 5.322 90.647 1.00 8.78 H new ATOM 0 HG2 GLU A 191 -3.430 3.359 91.351 1.00 9.99 H new ATOM 0 HG3 GLU A 191 -1.950 3.297 91.838 1.00 9.99 H new ATOM 1477 N TYR A 192 -1.898 8.337 92.021 1.00 8.62 N ATOM 1478 CA TYR A 192 -1.552 9.670 91.503 1.00 9.81 C ATOM 1479 C TYR A 192 -0.200 10.095 92.097 1.00 9.89 C ATOM 1480 O TYR A 192 0.607 10.744 91.423 1.00 10.48 O ATOM 1481 CB TYR A 192 -2.583 10.727 91.910 1.00 10.35 C ATOM 1482 CG TYR A 192 -3.862 10.787 91.109 1.00 10.51 C ATOM 1483 CD1 TYR A 192 -4.144 9.862 90.102 1.00 12.04 C ATOM 1484 CD2 TYR A 192 -4.810 11.768 91.390 1.00 11.93 C ATOM 1485 CE1 TYR A 192 -5.356 9.924 89.395 1.00 12.99 C ATOM 1486 CE2 TYR A 192 -6.013 11.834 90.700 1.00 12.15 C ATOM 1487 CZ TYR A 192 -6.276 10.912 89.711 1.00 12.67 C ATOM 1488 OH TYR A 192 -7.485 10.966 89.046 1.00 15.02 O ATOM 0 H TYR A 192 -2.614 8.304 92.497 1.00 8.62 H new ATOM 0 HA TYR A 192 -1.525 9.611 90.535 1.00 9.81 H new ATOM 0 HB2 TYR A 192 -2.817 10.577 92.839 1.00 10.35 H new ATOM 0 HB3 TYR A 192 -2.157 11.597 91.862 1.00 10.35 H new ATOM 0 HD1 TYR A 192 -3.524 9.199 89.898 1.00 12.04 H new ATOM 0 HD2 TYR A 192 -4.633 12.393 92.055 1.00 11.93 H new ATOM 0 HE1 TYR A 192 -5.539 9.309 88.722 1.00 12.99 H new ATOM 0 HE2 TYR A 192 -6.635 12.494 90.904 1.00 12.15 H new ATOM 0 HH TYR A 192 -7.954 11.584 89.367 1.00 15.02 H new ATOM 1489 N GLY A 193 0.038 9.760 93.363 1.00 9.16 N ATOM 1490 CA GLY A 193 1.307 10.124 93.965 1.00 8.75 C ATOM 1491 C GLY A 193 2.487 9.511 93.237 1.00 8.49 C ATOM 1492 O GLY A 193 3.471 10.198 92.899 1.00 8.79 O ATOM 0 H GLY A 193 -0.507 9.334 93.874 1.00 9.16 H new ATOM 0 HA2 GLY A 193 1.397 11.090 93.966 1.00 8.75 H new ATOM 0 HA3 GLY A 193 1.317 9.837 94.892 1.00 8.75 H new ATOM 1493 N VAL A 194 2.412 8.211 92.978 1.00 8.27 N ATOM 1494 CA VAL A 194 3.503 7.545 92.283 1.00 9.05 C ATOM 1495 C VAL A 194 3.642 8.083 90.853 1.00 8.81 C ATOM 1496 O VAL A 194 4.753 8.399 90.409 1.00 10.08 O ATOM 1497 CB VAL A 194 3.295 6.007 92.280 1.00 8.63 C ATOM 1498 CG1 VAL A 194 4.339 5.333 91.390 1.00 10.83 C ATOM 1499 CG2 VAL A 194 3.419 5.477 93.720 1.00 9.76 C ATOM 0 H VAL A 194 1.750 7.705 93.192 1.00 8.27 H new ATOM 0 HA VAL A 194 4.328 7.735 92.757 1.00 9.05 H new ATOM 0 HB VAL A 194 2.413 5.805 91.931 1.00 8.63 H new ATOM 0 HG11 VAL A 194 4.199 4.373 91.396 1.00 10.83 H new ATOM 0 HG12 VAL A 194 4.254 5.666 90.483 1.00 10.83 H new ATOM 0 HG13 VAL A 194 5.227 5.532 91.725 1.00 10.83 H new ATOM 0 HG21 VAL A 194 3.290 4.516 93.723 1.00 9.76 H new ATOM 0 HG22 VAL A 194 4.300 5.686 94.067 1.00 9.76 H new ATOM 0 HG23 VAL A 194 2.745 5.895 94.278 1.00 9.76 H new ATOM 1500 N GLU A 195 2.524 8.218 90.139 1.00 9.49 N ATOM 1501 CA GLU A 195 2.551 8.725 88.770 1.00 10.46 C ATOM 1502 C GLU A 195 3.139 10.135 88.723 1.00 9.94 C ATOM 1503 O GLU A 195 3.894 10.476 87.797 1.00 10.17 O ATOM 1504 CB GLU A 195 1.137 8.732 88.179 1.00 11.49 C ATOM 1505 CG GLU A 195 1.097 9.125 86.704 1.00 15.14 C ATOM 1506 CD GLU A 195 -0.313 9.169 86.126 1.00 20.85 C ATOM 1507 OE1 GLU A 195 -1.290 8.879 86.856 1.00 21.96 O ATOM 1508 OE2 GLU A 195 -0.442 9.503 84.928 1.00 23.09 O ATOM 0 H GLU A 195 1.739 8.021 90.431 1.00 9.49 H new ATOM 0 HA GLU A 195 3.114 8.138 88.242 1.00 10.46 H new ATOM 0 HB2 GLU A 195 0.746 7.850 88.282 1.00 11.49 H new ATOM 0 HB3 GLU A 195 0.585 9.348 88.686 1.00 11.49 H new ATOM 0 HG2 GLU A 195 1.510 9.996 86.597 1.00 15.14 H new ATOM 0 HG3 GLU A 195 1.629 8.494 86.194 1.00 15.14 H new ATOM 1509 N SER A 196 2.804 10.953 89.716 1.00 9.19 N ATOM 1510 CA SER A 196 3.306 12.327 89.749 1.00 9.72 C ATOM 1511 C SER A 196 4.829 12.345 89.800 1.00 9.63 C ATOM 1512 O SER A 196 5.472 13.244 89.234 1.00 9.48 O ATOM 1513 CB SER A 196 2.721 13.102 90.941 1.00 9.43 C ATOM 1514 OG SER A 196 3.367 12.794 92.171 1.00 9.30 O ATOM 0 H SER A 196 2.294 10.738 90.374 1.00 9.19 H new ATOM 0 HA SER A 196 3.020 12.766 88.933 1.00 9.72 H new ATOM 0 HB2 SER A 196 2.796 14.054 90.771 1.00 9.43 H new ATOM 0 HB3 SER A 196 1.775 12.902 91.019 1.00 9.43 H new ATOM 0 HG SER A 196 3.354 11.963 92.294 1.00 9.30 H new ATOM 1515 N LEU A 197 5.419 11.351 90.453 1.00 9.06 N ATOM 1516 CA LEU A 197 6.874 11.288 90.545 1.00 9.52 C ATOM 1517 C LEU A 197 7.487 10.903 89.202 1.00 8.57 C ATOM 1518 O LEU A 197 8.536 11.442 88.820 1.00 9.21 O ATOM 1519 CB LEU A 197 7.296 10.324 91.664 1.00 8.49 C ATOM 1520 CG LEU A 197 6.894 10.846 93.052 1.00 9.26 C ATOM 1521 CD1 LEU A 197 7.243 9.788 94.081 1.00 9.63 C ATOM 1522 CD2 LEU A 197 7.582 12.171 93.388 1.00 10.40 C ATOM 0 H LEU A 197 5.002 10.710 90.846 1.00 9.06 H new ATOM 0 HA LEU A 197 7.211 12.169 90.771 1.00 9.52 H new ATOM 0 HB2 LEU A 197 6.888 9.457 91.514 1.00 8.49 H new ATOM 0 HB3 LEU A 197 8.257 10.194 91.633 1.00 8.49 H new ATOM 0 HG LEU A 197 5.940 11.020 93.057 1.00 9.26 H new ATOM 0 HD11 LEU A 197 6.995 10.102 94.965 1.00 9.63 H new ATOM 0 HD12 LEU A 197 6.760 8.971 93.882 1.00 9.63 H new ATOM 0 HD13 LEU A 197 8.197 9.614 94.056 1.00 9.63 H new ATOM 0 HD21 LEU A 197 7.303 12.466 94.269 1.00 10.40 H new ATOM 0 HD22 LEU A 197 8.544 12.048 93.378 1.00 10.40 H new ATOM 0 HD23 LEU A 197 7.335 12.840 92.730 1.00 10.40 H new ATOM 1523 N HIS A 198 6.858 9.989 88.469 1.00 9.55 N ATOM 1524 CA HIS A 198 7.371 9.658 87.141 1.00 9.77 C ATOM 1525 C HIS A 198 7.344 10.931 86.284 1.00 9.05 C ATOM 1526 O HIS A 198 8.299 11.205 85.567 1.00 9.46 O ATOM 1527 CB HIS A 198 6.521 8.559 86.489 1.00 10.34 C ATOM 1528 CG HIS A 198 6.788 7.197 87.045 1.00 10.91 C ATOM 1529 ND1 HIS A 198 7.835 6.409 86.614 1.00 12.59 N ATOM 1530 CD2 HIS A 198 6.164 6.493 88.021 1.00 12.15 C ATOM 1531 CE1 HIS A 198 7.843 5.280 87.299 1.00 12.82 C ATOM 1532 NE2 HIS A 198 6.840 5.306 88.158 1.00 12.26 N ATOM 0 H HIS A 198 6.153 9.560 88.711 1.00 9.55 H new ATOM 0 HA HIS A 198 8.279 9.324 87.214 1.00 9.77 H new ATOM 0 HB2 HIS A 198 5.582 8.772 86.608 1.00 10.34 H new ATOM 0 HB3 HIS A 198 6.691 8.551 85.534 1.00 10.34 H new ATOM 0 HD1 HIS A 198 8.395 6.620 85.996 1.00 12.59 H new ATOM 0 HD2 HIS A 198 5.418 6.763 88.506 1.00 12.15 H new ATOM 0 HE1 HIS A 198 8.452 4.585 87.194 1.00 12.82 H new ATOM 1533 N LYS A 199 6.277 11.719 86.379 1.00 9.73 N ATOM 1534 CA LYS A 199 6.173 12.948 85.589 1.00 9.71 C ATOM 1535 C LYS A 199 7.218 13.986 86.005 1.00 10.31 C ATOM 1536 O LYS A 199 7.785 14.692 85.161 1.00 10.08 O ATOM 1537 CB LYS A 199 4.763 13.538 85.702 1.00 11.23 C ATOM 1538 CG LYS A 199 3.709 12.694 84.972 1.00 12.86 C ATOM 1539 CD LYS A 199 2.312 13.210 85.219 1.00 15.91 C ATOM 1540 CE LYS A 199 1.272 12.396 84.472 1.00 18.80 C ATOM 1541 NZ LYS A 199 1.411 12.548 83.007 1.00 20.94 N ATOM 0 H LYS A 199 5.604 11.563 86.892 1.00 9.73 H new ATOM 0 HA LYS A 199 6.347 12.714 84.664 1.00 9.71 H new ATOM 0 HB2 LYS A 199 4.521 13.612 86.638 1.00 11.23 H new ATOM 0 HB3 LYS A 199 4.762 14.437 85.337 1.00 11.23 H new ATOM 0 HG2 LYS A 199 3.893 12.699 84.020 1.00 12.86 H new ATOM 0 HG3 LYS A 199 3.771 11.772 85.268 1.00 12.86 H new ATOM 0 HD2 LYS A 199 2.121 13.185 86.170 1.00 15.91 H new ATOM 0 HD3 LYS A 199 2.256 14.138 84.943 1.00 15.91 H new ATOM 0 HE2 LYS A 199 1.360 11.460 84.711 1.00 18.80 H new ATOM 0 HE3 LYS A 199 0.384 12.676 84.744 1.00 18.80 H new ATOM 0 HZ1 LYS A 199 0.688 12.221 82.604 1.00 20.94 H new ATOM 0 HZ2 LYS A 199 1.498 13.410 82.805 1.00 20.94 H new ATOM 0 HZ3 LYS A 199 2.131 12.104 82.729 1.00 20.94 H new ATOM 1542 N THR A 200 7.485 14.077 87.302 1.00 10.04 N ATOM 1543 CA THR A 200 8.477 15.002 87.835 1.00 9.16 C ATOM 1544 C THR A 200 9.867 14.660 87.300 1.00 8.89 C ATOM 1545 O THR A 200 10.598 15.544 86.838 1.00 9.36 O ATOM 1546 CB THR A 200 8.459 14.925 89.382 1.00 9.26 C ATOM 1547 OG1 THR A 200 7.194 15.399 89.842 1.00 10.60 O ATOM 1548 CG2 THR A 200 9.560 15.773 90.019 1.00 10.36 C ATOM 0 H THR A 200 7.093 13.601 87.902 1.00 10.04 H new ATOM 0 HA THR A 200 8.261 15.905 87.554 1.00 9.16 H new ATOM 0 HB THR A 200 8.611 14.002 89.638 1.00 9.26 H new ATOM 0 HG1 THR A 200 6.610 14.810 89.712 1.00 10.60 H new ATOM 0 HG21 THR A 200 9.511 15.695 90.985 1.00 10.36 H new ATOM 0 HG22 THR A 200 10.426 15.462 89.713 1.00 10.36 H new ATOM 0 HG23 THR A 200 9.442 16.701 89.764 1.00 10.36 H new ATOM 1549 N PHE A 201 10.230 13.380 87.362 1.00 8.65 N ATOM 1550 CA PHE A 201 11.529 12.963 86.866 1.00 9.85 C ATOM 1551 C PHE A 201 11.646 13.169 85.368 1.00 10.23 C ATOM 1552 O PHE A 201 12.698 13.592 84.896 1.00 10.93 O ATOM 1553 CB PHE A 201 11.808 11.506 87.248 1.00 9.96 C ATOM 1554 CG PHE A 201 12.409 11.355 88.619 1.00 8.45 C ATOM 1555 CD1 PHE A 201 13.779 11.179 88.768 1.00 9.01 C ATOM 1556 CD2 PHE A 201 11.616 11.444 89.763 1.00 9.25 C ATOM 1557 CE1 PHE A 201 14.360 11.095 90.022 1.00 10.14 C ATOM 1558 CE2 PHE A 201 12.193 11.360 91.034 1.00 9.93 C ATOM 1559 CZ PHE A 201 13.559 11.187 91.162 1.00 10.15 C ATOM 0 H PHE A 201 9.743 12.748 87.684 1.00 8.65 H new ATOM 0 HA PHE A 201 12.202 13.522 87.286 1.00 9.85 H new ATOM 0 HB2 PHE A 201 10.979 11.003 87.208 1.00 9.96 H new ATOM 0 HB3 PHE A 201 12.409 11.116 86.594 1.00 9.96 H new ATOM 0 HD1 PHE A 201 14.316 11.116 88.011 1.00 9.01 H new ATOM 0 HD2 PHE A 201 10.697 11.560 89.680 1.00 9.25 H new ATOM 0 HE1 PHE A 201 15.279 10.978 90.105 1.00 10.14 H new ATOM 0 HE2 PHE A 201 11.658 11.420 91.793 1.00 9.93 H new ATOM 0 HZ PHE A 201 13.944 11.132 92.007 1.00 10.15 H new ATOM 1560 N ALA A 202 10.578 12.886 84.622 1.00 9.64 N ATOM 1561 CA ALA A 202 10.622 13.088 83.170 1.00 9.74 C ATOM 1562 C ALA A 202 10.861 14.572 82.870 1.00 10.27 C ATOM 1563 O ALA A 202 11.656 14.902 81.988 1.00 10.86 O ATOM 1564 CB ALA A 202 9.319 12.596 82.516 1.00 10.54 C ATOM 0 H ALA A 202 9.833 12.583 84.927 1.00 9.64 H new ATOM 0 HA ALA A 202 11.352 12.571 82.796 1.00 9.74 H new ATOM 0 HB1 ALA A 202 9.365 12.737 81.557 1.00 10.54 H new ATOM 0 HB2 ALA A 202 9.202 11.651 82.698 1.00 10.54 H new ATOM 0 HB3 ALA A 202 8.568 13.090 82.879 1.00 10.54 H new ATOM 1565 N LEU A 203 10.201 15.470 83.598 1.00 10.28 N ATOM 1566 CA LEU A 203 10.422 16.897 83.368 1.00 9.66 C ATOM 1567 C LEU A 203 11.849 17.316 83.721 1.00 9.75 C ATOM 1568 O LEU A 203 12.465 18.125 83.000 1.00 10.62 O ATOM 1569 CB LEU A 203 9.421 17.740 84.163 1.00 9.40 C ATOM 1570 CG LEU A 203 8.020 17.786 83.544 1.00 8.07 C ATOM 1571 CD1 LEU A 203 7.050 18.387 84.549 1.00 10.60 C ATOM 1572 CD2 LEU A 203 8.029 18.612 82.238 1.00 10.69 C ATOM 0 H LEU A 203 9.634 15.281 84.216 1.00 10.28 H new ATOM 0 HA LEU A 203 10.288 17.055 82.420 1.00 9.66 H new ATOM 0 HB2 LEU A 203 9.356 17.385 85.063 1.00 9.40 H new ATOM 0 HB3 LEU A 203 9.762 18.645 84.239 1.00 9.40 H new ATOM 0 HG LEU A 203 7.737 16.885 83.324 1.00 8.07 H new ATOM 0 HD11 LEU A 203 6.161 18.419 84.162 1.00 10.60 H new ATOM 0 HD12 LEU A 203 7.034 17.841 85.350 1.00 10.60 H new ATOM 0 HD13 LEU A 203 7.335 19.286 84.777 1.00 10.60 H new ATOM 0 HD21 LEU A 203 7.136 18.631 81.860 1.00 10.69 H new ATOM 0 HD22 LEU A 203 8.317 19.518 82.430 1.00 10.69 H new ATOM 0 HD23 LEU A 203 8.640 18.207 81.603 1.00 10.69 H new ATOM 1573 N ALA A 204 12.394 16.795 84.819 1.00 9.25 N ATOM 1574 CA ALA A 204 13.751 17.146 85.207 1.00 8.88 C ATOM 1575 C ALA A 204 14.774 16.673 84.170 1.00 10.67 C ATOM 1576 O ALA A 204 15.774 17.350 83.936 1.00 10.47 O ATOM 1577 CB ALA A 204 14.072 16.552 86.591 1.00 9.77 C ATOM 0 H ALA A 204 11.997 16.243 85.346 1.00 9.25 H new ATOM 0 HA ALA A 204 13.810 18.113 85.254 1.00 8.88 H new ATOM 0 HB1 ALA A 204 14.978 16.790 86.843 1.00 9.77 H new ATOM 0 HB2 ALA A 204 13.451 16.905 87.247 1.00 9.77 H new ATOM 0 HB3 ALA A 204 13.990 15.586 86.556 1.00 9.77 H new ATOM 1578 N GLN A 205 14.534 15.523 83.551 1.00 9.92 N ATOM 1579 CA GLN A 205 15.466 15.040 82.533 1.00 12.04 C ATOM 1580 C GLN A 205 15.275 15.819 81.228 1.00 12.52 C ATOM 1581 O GLN A 205 16.251 16.094 80.531 1.00 14.56 O ATOM 1582 CB GLN A 205 15.270 13.547 82.293 1.00 11.98 C ATOM 1583 CG GLN A 205 15.690 12.673 83.478 1.00 13.27 C ATOM 1584 CD GLN A 205 17.180 12.762 83.785 1.00 13.18 C ATOM 1585 OE1 GLN A 205 17.691 13.821 84.154 1.00 14.06 O ATOM 1586 NE2 GLN A 205 17.883 11.644 83.635 1.00 14.45 N ATOM 0 H GLN A 205 13.855 15.016 83.699 1.00 9.92 H new ATOM 0 HA GLN A 205 16.371 15.183 82.851 1.00 12.04 H new ATOM 0 HB2 GLN A 205 14.336 13.380 82.093 1.00 11.98 H new ATOM 0 HB3 GLN A 205 15.779 13.284 81.511 1.00 11.98 H new ATOM 0 HG2 GLN A 205 15.187 12.938 84.264 1.00 13.27 H new ATOM 0 HG3 GLN A 205 15.458 11.750 83.291 1.00 13.27 H new ATOM 0 HE21 GLN A 205 17.493 10.923 83.376 1.00 14.45 H new ATOM 0 HE22 GLN A 205 18.728 11.642 83.797 1.00 14.45 H new ATOM 1587 N LYS A 206 14.038 16.191 80.910 1.00 11.84 N ATOM 1588 CA LYS A 206 13.761 16.949 79.687 1.00 11.97 C ATOM 1589 C LYS A 206 14.412 18.337 79.707 1.00 11.80 C ATOM 1590 O LYS A 206 14.965 18.788 78.692 1.00 13.69 O ATOM 1591 CB LYS A 206 12.248 17.072 79.498 1.00 11.24 C ATOM 1592 CG LYS A 206 11.821 17.864 78.260 1.00 11.71 C ATOM 1593 CD LYS A 206 10.306 17.822 78.112 1.00 11.97 C ATOM 1594 CE LYS A 206 9.832 18.652 76.922 1.00 11.72 C ATOM 1595 NZ LYS A 206 8.344 18.631 76.804 1.00 14.05 N ATOM 0 H LYS A 206 13.344 16.016 81.387 1.00 11.84 H new ATOM 0 HA LYS A 206 14.148 16.466 78.940 1.00 11.97 H new ATOM 0 HB2 LYS A 206 11.868 16.181 79.444 1.00 11.24 H new ATOM 0 HB3 LYS A 206 11.869 17.495 80.284 1.00 11.24 H new ATOM 0 HG2 LYS A 206 12.121 18.783 78.336 1.00 11.71 H new ATOM 0 HG3 LYS A 206 12.241 17.493 77.468 1.00 11.71 H new ATOM 0 HD2 LYS A 206 10.017 16.903 78.001 1.00 11.97 H new ATOM 0 HD3 LYS A 206 9.892 18.154 78.924 1.00 11.97 H new ATOM 0 HE2 LYS A 206 10.138 19.567 77.021 1.00 11.72 H new ATOM 0 HE3 LYS A 206 10.228 18.307 76.106 1.00 11.72 H new ATOM 0 HZ1 LYS A 206 8.101 19.022 76.042 1.00 14.05 H new ATOM 0 HZ2 LYS A 206 8.057 17.788 76.809 1.00 14.05 H new ATOM 0 HZ3 LYS A 206 7.985 19.070 77.490 1.00 14.05 H new ATOM 1596 N TYR A 207 14.394 18.999 80.859 1.00 11.63 N ATOM 1597 CA TYR A 207 14.943 20.342 81.000 1.00 11.06 C ATOM 1598 C TYR A 207 16.296 20.441 81.693 1.00 11.27 C ATOM 1599 O TYR A 207 16.832 21.543 81.838 1.00 12.25 O ATOM 1600 CB TYR A 207 13.937 21.221 81.756 1.00 11.54 C ATOM 1601 CG TYR A 207 12.698 21.518 80.946 1.00 10.18 C ATOM 1602 CD1 TYR A 207 11.571 20.704 81.013 1.00 10.95 C ATOM 1603 CD2 TYR A 207 12.692 22.578 80.038 1.00 11.48 C ATOM 1604 CE1 TYR A 207 10.465 20.933 80.187 1.00 11.57 C ATOM 1605 CE2 TYR A 207 11.606 22.814 79.220 1.00 12.07 C ATOM 1606 CZ TYR A 207 10.496 21.992 79.291 1.00 11.42 C ATOM 1607 OH TYR A 207 9.437 22.223 78.446 1.00 12.61 O ATOM 0 H TYR A 207 14.061 18.680 81.585 1.00 11.63 H new ATOM 0 HA TYR A 207 15.097 20.645 80.091 1.00 11.06 H new ATOM 0 HB2 TYR A 207 13.681 20.778 82.580 1.00 11.54 H new ATOM 0 HB3 TYR A 207 14.365 22.056 82.004 1.00 11.54 H new ATOM 0 HD1 TYR A 207 11.553 19.997 81.616 1.00 10.95 H new ATOM 0 HD2 TYR A 207 13.434 23.136 79.983 1.00 11.48 H new ATOM 0 HE1 TYR A 207 9.718 20.382 80.238 1.00 11.57 H new ATOM 0 HE2 TYR A 207 11.620 23.525 78.621 1.00 12.07 H new ATOM 0 HH TYR A 207 8.871 21.608 78.531 1.00 12.61 H new ATOM 1608 N ASP A 208 16.851 19.300 82.103 1.00 11.26 N ATOM 1609 CA ASP A 208 18.117 19.257 82.850 1.00 11.42 C ATOM 1610 C ASP A 208 18.022 20.139 84.097 1.00 11.68 C ATOM 1611 O ASP A 208 18.775 21.103 84.279 1.00 12.44 O ATOM 1612 CB ASP A 208 19.299 19.712 81.990 1.00 13.60 C ATOM 1613 CG ASP A 208 20.637 19.440 82.663 1.00 16.96 C ATOM 1614 OD1 ASP A 208 21.674 19.931 82.169 1.00 21.41 O ATOM 1615 OD2 ASP A 208 20.663 18.722 83.687 1.00 16.82 O ATOM 0 H ASP A 208 16.506 18.526 81.957 1.00 11.26 H new ATOM 0 HA ASP A 208 18.271 18.335 83.110 1.00 11.42 H new ATOM 0 HB2 ASP A 208 19.270 19.255 81.135 1.00 13.60 H new ATOM 0 HB3 ASP A 208 19.218 20.661 81.807 1.00 13.60 H new ATOM 1616 N ARG A 209 17.078 19.795 84.971 1.00 10.20 N ATOM 1617 CA ARG A 209 16.875 20.548 86.209 1.00 10.47 C ATOM 1618 C ARG A 209 17.015 19.622 87.407 1.00 9.68 C ATOM 1619 O ARG A 209 17.034 18.405 87.261 1.00 10.24 O ATOM 1620 CB ARG A 209 15.482 21.190 86.214 1.00 11.42 C ATOM 1621 CG ARG A 209 15.220 22.120 85.017 1.00 10.61 C ATOM 1622 CD ARG A 209 16.069 23.403 85.058 1.00 12.58 C ATOM 1623 NE ARG A 209 16.141 23.956 83.705 1.00 12.98 N ATOM 1624 CZ ARG A 209 15.213 24.736 83.154 1.00 12.56 C ATOM 1625 NH1 ARG A 209 15.365 25.145 81.901 1.00 15.36 N ATOM 1626 NH2 ARG A 209 14.173 25.171 83.852 1.00 12.01 N ATOM 0 H ARG A 209 16.544 19.129 84.867 1.00 10.20 H new ATOM 0 HA ARG A 209 17.546 21.246 86.263 1.00 10.47 H new ATOM 0 HB2 ARG A 209 14.812 20.488 86.220 1.00 11.42 H new ATOM 0 HB3 ARG A 209 15.371 21.695 87.035 1.00 11.42 H new ATOM 0 HG2 ARG A 209 15.406 21.641 84.194 1.00 10.61 H new ATOM 0 HG3 ARG A 209 14.280 22.360 84.999 1.00 10.61 H new ATOM 0 HD2 ARG A 209 15.675 24.049 85.665 1.00 12.58 H new ATOM 0 HD3 ARG A 209 16.959 23.208 85.390 1.00 12.58 H new ATOM 0 HE ARG A 209 16.833 23.763 83.232 1.00 12.98 H new ATOM 0 HH11 ARG A 209 16.058 24.906 81.452 1.00 15.36 H new ATOM 0 HH12 ARG A 209 14.770 25.649 81.538 1.00 15.36 H new ATOM 0 HH21 ARG A 209 14.087 24.950 84.679 1.00 12.01 H new ATOM 0 HH22 ARG A 209 13.584 25.674 83.478 1.00 12.01 H new ATOM 1627 N LEU A 210 17.124 20.217 88.588 1.00 9.22 N ATOM 1628 CA LEU A 210 17.229 19.441 89.819 1.00 8.91 C ATOM 1629 C LEU A 210 15.807 19.059 90.245 1.00 9.96 C ATOM 1630 O LEU A 210 14.828 19.537 89.662 1.00 9.72 O ATOM 1631 CB LEU A 210 17.892 20.282 90.917 1.00 10.39 C ATOM 1632 CG LEU A 210 19.267 20.878 90.561 1.00 8.96 C ATOM 1633 CD1 LEU A 210 19.785 21.718 91.719 1.00 11.66 C ATOM 1634 CD2 LEU A 210 20.242 19.753 90.210 1.00 10.66 C ATOM 0 H LEU A 210 17.139 21.070 88.700 1.00 9.22 H new ATOM 0 HA LEU A 210 17.770 18.649 89.676 1.00 8.91 H new ATOM 0 HB2 LEU A 210 17.293 21.009 91.151 1.00 10.39 H new ATOM 0 HB3 LEU A 210 17.992 19.730 91.709 1.00 10.39 H new ATOM 0 HG LEU A 210 19.181 21.457 89.787 1.00 8.96 H new ATOM 0 HD11 LEU A 210 20.651 22.090 91.488 1.00 11.66 H new ATOM 0 HD12 LEU A 210 19.162 22.439 91.900 1.00 11.66 H new ATOM 0 HD13 LEU A 210 19.873 21.162 92.509 1.00 11.66 H new ATOM 0 HD21 LEU A 210 21.107 20.132 89.986 1.00 10.66 H new ATOM 0 HD22 LEU A 210 20.337 19.158 90.970 1.00 10.66 H new ATOM 0 HD23 LEU A 210 19.902 19.255 89.451 1.00 10.66 H new ATOM 1635 N ILE A 211 15.699 18.200 91.255 1.00 9.52 N ATOM 1636 CA ILE A 211 14.408 17.762 91.782 1.00 9.50 C ATOM 1637 C ILE A 211 14.407 17.927 93.300 1.00 7.97 C ATOM 1638 O ILE A 211 15.401 17.612 93.965 1.00 8.89 O ATOM 1639 CB ILE A 211 14.153 16.262 91.478 1.00 9.19 C ATOM 1640 CG1 ILE A 211 13.935 16.078 89.980 1.00 9.40 C ATOM 1641 CG2 ILE A 211 12.954 15.747 92.307 1.00 9.82 C ATOM 1642 CD1 ILE A 211 12.718 16.748 89.478 1.00 19.35 C ATOM 0 H ILE A 211 16.376 17.853 91.656 1.00 9.52 H new ATOM 0 HA ILE A 211 13.718 18.299 91.362 1.00 9.50 H new ATOM 0 HB ILE A 211 14.926 15.736 91.735 1.00 9.19 H new ATOM 0 HG12 ILE A 211 14.706 16.423 89.503 1.00 9.40 H new ATOM 0 HG13 ILE A 211 13.879 15.130 89.782 1.00 9.40 H new ATOM 0 HG21 ILE A 211 12.803 14.809 92.110 1.00 9.82 H new ATOM 0 HG22 ILE A 211 13.145 15.852 93.252 1.00 9.82 H new ATOM 0 HG23 ILE A 211 12.161 16.257 92.080 1.00 9.82 H new ATOM 0 HD11 ILE A 211 12.635 16.595 88.524 1.00 19.35 H new ATOM 0 HD12 ILE A 211 11.940 16.388 89.932 1.00 19.35 H new ATOM 0 HD13 ILE A 211 12.779 17.701 89.648 1.00 19.35 H new ATOM 1643 N ASP A 212 13.304 18.442 93.834 1.00 8.66 N ATOM 1644 CA ASP A 212 13.159 18.563 95.285 1.00 8.95 C ATOM 1645 C ASP A 212 11.685 18.340 95.578 1.00 8.52 C ATOM 1646 O ASP A 212 10.838 19.196 95.334 1.00 9.84 O ATOM 1647 CB ASP A 212 13.650 19.923 95.803 1.00 9.44 C ATOM 1648 CG ASP A 212 13.757 19.957 97.320 1.00 9.89 C ATOM 1649 OD1 ASP A 212 14.735 20.531 97.838 1.00 10.77 O ATOM 1650 OD2 ASP A 212 12.851 19.403 97.987 1.00 10.60 O ATOM 0 H ASP A 212 12.631 18.726 93.379 1.00 8.66 H new ATOM 0 HA ASP A 212 13.709 17.909 95.745 1.00 8.95 H new ATOM 0 HB2 ASP A 212 14.517 20.121 95.415 1.00 9.44 H new ATOM 0 HB3 ASP A 212 13.041 20.618 95.508 1.00 9.44 H new ATOM 1651 N VAL A 213 11.399 17.152 96.097 1.00 8.62 N ATOM 1652 CA VAL A 213 10.046 16.716 96.393 1.00 9.19 C ATOM 1653 C VAL A 213 9.632 16.942 97.841 1.00 8.69 C ATOM 1654 O VAL A 213 10.403 16.623 98.745 1.00 9.75 O ATOM 1655 CB VAL A 213 9.927 15.184 96.132 1.00 9.65 C ATOM 1656 CG1 VAL A 213 8.525 14.687 96.485 1.00 11.18 C ATOM 1657 CG2 VAL A 213 10.295 14.860 94.702 1.00 11.12 C ATOM 0 H VAL A 213 11.999 16.567 96.290 1.00 8.62 H new ATOM 0 HA VAL A 213 9.469 17.244 95.820 1.00 9.19 H new ATOM 0 HB VAL A 213 10.554 14.718 96.707 1.00 9.65 H new ATOM 0 HG11 VAL A 213 8.468 13.733 96.317 1.00 11.18 H new ATOM 0 HG12 VAL A 213 8.346 14.861 97.422 1.00 11.18 H new ATOM 0 HG13 VAL A 213 7.870 15.151 95.940 1.00 11.18 H new ATOM 0 HG21 VAL A 213 10.216 13.904 94.556 1.00 11.12 H new ATOM 0 HG22 VAL A 213 9.697 15.329 94.099 1.00 11.12 H new ATOM 0 HG23 VAL A 213 11.209 15.138 94.532 1.00 11.12 H new ATOM 1658 N HIS A 214 8.451 17.530 98.062 1.00 9.39 N ATOM 1659 CA HIS A 214 7.898 17.628 99.430 1.00 9.17 C ATOM 1660 C HIS A 214 7.412 16.180 99.561 1.00 9.16 C ATOM 1661 O HIS A 214 6.355 15.806 99.041 1.00 9.01 O ATOM 1662 CB HIS A 214 6.735 18.612 99.479 1.00 10.22 C ATOM 1663 CG HIS A 214 7.141 20.004 99.845 1.00 10.46 C ATOM 1664 ND1 HIS A 214 7.898 20.805 99.014 1.00 11.65 N ATOM 1665 CD2 HIS A 214 6.914 20.732 100.965 1.00 12.42 C ATOM 1666 CE1 HIS A 214 8.117 21.966 99.606 1.00 11.27 C ATOM 1667 NE2 HIS A 214 7.533 21.948 100.793 1.00 14.07 N ATOM 0 H HIS A 214 7.958 17.875 97.448 1.00 9.39 H new ATOM 0 HA HIS A 214 8.502 17.941 100.121 1.00 9.17 H new ATOM 0 HB2 HIS A 214 6.298 18.628 98.613 1.00 10.22 H new ATOM 0 HB3 HIS A 214 6.080 18.295 100.121 1.00 10.22 H new ATOM 0 HD1 HIS A 214 8.183 20.583 98.233 1.00 11.65 H new ATOM 0 HD2 HIS A 214 6.430 20.460 101.711 1.00 12.42 H new ATOM 0 HE1 HIS A 214 8.600 22.676 99.249 1.00 11.27 H new ATOM 1668 N CYS A 215 8.178 15.385 100.298 1.00 8.27 N ATOM 1669 CA CYS A 215 7.971 13.949 100.321 1.00 8.10 C ATOM 1670 C CYS A 215 7.514 13.339 101.630 1.00 7.88 C ATOM 1671 O CYS A 215 8.254 13.335 102.613 1.00 9.02 O ATOM 1672 CB CYS A 215 9.299 13.298 99.905 1.00 8.91 C ATOM 1673 SG CYS A 215 9.199 11.602 99.331 1.00 9.70 S ATOM 0 H CYS A 215 8.825 15.661 100.793 1.00 8.27 H new ATOM 0 HA CYS A 215 7.232 13.778 99.716 1.00 8.10 H new ATOM 0 HB2 CYS A 215 9.696 13.836 99.202 1.00 8.91 H new ATOM 0 HB3 CYS A 215 9.905 13.329 100.662 1.00 8.91 H new ATOM 0 HG CYS A 215 8.715 10.917 100.189 1.00 9.70 H new ATOM 1674 N ASP A 216 6.313 12.770 101.624 1.00 8.24 N ATOM 1675 CA ASP A 216 5.776 12.109 102.818 1.00 8.01 C ATOM 1676 C ASP A 216 5.764 13.046 104.036 1.00 9.04 C ATOM 1677 O ASP A 216 6.176 12.648 105.129 1.00 8.27 O ATOM 1678 CB ASP A 216 6.595 10.836 103.148 1.00 9.03 C ATOM 1679 CG ASP A 216 6.695 9.872 101.970 1.00 7.82 C ATOM 1680 OD1 ASP A 216 7.831 9.461 101.640 1.00 9.05 O ATOM 1681 OD2 ASP A 216 5.637 9.522 101.394 1.00 7.72 O ATOM 0 H ASP A 216 5.791 12.754 100.941 1.00 8.24 H new ATOM 0 HA ASP A 216 4.859 11.862 102.620 1.00 8.01 H new ATOM 0 HB2 ASP A 216 7.488 11.094 103.425 1.00 9.03 H new ATOM 0 HB3 ASP A 216 6.186 10.380 103.900 1.00 9.03 H new ATOM 1682 N GLU A 217 5.298 14.281 103.864 1.00 8.56 N ATOM 1683 CA GLU A 217 5.233 15.212 105.003 1.00 8.77 C ATOM 1684 C GLU A 217 3.883 14.963 105.674 1.00 9.03 C ATOM 1685 O GLU A 217 2.935 15.750 105.563 1.00 9.22 O ATOM 1686 CB GLU A 217 5.348 16.678 104.552 1.00 9.62 C ATOM 1687 CG GLU A 217 5.482 17.642 105.748 1.00 11.14 C ATOM 1688 CD GLU A 217 5.401 19.118 105.390 1.00 13.49 C ATOM 1689 OE1 GLU A 217 5.193 19.456 104.201 1.00 13.38 O ATOM 1690 OE2 GLU A 217 5.546 19.964 106.309 1.00 13.32 O ATOM 0 H GLU A 217 5.019 14.600 103.116 1.00 8.56 H new ATOM 0 HA GLU A 217 5.973 15.059 105.611 1.00 8.77 H new ATOM 0 HB2 GLU A 217 6.118 16.777 103.970 1.00 9.62 H new ATOM 0 HB3 GLU A 217 4.566 16.917 104.031 1.00 9.62 H new ATOM 0 HG2 GLU A 217 4.784 17.439 106.390 1.00 11.14 H new ATOM 0 HG3 GLU A 217 6.330 17.475 106.188 1.00 11.14 H new ATOM 1691 N ILE A 218 3.812 13.849 106.385 1.00 7.96 N ATOM 1692 CA ILE A 218 2.561 13.416 106.986 1.00 8.70 C ATOM 1693 C ILE A 218 2.851 12.281 107.973 1.00 8.09 C ATOM 1694 O ILE A 218 3.724 11.454 107.731 1.00 9.08 O ATOM 1695 CB ILE A 218 1.612 12.903 105.851 1.00 8.85 C ATOM 1696 CG1 ILE A 218 0.283 12.482 106.447 1.00 9.65 C ATOM 1697 CG2 ILE A 218 2.274 11.764 105.061 1.00 9.97 C ATOM 1698 CD1 ILE A 218 -0.381 13.584 107.145 1.00 19.19 C ATOM 0 H ILE A 218 4.479 13.327 106.532 1.00 7.96 H new ATOM 0 HA ILE A 218 2.138 14.151 107.457 1.00 8.70 H new ATOM 0 HB ILE A 218 1.445 13.623 105.223 1.00 8.85 H new ATOM 0 HG12 ILE A 218 -0.296 12.151 105.742 1.00 9.65 H new ATOM 0 HG13 ILE A 218 0.425 11.748 107.065 1.00 9.65 H new ATOM 0 HG21 ILE A 218 1.671 11.461 104.364 1.00 9.97 H new ATOM 0 HG22 ILE A 218 3.097 12.084 104.660 1.00 9.97 H new ATOM 0 HG23 ILE A 218 2.472 11.027 105.660 1.00 9.97 H new ATOM 0 HD11 ILE A 218 -1.225 13.274 107.510 1.00 19.19 H new ATOM 0 HD12 ILE A 218 0.187 13.900 107.866 1.00 19.19 H new ATOM 0 HD13 ILE A 218 -0.546 14.309 106.522 1.00 19.19 H new ATOM 1699 N ASP A 219 2.121 12.248 109.088 1.00 7.92 N ATOM 1700 CA ASP A 219 2.312 11.181 110.081 1.00 8.15 C ATOM 1701 C ASP A 219 1.506 9.941 109.674 1.00 8.03 C ATOM 1702 O ASP A 219 0.610 9.488 110.396 1.00 9.46 O ATOM 1703 CB ASP A 219 1.865 11.655 111.471 1.00 8.44 C ATOM 1704 CG ASP A 219 2.725 12.779 112.016 1.00 9.49 C ATOM 1705 OD1 ASP A 219 2.146 13.688 112.653 1.00 10.92 O ATOM 1706 OD2 ASP A 219 3.960 12.759 111.814 1.00 9.61 O ATOM 0 H ASP A 219 1.516 12.825 109.290 1.00 7.92 H new ATOM 0 HA ASP A 219 3.255 10.956 110.116 1.00 8.15 H new ATOM 0 HB2 ASP A 219 0.943 11.953 111.425 1.00 8.44 H new ATOM 0 HB3 ASP A 219 1.891 10.906 112.087 1.00 8.44 H new ATOM 1707 N ASP A 220 1.828 9.408 108.500 1.00 8.41 N ATOM 1708 CA ASP A 220 1.140 8.236 107.943 1.00 7.74 C ATOM 1709 C ASP A 220 2.211 7.188 107.683 1.00 8.85 C ATOM 1710 O ASP A 220 3.052 7.361 106.800 1.00 8.65 O ATOM 1711 CB ASP A 220 0.442 8.638 106.632 1.00 8.58 C ATOM 1712 CG ASP A 220 -0.229 7.467 105.931 1.00 9.23 C ATOM 1713 OD1 ASP A 220 -0.612 7.635 104.739 1.00 10.59 O ATOM 1714 OD2 ASP A 220 -0.368 6.391 106.559 1.00 9.95 O ATOM 0 H ASP A 220 2.455 9.715 107.998 1.00 8.41 H new ATOM 0 HA ASP A 220 0.465 7.889 108.547 1.00 7.74 H new ATOM 0 HB2 ASP A 220 -0.223 9.319 106.821 1.00 8.58 H new ATOM 0 HB3 ASP A 220 1.094 9.036 106.034 1.00 8.58 H new ATOM 1715 N GLU A 221 2.187 6.102 108.456 1.00 8.56 N ATOM 1716 CA GLU A 221 3.177 5.046 108.304 1.00 8.71 C ATOM 1717 C GLU A 221 3.127 4.360 106.933 1.00 8.28 C ATOM 1718 O GLU A 221 4.053 3.619 106.581 1.00 9.08 O ATOM 1719 CB GLU A 221 3.019 4.022 109.446 1.00 10.12 C ATOM 1720 CG GLU A 221 1.901 3.009 109.281 1.00 10.36 C ATOM 1721 CD GLU A 221 0.501 3.556 109.468 1.00 11.26 C ATOM 1722 OE1 GLU A 221 -0.451 2.812 109.092 1.00 12.70 O ATOM 1723 OE2 GLU A 221 0.326 4.687 109.992 1.00 12.24 O ATOM 0 H GLU A 221 1.605 5.961 109.073 1.00 8.56 H new ATOM 0 HA GLU A 221 4.053 5.460 108.356 1.00 8.71 H new ATOM 0 HB2 GLU A 221 3.856 3.541 109.543 1.00 10.12 H new ATOM 0 HB3 GLU A 221 2.873 4.507 110.273 1.00 10.12 H new ATOM 0 HG2 GLU A 221 1.965 2.620 108.395 1.00 10.36 H new ATOM 0 HG3 GLU A 221 2.039 2.290 109.917 1.00 10.36 H new ATOM 1724 N GLN A 222 2.058 4.603 106.175 1.00 7.46 N ATOM 1725 CA GLN A 222 1.923 4.024 104.838 1.00 7.19 C ATOM 1726 C GLN A 222 2.373 4.988 103.740 1.00 8.07 C ATOM 1727 O GLN A 222 2.303 4.645 102.558 1.00 9.23 O ATOM 1728 CB GLN A 222 0.474 3.619 104.584 1.00 7.91 C ATOM 1729 CG GLN A 222 0.011 2.495 105.495 1.00 8.86 C ATOM 1730 CD GLN A 222 -1.484 2.280 105.456 1.00 8.24 C ATOM 1731 OE1 GLN A 222 -2.064 2.118 104.393 1.00 9.52 O ATOM 1732 NE2 GLN A 222 -2.106 2.244 106.627 1.00 9.54 N ATOM 0 H GLN A 222 1.399 5.101 106.416 1.00 7.46 H new ATOM 0 HA GLN A 222 2.500 3.245 104.808 1.00 7.19 H new ATOM 0 HB2 GLN A 222 -0.100 4.390 104.711 1.00 7.91 H new ATOM 0 HB3 GLN A 222 0.377 3.342 103.660 1.00 7.91 H new ATOM 0 HG2 GLN A 222 0.458 1.673 105.238 1.00 8.86 H new ATOM 0 HG3 GLN A 222 0.281 2.692 106.406 1.00 8.86 H new ATOM 0 HE21 GLN A 222 -1.662 2.363 107.354 1.00 9.54 H new ATOM 0 HE22 GLN A 222 -2.954 2.102 106.660 1.00 9.54 H new ATOM 1733 N SER A 223 2.816 6.183 104.107 1.00 7.13 N ATOM 1734 CA SER A 223 3.272 7.150 103.101 1.00 7.62 C ATOM 1735 C SER A 223 4.747 6.829 102.833 1.00 7.91 C ATOM 1736 O SER A 223 5.638 7.180 103.621 1.00 8.61 O ATOM 1737 CB SER A 223 3.088 8.579 103.622 1.00 7.80 C ATOM 1738 OG SER A 223 3.203 9.518 102.558 1.00 8.48 O ATOM 0 H SER A 223 2.863 6.457 104.921 1.00 7.13 H new ATOM 0 HA SER A 223 2.759 7.088 102.280 1.00 7.62 H new ATOM 0 HB2 SER A 223 2.219 8.665 104.044 1.00 7.80 H new ATOM 0 HB3 SER A 223 3.754 8.769 104.302 1.00 7.80 H new ATOM 0 HG SER A 223 3.976 9.479 102.232 1.00 8.48 H new ATOM 1739 N ARG A 224 4.984 6.138 101.714 1.00 8.38 N ATOM 1740 CA ARG A 224 6.313 5.665 101.324 1.00 8.41 C ATOM 1741 C ARG A 224 6.731 6.148 99.944 1.00 8.31 C ATOM 1742 O ARG A 224 7.386 5.429 99.193 1.00 8.48 O ATOM 1743 CB ARG A 224 6.329 4.133 101.354 1.00 9.45 C ATOM 1744 CG ARG A 224 6.126 3.569 102.746 1.00 8.42 C ATOM 1745 CD ARG A 224 6.045 2.051 102.751 1.00 9.21 C ATOM 1746 NE ARG A 224 6.015 1.522 104.114 1.00 8.79 N ATOM 1747 CZ ARG A 224 6.075 0.229 104.430 1.00 8.79 C ATOM 1748 NH1 ARG A 224 6.045 -0.131 105.705 1.00 10.14 N ATOM 1749 NH2 ARG A 224 6.174 -0.696 103.484 1.00 10.10 N ATOM 0 H ARG A 224 4.367 5.929 101.153 1.00 8.38 H new ATOM 0 HA ARG A 224 6.949 6.031 101.958 1.00 8.41 H new ATOM 0 HB2 ARG A 224 5.633 3.795 100.768 1.00 9.45 H new ATOM 0 HB3 ARG A 224 7.175 3.816 101.002 1.00 9.45 H new ATOM 0 HG2 ARG A 224 6.857 3.853 103.317 1.00 8.42 H new ATOM 0 HG3 ARG A 224 5.311 3.935 103.125 1.00 8.42 H new ATOM 0 HD2 ARG A 224 5.250 1.766 102.274 1.00 9.21 H new ATOM 0 HD3 ARG A 224 6.807 1.683 102.276 1.00 9.21 H new ATOM 0 HE ARG A 224 5.954 2.087 104.759 1.00 8.79 H new ATOM 0 HH11 ARG A 224 5.987 0.468 106.320 1.00 10.14 H new ATOM 0 HH12 ARG A 224 6.083 -0.963 105.918 1.00 10.14 H new ATOM 0 HH21 ARG A 224 6.200 -0.464 102.656 1.00 10.10 H new ATOM 0 HH22 ARG A 224 6.212 -1.528 103.698 1.00 10.10 H new ATOM 1750 N PHE A 225 6.369 7.369 99.601 1.00 8.14 N ATOM 1751 CA PHE A 225 6.762 7.875 98.300 1.00 7.66 C ATOM 1752 C PHE A 225 8.274 8.032 98.174 1.00 7.39 C ATOM 1753 O PHE A 225 8.813 8.000 97.057 1.00 8.19 O ATOM 1754 CB PHE A 225 6.007 9.180 98.004 1.00 7.69 C ATOM 1755 CG PHE A 225 4.528 8.985 97.909 1.00 7.87 C ATOM 1756 CD1 PHE A 225 3.683 9.451 98.905 1.00 8.55 C ATOM 1757 CD2 PHE A 225 3.984 8.259 96.851 1.00 9.98 C ATOM 1758 CE1 PHE A 225 2.311 9.198 98.856 1.00 9.69 C ATOM 1759 CE2 PHE A 225 2.616 8.004 96.793 1.00 9.54 C ATOM 1760 CZ PHE A 225 1.782 8.468 97.795 1.00 9.97 C ATOM 0 H PHE A 225 5.910 7.908 100.089 1.00 8.14 H new ATOM 0 HA PHE A 225 6.514 7.222 97.627 1.00 7.66 H new ATOM 0 HB2 PHE A 225 6.200 9.826 98.702 1.00 7.69 H new ATOM 0 HB3 PHE A 225 6.334 9.556 97.172 1.00 7.69 H new ATOM 0 HD1 PHE A 225 4.035 9.938 99.615 1.00 8.55 H new ATOM 0 HD2 PHE A 225 4.540 7.942 96.177 1.00 9.98 H new ATOM 0 HE1 PHE A 225 1.753 9.516 99.529 1.00 9.69 H new ATOM 0 HE2 PHE A 225 2.263 7.522 96.081 1.00 9.54 H new ATOM 0 HZ PHE A 225 0.869 8.292 97.760 1.00 9.97 H new ATOM 1761 N VAL A 226 8.971 8.174 99.298 1.00 7.66 N ATOM 1762 CA VAL A 226 10.421 8.285 99.266 1.00 8.47 C ATOM 1763 C VAL A 226 11.085 7.114 98.523 1.00 8.35 C ATOM 1764 O VAL A 226 12.104 7.315 97.856 1.00 7.99 O ATOM 1765 CB VAL A 226 10.997 8.402 100.709 1.00 9.08 C ATOM 1766 CG1 VAL A 226 10.694 7.125 101.512 1.00 9.43 C ATOM 1767 CG2 VAL A 226 12.495 8.707 100.661 1.00 11.10 C ATOM 0 H VAL A 226 8.624 8.208 100.084 1.00 7.66 H new ATOM 0 HA VAL A 226 10.628 9.094 98.773 1.00 8.47 H new ATOM 0 HB VAL A 226 10.565 9.141 101.165 1.00 9.08 H new ATOM 0 HG11 VAL A 226 11.058 7.211 102.407 1.00 9.43 H new ATOM 0 HG12 VAL A 226 9.734 6.996 101.565 1.00 9.43 H new ATOM 0 HG13 VAL A 226 11.099 6.362 101.071 1.00 9.43 H new ATOM 0 HG21 VAL A 226 12.840 8.777 101.565 1.00 11.10 H new ATOM 0 HG22 VAL A 226 12.956 7.993 100.194 1.00 11.10 H new ATOM 0 HG23 VAL A 226 12.640 9.545 100.194 1.00 11.10 H new ATOM 1768 N GLU A 227 10.539 5.901 98.603 1.00 8.16 N ATOM 1769 CA GLU A 227 11.197 4.792 97.897 1.00 7.79 C ATOM 1770 C GLU A 227 11.111 4.987 96.376 1.00 8.36 C ATOM 1771 O GLU A 227 12.020 4.576 95.659 1.00 9.06 O ATOM 1772 CB GLU A 227 10.650 3.409 98.339 1.00 7.39 C ATOM 1773 CG GLU A 227 9.227 3.080 97.913 1.00 9.23 C ATOM 1774 CD GLU A 227 8.768 1.700 98.365 1.00 8.37 C ATOM 1775 OE1 GLU A 227 7.776 1.197 97.794 1.00 10.37 O ATOM 1776 OE2 GLU A 227 9.381 1.120 99.294 1.00 10.35 O ATOM 0 H GLU A 227 9.824 5.700 99.037 1.00 8.16 H new ATOM 0 HA GLU A 227 12.135 4.803 98.144 1.00 7.79 H new ATOM 0 HB2 GLU A 227 11.239 2.722 97.989 1.00 7.39 H new ATOM 0 HB3 GLU A 227 10.698 3.358 99.306 1.00 7.39 H new ATOM 0 HG2 GLU A 227 8.625 3.749 98.275 1.00 9.23 H new ATOM 0 HG3 GLU A 227 9.164 3.135 96.947 1.00 9.23 H new ATOM 1777 N THR A 228 10.043 5.613 95.882 1.00 8.55 N ATOM 1778 CA THR A 228 9.946 5.867 94.442 1.00 7.97 C ATOM 1779 C THR A 228 10.920 6.987 94.055 1.00 8.74 C ATOM 1780 O THR A 228 11.572 6.913 93.021 1.00 9.28 O ATOM 1781 CB THR A 228 8.505 6.237 94.040 1.00 8.84 C ATOM 1782 OG1 THR A 228 7.667 5.086 94.213 1.00 9.75 O ATOM 1783 CG2 THR A 228 8.442 6.687 92.569 1.00 9.52 C ATOM 0 H THR A 228 9.378 5.893 96.349 1.00 8.55 H new ATOM 0 HA THR A 228 10.184 5.057 93.965 1.00 7.97 H new ATOM 0 HB THR A 228 8.203 6.969 94.600 1.00 8.84 H new ATOM 0 HG1 THR A 228 7.331 5.097 94.983 1.00 9.75 H new ATOM 0 HG21 THR A 228 7.528 6.914 92.339 1.00 9.52 H new ATOM 0 HG22 THR A 228 9.009 7.464 92.443 1.00 9.52 H new ATOM 0 HG23 THR A 228 8.749 5.967 91.997 1.00 9.52 H new ATOM 1784 N VAL A 229 11.025 8.027 94.874 1.00 8.21 N ATOM 1785 CA VAL A 229 11.967 9.101 94.574 1.00 8.84 C ATOM 1786 C VAL A 229 13.381 8.521 94.466 1.00 8.93 C ATOM 1787 O VAL A 229 14.116 8.803 93.521 1.00 9.78 O ATOM 1788 CB VAL A 229 11.958 10.185 95.684 1.00 8.04 C ATOM 1789 CG1 VAL A 229 13.037 11.241 95.396 1.00 9.19 C ATOM 1790 CG2 VAL A 229 10.589 10.842 95.762 1.00 8.93 C ATOM 0 H VAL A 229 10.570 8.131 95.596 1.00 8.21 H new ATOM 0 HA VAL A 229 11.699 9.510 93.736 1.00 8.84 H new ATOM 0 HB VAL A 229 12.151 9.764 96.536 1.00 8.04 H new ATOM 0 HG11 VAL A 229 13.025 11.915 96.094 1.00 9.19 H new ATOM 0 HG12 VAL A 229 13.908 10.816 95.373 1.00 9.19 H new ATOM 0 HG13 VAL A 229 12.859 11.660 94.539 1.00 9.19 H new ATOM 0 HG21 VAL A 229 10.593 11.518 96.458 1.00 8.93 H new ATOM 0 HG22 VAL A 229 10.380 11.257 94.911 1.00 8.93 H new ATOM 0 HG23 VAL A 229 9.919 10.171 95.967 1.00 8.93 H new ATOM 1791 N ALA A 230 13.777 7.708 95.442 1.00 7.87 N ATOM 1792 CA ALA A 230 15.110 7.127 95.433 1.00 8.37 C ATOM 1793 C ALA A 230 15.304 6.134 94.284 1.00 9.17 C ATOM 1794 O ALA A 230 16.361 6.128 93.638 1.00 9.58 O ATOM 1795 CB ALA A 230 15.401 6.452 96.773 1.00 8.95 C ATOM 0 H ALA A 230 13.290 7.483 96.114 1.00 7.87 H new ATOM 0 HA ALA A 230 15.739 7.852 95.294 1.00 8.37 H new ATOM 0 HB1 ALA A 230 16.292 6.068 96.756 1.00 8.95 H new ATOM 0 HB2 ALA A 230 15.346 7.109 97.485 1.00 8.95 H new ATOM 0 HB3 ALA A 230 14.750 5.750 96.930 1.00 8.95 H new ATOM 1796 N ALA A 231 14.306 5.300 94.014 1.00 8.53 N ATOM 1797 CA ALA A 231 14.431 4.316 92.936 1.00 9.02 C ATOM 1798 C ALA A 231 14.526 4.969 91.562 1.00 9.47 C ATOM 1799 O ALA A 231 15.322 4.537 90.726 1.00 9.55 O ATOM 1800 CB ALA A 231 13.259 3.340 92.974 1.00 9.18 C ATOM 0 H ALA A 231 13.556 5.284 94.435 1.00 8.53 H new ATOM 0 HA ALA A 231 15.260 3.834 93.083 1.00 9.02 H new ATOM 0 HB1 ALA A 231 13.352 2.694 92.257 1.00 9.18 H new ATOM 0 HB2 ALA A 231 13.251 2.877 93.826 1.00 9.18 H new ATOM 0 HB3 ALA A 231 12.428 3.828 92.863 1.00 9.18 H new ATOM 1801 N LEU A 232 13.727 6.000 91.321 1.00 8.82 N ATOM 1802 CA LEU A 232 13.788 6.678 90.036 1.00 10.01 C ATOM 1803 C LEU A 232 15.131 7.382 89.889 1.00 10.22 C ATOM 1804 O LEU A 232 15.716 7.390 88.803 1.00 10.82 O ATOM 1805 CB LEU A 232 12.636 7.671 89.888 1.00 10.47 C ATOM 1806 CG LEU A 232 11.258 7.036 89.685 1.00 10.39 C ATOM 1807 CD1 LEU A 232 10.179 8.105 89.667 1.00 12.31 C ATOM 1808 CD2 LEU A 232 11.241 6.270 88.372 1.00 15.67 C ATOM 0 H LEU A 232 13.153 6.318 91.877 1.00 8.82 H new ATOM 0 HA LEU A 232 13.700 6.018 89.330 1.00 10.01 H new ATOM 0 HB2 LEU A 232 12.606 8.231 90.679 1.00 10.47 H new ATOM 0 HB3 LEU A 232 12.823 8.253 89.135 1.00 10.47 H new ATOM 0 HG LEU A 232 11.081 6.428 90.420 1.00 10.39 H new ATOM 0 HD11 LEU A 232 9.313 7.688 89.538 1.00 12.31 H new ATOM 0 HD12 LEU A 232 10.184 8.585 90.510 1.00 12.31 H new ATOM 0 HD13 LEU A 232 10.350 8.726 88.942 1.00 12.31 H new ATOM 0 HD21 LEU A 232 10.368 5.868 88.243 1.00 15.67 H new ATOM 0 HD22 LEU A 232 11.427 6.878 87.640 1.00 15.67 H new ATOM 0 HD23 LEU A 232 11.917 5.575 88.394 1.00 15.67 H new ATOM 1809 N ALA A 233 15.645 7.960 90.967 1.00 9.06 N ATOM 1810 CA ALA A 233 16.941 8.629 90.892 1.00 9.77 C ATOM 1811 C ALA A 233 18.028 7.600 90.592 1.00 10.43 C ATOM 1812 O ALA A 233 18.927 7.850 89.787 1.00 10.46 O ATOM 1813 CB ALA A 233 17.247 9.343 92.199 1.00 10.20 C ATOM 0 H ALA A 233 15.269 7.978 91.740 1.00 9.06 H new ATOM 0 HA ALA A 233 16.915 9.288 90.181 1.00 9.77 H new ATOM 0 HB1 ALA A 233 18.110 9.782 92.134 1.00 10.20 H new ATOM 0 HB2 ALA A 233 16.560 10.005 92.375 1.00 10.20 H new ATOM 0 HB3 ALA A 233 17.267 8.698 92.923 1.00 10.20 H new ATOM 1814 N HIS A 234 17.954 6.435 91.229 1.00 10.35 N ATOM 1815 CA HIS A 234 18.966 5.410 90.996 1.00 11.47 C ATOM 1816 C HIS A 234 18.911 4.915 89.554 1.00 12.26 C ATOM 1817 O HIS A 234 19.950 4.732 88.909 1.00 11.89 O ATOM 1818 CB HIS A 234 18.766 4.245 91.974 1.00 11.93 C ATOM 1819 CG HIS A 234 19.847 3.212 91.911 1.00 12.17 C ATOM 1820 ND1 HIS A 234 19.766 2.098 91.102 1.00 13.98 N ATOM 1821 CD2 HIS A 234 21.042 3.137 92.542 1.00 14.81 C ATOM 1822 CE1 HIS A 234 20.867 1.381 91.240 1.00 12.87 C ATOM 1823 NE2 HIS A 234 21.658 1.988 92.108 1.00 14.91 N ATOM 0 H HIS A 234 17.338 6.221 91.790 1.00 10.35 H new ATOM 0 HA HIS A 234 19.842 5.798 91.147 1.00 11.47 H new ATOM 0 HB2 HIS A 234 18.718 4.596 92.877 1.00 11.93 H new ATOM 0 HB3 HIS A 234 17.914 3.821 91.789 1.00 11.93 H new ATOM 0 HD1 HIS A 234 19.104 1.901 90.589 1.00 13.98 H new ATOM 0 HD2 HIS A 234 21.382 3.748 93.154 1.00 14.81 H new ATOM 0 HE1 HIS A 234 21.054 0.583 90.800 1.00 12.87 H new ATOM 1824 N HIS A 235 17.705 4.718 89.044 1.00 12.58 N ATOM 1825 CA HIS A 235 17.529 4.237 87.679 1.00 14.54 C ATOM 1826 C HIS A 235 18.107 5.202 86.651 1.00 15.04 C ATOM 1827 O HIS A 235 18.736 4.770 85.675 1.00 16.44 O ATOM 1828 CB HIS A 235 16.048 4.013 87.394 1.00 15.64 C ATOM 1829 CG HIS A 235 15.771 3.502 86.017 1.00 19.12 C ATOM 1830 ND1 HIS A 235 15.389 4.324 84.979 1.00 22.51 N ATOM 1831 CD2 HIS A 235 15.843 2.253 85.503 1.00 21.39 C ATOM 1832 CE1 HIS A 235 15.235 3.602 83.883 1.00 22.84 C ATOM 1833 NE2 HIS A 235 15.504 2.342 84.175 1.00 22.57 N ATOM 0 H HIS A 235 16.972 4.857 89.472 1.00 12.58 H new ATOM 0 HA HIS A 235 18.013 3.400 87.602 1.00 14.54 H new ATOM 0 HB2 HIS A 235 15.694 3.383 88.041 1.00 15.64 H new ATOM 0 HB3 HIS A 235 15.572 4.849 87.522 1.00 15.64 H new ATOM 0 HD2 HIS A 235 16.078 1.479 85.962 1.00 21.39 H new ATOM 0 HE1 HIS A 235 14.981 3.925 83.049 1.00 22.84 H new ATOM 0 HE2 HIS A 235 15.472 1.684 83.623 1.00 22.57 H new ATOM 1834 N GLU A 236 17.894 6.497 86.874 1.00 14.66 N ATOM 1835 CA GLU A 236 18.372 7.541 85.966 1.00 16.40 C ATOM 1836 C GLU A 236 19.811 7.975 86.264 1.00 16.63 C ATOM 1837 O GLU A 236 20.353 8.825 85.557 1.00 18.63 O ATOM 1838 CB GLU A 236 17.445 8.765 86.058 1.00 17.10 C ATOM 1839 CG GLU A 236 15.977 8.508 85.687 1.00 19.29 C ATOM 1840 CD GLU A 236 15.702 8.577 84.186 1.00 20.37 C ATOM 1841 OE1 GLU A 236 14.603 8.155 83.778 1.00 23.71 O ATOM 1842 OE2 GLU A 236 16.566 9.058 83.418 1.00 20.78 O ATOM 0 H GLU A 236 17.467 6.797 87.558 1.00 14.66 H new ATOM 0 HA GLU A 236 18.362 7.167 85.071 1.00 16.40 H new ATOM 0 HB2 GLU A 236 17.478 9.110 86.964 1.00 17.10 H new ATOM 0 HB3 GLU A 236 17.793 9.460 85.477 1.00 17.10 H new ATOM 0 HG2 GLU A 236 15.717 7.633 86.015 1.00 19.29 H new ATOM 0 HG3 GLU A 236 15.418 9.159 86.140 1.00 19.29 H new ATOM 1843 N GLY A 237 20.425 7.401 87.296 1.00 15.81 N ATOM 1844 CA GLY A 237 21.781 7.769 87.680 1.00 16.58 C ATOM 1845 C GLY A 237 21.875 9.261 87.953 1.00 16.80 C ATOM 1846 O GLY A 237 22.803 9.933 87.500 1.00 20.26 O ATOM 0 H GLY A 237 20.069 6.792 87.788 1.00 15.81 H new ATOM 0 HA2 GLY A 237 22.044 7.273 88.471 1.00 16.58 H new ATOM 0 HA3 GLY A 237 22.400 7.525 86.974 1.00 16.58 H new ATOM 1847 N MET A 238 20.929 9.793 88.716 1.00 13.30 N ATOM 1848 CA MET A 238 20.927 11.226 88.977 1.00 13.08 C ATOM 1849 C MET A 238 20.735 11.611 90.441 1.00 12.87 C ATOM 1850 O MET A 238 20.283 12.721 90.730 1.00 13.94 O ATOM 1851 CB MET A 238 19.835 11.883 88.124 1.00 15.55 C ATOM 1852 CG MET A 238 18.425 11.411 88.469 1.00 15.09 C ATOM 1853 SD MET A 238 17.134 12.064 87.373 1.00 15.26 S ATOM 1854 CE MET A 238 17.051 13.704 87.933 1.00 15.80 C ATOM 0 H MET A 238 20.290 9.352 89.086 1.00 13.30 H new ATOM 0 HA MET A 238 21.811 11.546 88.740 1.00 13.08 H new ATOM 0 HB2 MET A 238 19.882 12.845 88.236 1.00 15.55 H new ATOM 0 HB3 MET A 238 20.010 11.697 87.188 1.00 15.55 H new ATOM 0 HG2 MET A 238 18.402 10.442 88.437 1.00 15.09 H new ATOM 0 HG3 MET A 238 18.222 11.670 89.382 1.00 15.09 H new ATOM 0 HE1 MET A 238 16.152 13.895 88.243 1.00 15.80 H new ATOM 0 HE2 MET A 238 17.677 13.829 88.663 1.00 15.80 H new ATOM 0 HE3 MET A 238 17.277 14.306 87.207 1.00 15.80 H new ATOM 1855 N GLY A 239 21.094 10.722 91.362 1.00 12.11 N ATOM 1856 CA GLY A 239 20.896 11.011 92.776 1.00 13.15 C ATOM 1857 C GLY A 239 21.387 12.361 93.276 1.00 11.99 C ATOM 1858 O GLY A 239 20.720 12.999 94.071 1.00 12.64 O ATOM 0 H GLY A 239 21.449 9.957 91.192 1.00 12.11 H new ATOM 0 HA2 GLY A 239 19.948 10.944 92.968 1.00 13.15 H new ATOM 0 HA3 GLY A 239 21.339 10.319 93.291 1.00 13.15 H new ATOM 1859 N ALA A 240 22.546 12.804 92.802 1.00 13.10 N ATOM 1860 CA ALA A 240 23.120 14.076 93.226 1.00 12.46 C ATOM 1861 C ALA A 240 22.215 15.270 92.945 1.00 11.77 C ATOM 1862 O ALA A 240 22.301 16.298 93.608 1.00 14.26 O ATOM 1863 CB ALA A 240 24.481 14.287 92.537 1.00 13.20 C ATOM 0 H ALA A 240 23.021 12.377 92.227 1.00 13.10 H new ATOM 0 HA ALA A 240 23.228 14.026 94.189 1.00 12.46 H new ATOM 0 HB1 ALA A 240 24.860 15.134 92.821 1.00 13.20 H new ATOM 0 HB2 ALA A 240 25.082 13.566 92.781 1.00 13.20 H new ATOM 0 HB3 ALA A 240 24.359 14.294 91.575 1.00 13.20 H new ATOM 1864 N ARG A 241 21.341 15.119 91.966 1.00 10.49 N ATOM 1865 CA ARG A 241 20.436 16.187 91.560 1.00 9.88 C ATOM 1866 C ARG A 241 19.062 16.112 92.222 1.00 9.66 C ATOM 1867 O ARG A 241 18.198 16.928 91.931 1.00 9.99 O ATOM 1868 CB ARG A 241 20.239 16.094 90.043 1.00 10.82 C ATOM 1869 CG ARG A 241 21.499 16.407 89.215 1.00 10.52 C ATOM 1870 CD ARG A 241 21.366 15.913 87.779 1.00 11.63 C ATOM 1871 NE ARG A 241 20.185 16.465 87.122 1.00 11.15 N ATOM 1872 CZ ARG A 241 19.510 15.856 86.155 1.00 10.95 C ATOM 1873 NH1 ARG A 241 18.438 16.446 85.628 1.00 11.42 N ATOM 1874 NH2 ARG A 241 19.888 14.657 85.720 1.00 12.03 N ATOM 0 H ARG A 241 21.253 14.393 91.514 1.00 10.49 H new ATOM 0 HA ARG A 241 20.841 17.024 91.836 1.00 9.88 H new ATOM 0 HB2 ARG A 241 19.935 15.200 89.822 1.00 10.82 H new ATOM 0 HB3 ARG A 241 19.534 16.707 89.782 1.00 10.82 H new ATOM 0 HG2 ARG A 241 21.657 17.364 89.215 1.00 10.52 H new ATOM 0 HG3 ARG A 241 22.271 15.992 89.630 1.00 10.52 H new ATOM 0 HD2 ARG A 241 22.159 16.159 87.278 1.00 11.63 H new ATOM 0 HD3 ARG A 241 21.316 14.944 87.774 1.00 11.63 H new ATOM 0 HE ARG A 241 19.908 17.237 87.379 1.00 11.15 H new ATOM 0 HH11 ARG A 241 18.187 17.217 85.915 1.00 11.42 H new ATOM 0 HH12 ARG A 241 17.997 16.056 85.001 1.00 11.42 H new ATOM 0 HH21 ARG A 241 20.574 14.271 86.066 1.00 12.03 H new ATOM 0 HH22 ARG A 241 19.446 14.268 85.093 1.00 12.03 H new ATOM 1875 N VAL A 242 18.884 15.146 93.111 1.00 9.04 N ATOM 1876 CA VAL A 242 17.589 14.890 93.722 1.00 9.77 C ATOM 1877 C VAL A 242 17.560 15.053 95.226 1.00 9.63 C ATOM 1878 O VAL A 242 18.471 14.620 95.923 1.00 10.46 O ATOM 1879 CB VAL A 242 17.148 13.449 93.353 1.00 8.90 C ATOM 1880 CG1 VAL A 242 15.792 13.114 93.967 1.00 10.16 C ATOM 1881 CG2 VAL A 242 17.075 13.305 91.831 1.00 11.16 C ATOM 0 H VAL A 242 19.510 14.620 93.377 1.00 9.04 H new ATOM 0 HA VAL A 242 16.980 15.559 93.373 1.00 9.77 H new ATOM 0 HB VAL A 242 17.804 12.830 93.709 1.00 8.90 H new ATOM 0 HG11 VAL A 242 15.540 12.210 93.722 1.00 10.16 H new ATOM 0 HG12 VAL A 242 15.848 13.183 94.933 1.00 10.16 H new ATOM 0 HG13 VAL A 242 15.125 13.736 93.637 1.00 10.16 H new ATOM 0 HG21 VAL A 242 16.799 12.403 91.604 1.00 11.16 H new ATOM 0 HG22 VAL A 242 16.432 13.938 91.476 1.00 11.16 H new ATOM 0 HG23 VAL A 242 17.948 13.482 91.447 1.00 11.16 H new ATOM 1882 N THR A 243 16.473 15.633 95.715 1.00 8.72 N ATOM 1883 CA THR A 243 16.273 15.860 97.138 1.00 8.74 C ATOM 1884 C THR A 243 14.867 15.462 97.541 1.00 9.10 C ATOM 1885 O THR A 243 13.900 15.685 96.801 1.00 9.02 O ATOM 1886 CB THR A 243 16.449 17.357 97.498 1.00 9.52 C ATOM 1887 OG1 THR A 243 17.798 17.742 97.225 1.00 10.44 O ATOM 1888 CG2 THR A 243 16.150 17.620 98.976 1.00 9.55 C ATOM 0 H THR A 243 15.823 15.909 95.224 1.00 8.72 H new ATOM 0 HA THR A 243 16.933 15.326 97.606 1.00 8.74 H new ATOM 0 HB THR A 243 15.824 17.873 96.965 1.00 9.52 H new ATOM 0 HG1 THR A 243 18.219 17.085 96.914 1.00 10.44 H new ATOM 0 HG21 THR A 243 16.269 18.563 99.168 1.00 9.55 H new ATOM 0 HG22 THR A 243 15.235 17.364 99.172 1.00 9.55 H new ATOM 0 HG23 THR A 243 16.756 17.100 99.526 1.00 9.55 H new ATOM 1889 N ALA A 244 14.779 14.814 98.699 1.00 8.59 N ATOM 1890 CA ALA A 244 13.498 14.463 99.293 1.00 8.59 C ATOM 1891 C ALA A 244 13.378 15.331 100.547 1.00 8.19 C ATOM 1892 O ALA A 244 14.113 15.133 101.530 1.00 8.46 O ATOM 1893 CB ALA A 244 13.464 12.980 99.659 1.00 10.12 C ATOM 0 H ALA A 244 15.461 14.567 99.161 1.00 8.59 H new ATOM 0 HA ALA A 244 12.763 14.616 98.679 1.00 8.59 H new ATOM 0 HB1 ALA A 244 12.605 12.763 100.053 1.00 10.12 H new ATOM 0 HB2 ALA A 244 13.597 12.446 98.860 1.00 10.12 H new ATOM 0 HB3 ALA A 244 14.169 12.788 100.297 1.00 10.12 H new ATOM 1894 N SER A 245 12.492 16.317 100.498 1.00 7.78 N ATOM 1895 CA SER A 245 12.276 17.196 101.643 1.00 8.97 C ATOM 1896 C SER A 245 11.256 16.589 102.605 1.00 8.84 C ATOM 1897 O SER A 245 10.286 15.922 102.195 1.00 9.57 O ATOM 1898 CB SER A 245 11.776 18.573 101.192 1.00 9.18 C ATOM 1899 OG SER A 245 12.831 19.385 100.693 1.00 10.36 O ATOM 0 H SER A 245 12.005 16.495 99.812 1.00 7.78 H new ATOM 0 HA SER A 245 13.128 17.298 102.095 1.00 8.97 H new ATOM 0 HB2 SER A 245 11.101 18.462 100.504 1.00 9.18 H new ATOM 0 HB3 SER A 245 11.349 19.022 101.938 1.00 9.18 H new ATOM 0 HG SER A 245 12.828 19.364 99.853 1.00 10.36 H new ATOM 1900 N HIS A 246 11.494 16.858 103.885 1.00 8.86 N ATOM 1901 CA HIS A 246 10.670 16.422 105.004 1.00 9.15 C ATOM 1902 C HIS A 246 10.762 14.958 105.414 1.00 9.07 C ATOM 1903 O HIS A 246 11.361 14.652 106.451 1.00 9.31 O ATOM 1904 CB HIS A 246 9.195 16.789 104.778 1.00 10.22 C ATOM 1905 CG HIS A 246 8.919 18.260 104.846 1.00 10.77 C ATOM 1906 ND1 HIS A 246 9.108 19.002 105.994 1.00 11.64 N ATOM 1907 CD2 HIS A 246 8.430 19.117 103.920 1.00 11.78 C ATOM 1908 CE1 HIS A 246 8.738 20.251 105.772 1.00 12.42 C ATOM 1909 NE2 HIS A 246 8.324 20.349 104.521 1.00 11.80 N ATOM 0 H HIS A 246 12.173 17.322 104.135 1.00 8.86 H new ATOM 0 HA HIS A 246 11.055 16.910 105.749 1.00 9.15 H new ATOM 0 HB2 HIS A 246 8.917 16.456 103.910 1.00 10.22 H new ATOM 0 HB3 HIS A 246 8.653 16.336 105.442 1.00 10.22 H new ATOM 0 HD2 HIS A 246 8.207 18.911 103.041 1.00 11.78 H new ATOM 0 HE1 HIS A 246 8.765 20.944 106.392 1.00 12.42 H new ATOM 0 HE2 HIS A 246 8.035 21.066 104.144 1.00 11.80 H new ATOM 1910 N THR A 247 10.190 14.065 104.600 1.00 9.07 N ATOM 1911 CA THR A 247 10.086 12.622 104.897 1.00 8.62 C ATOM 1912 C THR A 247 9.741 12.381 106.370 1.00 8.00 C ATOM 1913 O THR A 247 10.275 11.480 107.022 1.00 8.88 O ATOM 1914 CB THR A 247 11.338 11.783 104.462 1.00 8.88 C ATOM 1915 OG1 THR A 247 12.512 12.162 105.187 1.00 9.17 O ATOM 1916 CG2 THR A 247 11.573 11.964 102.965 1.00 9.15 C ATOM 0 H THR A 247 9.843 14.282 103.843 1.00 9.07 H new ATOM 0 HA THR A 247 9.355 12.298 104.348 1.00 8.62 H new ATOM 0 HB THR A 247 11.159 10.851 104.662 1.00 8.88 H new ATOM 0 HG1 THR A 247 12.328 12.795 105.708 1.00 9.17 H new ATOM 0 HG21 THR A 247 12.347 11.446 102.694 1.00 9.15 H new ATOM 0 HG22 THR A 247 10.793 11.659 102.476 1.00 9.15 H new ATOM 0 HG23 THR A 247 11.729 12.902 102.773 1.00 9.15 H new ATOM 1917 N THR A 248 8.808 13.180 106.883 1.00 8.21 N ATOM 1918 CA THR A 248 8.420 13.035 108.285 1.00 7.73 C ATOM 1919 C THR A 248 7.699 11.715 108.553 1.00 8.39 C ATOM 1920 O THR A 248 7.729 11.217 109.684 1.00 8.16 O ATOM 1921 CB THR A 248 7.564 14.229 108.756 1.00 8.66 C ATOM 1922 OG1 THR A 248 6.417 14.354 107.912 1.00 9.60 O ATOM 1923 CG2 THR A 248 8.374 15.533 108.720 1.00 8.73 C ATOM 0 H THR A 248 8.396 13.798 106.449 1.00 8.21 H new ATOM 0 HA THR A 248 9.241 13.025 108.801 1.00 7.73 H new ATOM 0 HB THR A 248 7.285 14.067 109.671 1.00 8.66 H new ATOM 0 HG1 THR A 248 5.950 15.003 108.168 1.00 9.60 H new ATOM 0 HG21 THR A 248 7.817 16.269 109.019 1.00 8.73 H new ATOM 0 HG22 THR A 248 9.144 15.452 109.304 1.00 8.73 H new ATOM 0 HG23 THR A 248 8.673 15.703 107.813 1.00 8.73 H new ATOM 1924 N ALA A 249 7.089 11.117 107.532 1.00 7.69 N ATOM 1925 CA ALA A 249 6.438 9.831 107.734 1.00 7.45 C ATOM 1926 C ALA A 249 7.463 8.800 108.188 1.00 7.97 C ATOM 1927 O ALA A 249 7.109 7.839 108.872 1.00 8.36 O ATOM 1928 CB ALA A 249 5.781 9.366 106.430 1.00 8.93 C ATOM 0 H ALA A 249 7.042 11.432 106.733 1.00 7.69 H new ATOM 0 HA ALA A 249 5.755 9.927 108.417 1.00 7.45 H new ATOM 0 HB1 ALA A 249 5.350 8.509 106.572 1.00 8.93 H new ATOM 0 HB2 ALA A 249 5.120 10.018 106.150 1.00 8.93 H new ATOM 0 HB3 ALA A 249 6.457 9.276 105.741 1.00 8.93 H new ATOM 1929 N MET A 250 8.728 8.973 107.807 1.00 7.88 N ATOM 1930 CA MET A 250 9.751 8.006 108.196 1.00 8.39 C ATOM 1931 C MET A 250 9.859 7.891 109.720 1.00 9.57 C ATOM 1932 O MET A 250 10.274 6.855 110.245 1.00 10.46 O ATOM 1933 CB MET A 250 11.100 8.393 107.585 1.00 10.06 C ATOM 1934 CG MET A 250 12.092 7.243 107.531 1.00 10.97 C ATOM 1935 SD MET A 250 13.733 7.758 106.947 1.00 12.12 S ATOM 1936 CE MET A 250 13.382 8.270 105.317 1.00 12.24 C ATOM 0 H MET A 250 9.010 9.632 107.331 1.00 7.88 H new ATOM 0 HA MET A 250 9.491 7.136 107.855 1.00 8.39 H new ATOM 0 HB2 MET A 250 10.956 8.729 106.687 1.00 10.06 H new ATOM 0 HB3 MET A 250 11.485 9.119 108.101 1.00 10.06 H new ATOM 0 HG2 MET A 250 12.176 6.851 108.415 1.00 10.97 H new ATOM 0 HG3 MET A 250 11.747 6.551 106.945 1.00 10.97 H new ATOM 0 HE1 MET A 250 14.208 8.332 104.812 1.00 12.24 H new ATOM 0 HE2 MET A 250 12.793 7.625 104.895 1.00 12.24 H new ATOM 0 HE3 MET A 250 12.949 9.138 105.336 1.00 12.24 H new ATOM 1937 N HIS A 251 9.487 8.951 110.432 1.00 8.79 N ATOM 1938 CA HIS A 251 9.504 8.917 111.894 1.00 9.46 C ATOM 1939 C HIS A 251 8.542 7.862 112.439 1.00 10.80 C ATOM 1940 O HIS A 251 8.699 7.402 113.578 1.00 12.28 O ATOM 1941 CB HIS A 251 9.075 10.280 112.446 1.00 9.54 C ATOM 1942 CG HIS A 251 9.345 10.449 113.908 1.00 9.25 C ATOM 1943 ND1 HIS A 251 10.468 10.859 114.535 1.00 11.62 N flip ATOM 1944 CD2 HIS A 251 8.427 10.179 114.905 1.00 8.86 C flip ATOM 1945 CE1 HIS A 251 10.218 10.832 115.883 1.00 7.20 C flip ATOM 1946 NE2 HIS A 251 8.982 10.420 116.083 1.00 12.39 N flip ATOM 0 H HIS A 251 9.223 9.695 110.092 1.00 8.79 H new ATOM 0 HA HIS A 251 10.408 8.699 112.171 1.00 9.46 H new ATOM 0 HB2 HIS A 251 9.538 10.978 111.957 1.00 9.54 H new ATOM 0 HB3 HIS A 251 8.126 10.401 112.284 1.00 9.54 H new ATOM 0 HD1 HIS A 251 11.205 11.094 114.158 1.00 11.62 H new ATOM 0 HD2 HIS A 251 7.558 9.876 114.770 1.00 8.86 H new ATOM 0 HE1 HIS A 251 10.823 11.067 116.549 1.00 7.20 H new ATOM 1947 N SER A 252 7.552 7.488 111.631 1.00 9.62 N ATOM 1948 CA SER A 252 6.518 6.536 112.032 1.00 10.08 C ATOM 1949 C SER A 252 6.601 5.146 111.405 1.00 9.52 C ATOM 1950 O SER A 252 5.753 4.295 111.687 1.00 12.82 O ATOM 1951 CB SER A 252 5.152 7.143 111.736 1.00 11.62 C ATOM 1952 OG SER A 252 4.952 8.338 112.503 1.00 13.89 O ATOM 0 H SER A 252 7.461 7.782 110.828 1.00 9.62 H new ATOM 0 HA SER A 252 6.663 6.386 112.979 1.00 10.08 H new ATOM 0 HB2 SER A 252 5.081 7.345 110.790 1.00 11.62 H new ATOM 0 HB3 SER A 252 4.456 6.500 111.942 1.00 11.62 H new ATOM 0 HG SER A 252 5.198 9.004 112.054 1.00 13.89 H new ATOM 1953 N TYR A 253 7.613 4.905 110.578 1.00 9.12 N ATOM 1954 CA TYR A 253 7.773 3.598 109.941 1.00 9.34 C ATOM 1955 C TYR A 253 8.240 2.537 110.927 1.00 11.10 C ATOM 1956 O TYR A 253 8.906 2.844 111.913 1.00 11.78 O ATOM 1957 CB TYR A 253 8.857 3.634 108.873 1.00 9.27 C ATOM 1958 CG TYR A 253 8.619 4.442 107.619 1.00 8.34 C ATOM 1959 CD1 TYR A 253 7.367 4.948 107.286 1.00 8.80 C ATOM 1960 CD2 TYR A 253 9.681 4.683 106.751 1.00 8.13 C ATOM 1961 CE1 TYR A 253 7.182 5.689 106.104 1.00 7.98 C ATOM 1962 CE2 TYR A 253 9.514 5.408 105.587 1.00 7.62 C ATOM 1963 CZ TYR A 253 8.273 5.910 105.268 1.00 7.44 C ATOM 1964 OH TYR A 253 8.132 6.661 104.121 1.00 8.90 O ATOM 0 H TYR A 253 8.217 5.481 110.372 1.00 9.12 H new ATOM 0 HA TYR A 253 6.900 3.387 109.575 1.00 9.34 H new ATOM 0 HB2 TYR A 253 9.667 3.969 109.288 1.00 9.27 H new ATOM 0 HB3 TYR A 253 9.034 2.719 108.603 1.00 9.27 H new ATOM 0 HD1 TYR A 253 6.644 4.795 107.851 1.00 8.80 H new ATOM 0 HD2 TYR A 253 10.523 4.348 106.960 1.00 8.13 H new ATOM 0 HE1 TYR A 253 6.343 6.026 105.885 1.00 7.98 H new ATOM 0 HE2 TYR A 253 10.237 5.556 105.021 1.00 7.62 H new ATOM 0 HH TYR A 253 7.379 7.033 104.120 1.00 8.90 H new ATOM 1965 N ASN A 254 7.905 1.282 110.652 1.00 10.55 N ATOM 1966 CA ASN A 254 8.436 0.202 111.469 1.00 10.10 C ATOM 1967 C ASN A 254 9.933 0.103 111.107 1.00 10.14 C ATOM 1968 O ASN A 254 10.373 0.546 110.026 1.00 9.96 O ATOM 1969 CB ASN A 254 7.669 -1.124 111.240 1.00 9.86 C ATOM 1970 CG ASN A 254 7.757 -1.650 109.817 1.00 10.20 C ATOM 1971 OD1 ASN A 254 8.819 -2.089 109.361 1.00 11.43 O ATOM 1972 ND2 ASN A 254 6.624 -1.643 109.117 1.00 10.18 N ATOM 0 H ASN A 254 7.384 1.039 110.012 1.00 10.55 H new ATOM 0 HA ASN A 254 8.326 0.380 112.416 1.00 10.10 H new ATOM 0 HB2 ASN A 254 8.017 -1.797 111.846 1.00 9.86 H new ATOM 0 HB3 ASN A 254 6.736 -0.991 111.469 1.00 9.86 H new ATOM 0 HD21 ASN A 254 6.612 -1.952 108.315 1.00 10.18 H new ATOM 0 HD22 ASN A 254 5.904 -1.329 109.467 1.00 10.18 H new ATOM 1973 N GLY A 255 10.725 -0.458 112.014 1.00 9.43 N ATOM 1974 CA GLY A 255 12.161 -0.530 111.808 1.00 9.85 C ATOM 1975 C GLY A 255 12.639 -1.459 110.719 1.00 9.46 C ATOM 1976 O GLY A 255 13.673 -1.207 110.099 1.00 11.00 O ATOM 0 H GLY A 255 10.449 -0.801 112.753 1.00 9.43 H new ATOM 0 HA2 GLY A 255 12.484 0.363 111.609 1.00 9.85 H new ATOM 0 HA3 GLY A 255 12.574 -0.802 112.642 1.00 9.85 H new ATOM 1977 N ALA A 256 11.906 -2.542 110.476 1.00 9.60 N ATOM 1978 CA ALA A 256 12.304 -3.498 109.444 1.00 9.89 C ATOM 1979 C ALA A 256 12.218 -2.891 108.043 1.00 9.83 C ATOM 1980 O ALA A 256 13.160 -3.022 107.245 1.00 9.97 O ATOM 1981 CB ALA A 256 11.446 -4.741 109.546 1.00 10.41 C ATOM 0 H ALA A 256 11.181 -2.742 110.893 1.00 9.60 H new ATOM 0 HA ALA A 256 13.233 -3.736 109.592 1.00 9.89 H new ATOM 0 HB1 ALA A 256 11.711 -5.374 108.861 1.00 10.41 H new ATOM 0 HB2 ALA A 256 11.562 -5.144 110.421 1.00 10.41 H new ATOM 0 HB3 ALA A 256 10.514 -4.502 109.422 1.00 10.41 H new ATOM 1982 N TYR A 257 11.097 -2.236 107.743 1.00 8.78 N ATOM 1983 CA TYR A 257 10.978 -1.581 106.451 1.00 9.07 C ATOM 1984 C TYR A 257 12.043 -0.482 106.355 1.00 8.91 C ATOM 1985 O TYR A 257 12.683 -0.329 105.319 1.00 9.27 O ATOM 1986 CB TYR A 257 9.590 -0.965 106.267 1.00 8.87 C ATOM 1987 CG TYR A 257 9.521 -0.080 105.035 1.00 8.67 C ATOM 1988 CD1 TYR A 257 9.534 -0.631 103.753 1.00 8.93 C ATOM 1989 CD2 TYR A 257 9.515 1.308 105.154 1.00 9.37 C ATOM 1990 CE1 TYR A 257 9.545 0.194 102.620 1.00 8.86 C ATOM 1991 CE2 TYR A 257 9.529 2.135 104.029 1.00 9.55 C ATOM 1992 CZ TYR A 257 9.542 1.573 102.777 1.00 8.68 C ATOM 1993 OH TYR A 257 9.552 2.398 101.663 1.00 10.16 O ATOM 0 H TYR A 257 10.414 -2.162 108.260 1.00 8.78 H new ATOM 0 HA TYR A 257 11.107 -2.242 105.753 1.00 9.07 H new ATOM 0 HB2 TYR A 257 8.930 -1.672 106.194 1.00 8.87 H new ATOM 0 HB3 TYR A 257 9.361 -0.444 107.052 1.00 8.87 H new ATOM 0 HD1 TYR A 257 9.535 -1.555 103.649 1.00 8.93 H new ATOM 0 HD2 TYR A 257 9.501 1.692 106.001 1.00 9.37 H new ATOM 0 HE1 TYR A 257 9.554 -0.180 101.769 1.00 8.86 H new ATOM 0 HE2 TYR A 257 9.530 3.060 104.127 1.00 9.55 H new ATOM 0 HH TYR A 257 9.497 1.930 100.967 1.00 10.16 H new ATOM 1994 N THR A 258 12.236 0.298 107.417 1.00 9.39 N ATOM 1995 CA THR A 258 13.242 1.362 107.349 1.00 8.94 C ATOM 1996 C THR A 258 14.631 0.804 107.031 1.00 9.78 C ATOM 1997 O THR A 258 15.370 1.385 106.239 1.00 9.91 O ATOM 1998 CB THR A 258 13.283 2.168 108.663 1.00 9.80 C ATOM 1999 OG1 THR A 258 11.972 2.677 108.935 1.00 11.18 O ATOM 2000 CG2 THR A 258 14.241 3.352 108.549 1.00 10.87 C ATOM 0 H THR A 258 11.813 0.234 108.163 1.00 9.39 H new ATOM 0 HA THR A 258 12.983 1.956 106.627 1.00 8.94 H new ATOM 0 HB THR A 258 13.586 1.582 109.374 1.00 9.80 H new ATOM 0 HG1 THR A 258 11.494 2.064 109.253 1.00 11.18 H new ATOM 0 HG21 THR A 258 14.250 3.843 109.386 1.00 10.87 H new ATOM 0 HG22 THR A 258 15.134 3.028 108.355 1.00 10.87 H new ATOM 0 HG23 THR A 258 13.948 3.938 107.834 1.00 10.87 H new ATOM 2001 N SER A 259 15.000 -0.323 107.636 1.00 9.33 N ATOM 2002 CA SER A 259 16.298 -0.913 107.364 1.00 10.29 C ATOM 2003 C SER A 259 16.407 -1.310 105.887 1.00 8.57 C ATOM 2004 O SER A 259 17.434 -1.065 105.243 1.00 10.51 O ATOM 2005 CB SER A 259 16.516 -2.137 108.251 1.00 11.21 C ATOM 2006 OG SER A 259 17.831 -2.627 108.078 1.00 14.35 O ATOM 0 H SER A 259 14.516 -0.755 108.201 1.00 9.33 H new ATOM 0 HA SER A 259 16.983 -0.255 107.560 1.00 10.29 H new ATOM 0 HB2 SER A 259 16.369 -1.903 109.181 1.00 11.21 H new ATOM 0 HB3 SER A 259 15.873 -2.828 108.027 1.00 11.21 H new ATOM 0 HG SER A 259 17.947 -3.299 108.569 1.00 14.35 H new ATOM 2007 N ARG A 260 15.356 -1.914 105.347 1.00 9.31 N ATOM 2008 CA ARG A 260 15.373 -2.320 103.948 1.00 9.58 C ATOM 2009 C ARG A 260 15.525 -1.066 103.074 1.00 9.08 C ATOM 2010 O ARG A 260 16.367 -1.011 102.168 1.00 9.86 O ATOM 2011 CB ARG A 260 14.073 -3.073 103.617 1.00 9.48 C ATOM 2012 CG ARG A 260 14.109 -3.850 102.291 1.00 10.02 C ATOM 2013 CD ARG A 260 13.993 -2.919 101.088 1.00 10.39 C ATOM 2014 NE ARG A 260 12.620 -2.495 100.850 1.00 10.50 N ATOM 2015 CZ ARG A 260 12.274 -1.479 100.067 1.00 10.58 C ATOM 2016 NH1 ARG A 260 13.203 -0.754 99.463 1.00 11.23 N ATOM 2017 NH2 ARG A 260 10.991 -1.252 99.834 1.00 10.84 N ATOM 0 H ARG A 260 14.629 -2.097 105.769 1.00 9.31 H new ATOM 0 HA ARG A 260 16.119 -2.916 103.775 1.00 9.58 H new ATOM 0 HB2 ARG A 260 13.879 -3.693 104.337 1.00 9.48 H new ATOM 0 HB3 ARG A 260 13.342 -2.436 103.586 1.00 9.48 H new ATOM 0 HG2 ARG A 260 14.936 -4.353 102.233 1.00 10.02 H new ATOM 0 HG3 ARG A 260 13.384 -4.494 102.273 1.00 10.02 H new ATOM 0 HD2 ARG A 260 14.551 -2.138 101.230 1.00 10.39 H new ATOM 0 HD3 ARG A 260 14.332 -3.370 100.299 1.00 10.39 H new ATOM 0 HE ARG A 260 11.991 -2.931 101.242 1.00 10.50 H new ATOM 0 HH11 ARG A 260 14.035 -0.940 99.577 1.00 11.23 H new ATOM 0 HH12 ARG A 260 12.974 -0.097 98.957 1.00 11.23 H new ATOM 0 HH21 ARG A 260 10.393 -1.759 100.188 1.00 10.84 H new ATOM 0 HH22 ARG A 260 10.755 -0.597 99.329 1.00 10.84 H new ATOM 2018 N LEU A 261 14.723 -0.055 103.376 1.00 8.67 N ATOM 2019 CA LEU A 261 14.737 1.201 102.636 1.00 8.98 C ATOM 2020 C LEU A 261 16.104 1.889 102.635 1.00 8.08 C ATOM 2021 O LEU A 261 16.540 2.437 101.610 1.00 9.32 O ATOM 2022 CB LEU A 261 13.693 2.155 103.236 1.00 8.78 C ATOM 2023 CG LEU A 261 13.581 3.555 102.626 1.00 9.36 C ATOM 2024 CD1 LEU A 261 13.109 3.456 101.179 1.00 11.28 C ATOM 2025 CD2 LEU A 261 12.609 4.385 103.458 1.00 11.47 C ATOM 0 H LEU A 261 14.152 -0.077 104.019 1.00 8.67 H new ATOM 0 HA LEU A 261 14.527 0.986 101.714 1.00 8.98 H new ATOM 0 HB2 LEU A 261 12.824 1.729 103.168 1.00 8.78 H new ATOM 0 HB3 LEU A 261 13.887 2.255 104.181 1.00 8.78 H new ATOM 0 HG LEU A 261 14.449 3.987 102.631 1.00 9.36 H new ATOM 0 HD11 LEU A 261 13.040 4.346 100.799 1.00 11.28 H new ATOM 0 HD12 LEU A 261 13.745 2.934 100.666 1.00 11.28 H new ATOM 0 HD13 LEU A 261 12.241 3.025 101.150 1.00 11.28 H new ATOM 0 HD21 LEU A 261 12.533 5.274 103.077 1.00 11.47 H new ATOM 0 HD22 LEU A 261 11.738 3.959 103.459 1.00 11.47 H new ATOM 0 HD23 LEU A 261 12.937 4.451 104.369 1.00 11.47 H new ATOM 2026 N PHE A 262 16.771 1.891 103.786 1.00 9.25 N ATOM 2027 CA PHE A 262 18.059 2.571 103.902 1.00 9.21 C ATOM 2028 C PHE A 262 19.107 2.111 102.896 1.00 9.19 C ATOM 2029 O PHE A 262 19.926 2.922 102.447 1.00 10.26 O ATOM 2030 CB PHE A 262 18.597 2.478 105.348 1.00 9.96 C ATOM 2031 CG PHE A 262 18.325 3.710 106.182 1.00 9.91 C ATOM 2032 CD1 PHE A 262 19.365 4.338 106.857 1.00 11.45 C ATOM 2033 CD2 PHE A 262 17.043 4.247 106.273 1.00 11.19 C ATOM 2034 CE1 PHE A 262 19.135 5.485 107.609 1.00 12.42 C ATOM 2035 CE2 PHE A 262 16.806 5.399 107.027 1.00 11.26 C ATOM 2036 CZ PHE A 262 17.859 6.013 107.693 1.00 10.50 C ATOM 0 H PHE A 262 16.499 1.508 104.506 1.00 9.25 H new ATOM 0 HA PHE A 262 17.886 3.500 103.682 1.00 9.21 H new ATOM 0 HB2 PHE A 262 18.198 1.709 105.784 1.00 9.96 H new ATOM 0 HB3 PHE A 262 19.554 2.323 105.319 1.00 9.96 H new ATOM 0 HD1 PHE A 262 20.225 3.987 106.805 1.00 11.45 H new ATOM 0 HD2 PHE A 262 16.338 3.835 105.828 1.00 11.19 H new ATOM 0 HE1 PHE A 262 19.839 5.897 108.055 1.00 12.42 H new ATOM 0 HE2 PHE A 262 15.948 5.753 107.083 1.00 11.26 H new ATOM 0 HZ PHE A 262 17.706 6.780 108.196 1.00 10.50 H new ATOM 2037 N ARG A 263 19.088 0.838 102.518 1.00 9.55 N ATOM 2038 CA ARG A 263 20.050 0.357 101.520 1.00 10.49 C ATOM 2039 C ARG A 263 19.835 1.147 100.224 1.00 10.15 C ATOM 2040 O ARG A 263 20.794 1.631 99.615 1.00 10.38 O ATOM 2041 CB ARG A 263 19.841 -1.140 101.261 1.00 11.36 C ATOM 2042 CG ARG A 263 20.690 -1.702 100.119 1.00 14.12 C ATOM 2043 CD ARG A 263 20.546 -3.217 100.013 1.00 15.06 C ATOM 2044 NE ARG A 263 21.348 -3.762 98.917 1.00 18.01 N ATOM 2045 CZ ARG A 263 20.890 -3.993 97.694 1.00 16.98 C ATOM 2046 NH1 ARG A 263 21.705 -4.488 96.772 1.00 20.70 N ATOM 2047 NH2 ARG A 263 19.622 -3.750 97.389 1.00 14.22 N ATOM 0 H ARG A 263 18.541 0.245 102.816 1.00 9.55 H new ATOM 0 HA ARG A 263 20.955 0.486 101.844 1.00 10.49 H new ATOM 0 HB2 ARG A 263 20.044 -1.630 102.073 1.00 11.36 H new ATOM 0 HB3 ARG A 263 18.905 -1.296 101.062 1.00 11.36 H new ATOM 0 HG2 ARG A 263 20.423 -1.291 99.282 1.00 14.12 H new ATOM 0 HG3 ARG A 263 21.622 -1.473 100.263 1.00 14.12 H new ATOM 0 HD2 ARG A 263 20.818 -3.627 100.849 1.00 15.06 H new ATOM 0 HD3 ARG A 263 19.613 -3.445 99.876 1.00 15.06 H new ATOM 0 HE ARG A 263 22.173 -3.945 99.077 1.00 18.01 H new ATOM 0 HH11 ARG A 263 22.525 -4.657 96.969 1.00 20.70 H new ATOM 0 HH12 ARG A 263 21.414 -4.640 95.977 1.00 20.70 H new ATOM 0 HH21 ARG A 263 19.088 -3.439 97.987 1.00 14.22 H new ATOM 0 HH22 ARG A 263 19.334 -3.903 96.593 1.00 14.22 H new ATOM 2048 N LEU A 264 18.581 1.273 99.806 1.00 9.94 N ATOM 2049 CA LEU A 264 18.249 2.029 98.600 1.00 9.36 C ATOM 2050 C LEU A 264 18.586 3.510 98.754 1.00 10.16 C ATOM 2051 O LEU A 264 19.125 4.129 97.835 1.00 10.99 O ATOM 2052 CB LEU A 264 16.762 1.871 98.262 1.00 9.45 C ATOM 2053 CG LEU A 264 16.180 2.887 97.267 1.00 9.82 C ATOM 2054 CD1 LEU A 264 16.849 2.764 95.886 1.00 10.31 C ATOM 2055 CD2 LEU A 264 14.678 2.645 97.169 1.00 11.00 C ATOM 0 H LEU A 264 17.903 0.927 100.207 1.00 9.94 H new ATOM 0 HA LEU A 264 18.785 1.670 97.876 1.00 9.36 H new ATOM 0 HB2 LEU A 264 16.624 0.980 97.904 1.00 9.45 H new ATOM 0 HB3 LEU A 264 16.254 1.927 99.087 1.00 9.45 H new ATOM 0 HG LEU A 264 16.352 3.788 97.581 1.00 9.82 H new ATOM 0 HD11 LEU A 264 16.463 3.416 95.280 1.00 10.31 H new ATOM 0 HD12 LEU A 264 17.801 2.927 95.972 1.00 10.31 H new ATOM 0 HD13 LEU A 264 16.705 1.871 95.535 1.00 10.31 H new ATOM 0 HD21 LEU A 264 14.288 3.277 96.545 1.00 11.00 H new ATOM 0 HD22 LEU A 264 14.515 1.741 96.857 1.00 11.00 H new ATOM 0 HD23 LEU A 264 14.273 2.763 98.043 1.00 11.00 H new ATOM 2056 N LEU A 265 18.292 4.090 99.913 1.00 10.63 N ATOM 2057 CA LEU A 265 18.579 5.508 100.091 1.00 10.27 C ATOM 2058 C LEU A 265 20.061 5.767 99.886 1.00 11.52 C ATOM 2059 O LEU A 265 20.442 6.703 99.179 1.00 12.82 O ATOM 2060 CB LEU A 265 18.130 5.989 101.475 1.00 10.80 C ATOM 2061 CG LEU A 265 16.645 5.774 101.799 1.00 9.32 C ATOM 2062 CD1 LEU A 265 16.315 6.481 103.104 1.00 10.52 C ATOM 2063 CD2 LEU A 265 15.762 6.299 100.671 1.00 10.52 C ATOM 0 H LEU A 265 17.937 3.695 100.589 1.00 10.63 H new ATOM 0 HA LEU A 265 18.080 6.010 99.428 1.00 10.27 H new ATOM 0 HB2 LEU A 265 18.661 5.533 102.147 1.00 10.80 H new ATOM 0 HB3 LEU A 265 18.328 6.936 101.551 1.00 10.80 H new ATOM 0 HG LEU A 265 16.473 4.824 101.891 1.00 9.32 H new ATOM 0 HD11 LEU A 265 15.377 6.350 103.315 1.00 10.52 H new ATOM 0 HD12 LEU A 265 16.861 6.116 103.817 1.00 10.52 H new ATOM 0 HD13 LEU A 265 16.495 7.430 103.013 1.00 10.52 H new ATOM 0 HD21 LEU A 265 14.830 6.154 100.895 1.00 10.52 H new ATOM 0 HD22 LEU A 265 15.921 7.248 100.550 1.00 10.52 H new ATOM 0 HD23 LEU A 265 15.973 5.829 99.849 1.00 10.52 H new ATOM 2064 N LYS A 266 20.900 4.923 100.470 1.00 11.25 N ATOM 2065 CA LYS A 266 22.343 5.090 100.322 1.00 13.60 C ATOM 2066 C LYS A 266 22.786 4.879 98.874 1.00 13.55 C ATOM 2067 O LYS A 266 23.513 5.713 98.319 1.00 14.95 O ATOM 2068 CB LYS A 266 23.090 4.128 101.248 1.00 16.03 C ATOM 2069 CG LYS A 266 24.606 4.259 101.181 1.00 20.61 C ATOM 2070 CD LYS A 266 25.071 5.678 101.487 1.00 24.54 C ATOM 2071 CE LYS A 266 26.590 5.778 101.397 1.00 27.12 C ATOM 2072 NZ LYS A 266 27.092 7.177 101.515 1.00 29.58 N ATOM 0 H LYS A 266 20.660 4.253 100.952 1.00 11.25 H new ATOM 0 HA LYS A 266 22.561 6.002 100.571 1.00 13.60 H new ATOM 0 HB2 LYS A 266 22.801 4.282 102.161 1.00 16.03 H new ATOM 0 HB3 LYS A 266 22.843 3.218 101.022 1.00 16.03 H new ATOM 0 HG2 LYS A 266 25.011 3.644 101.812 1.00 20.61 H new ATOM 0 HG3 LYS A 266 24.913 4.002 100.297 1.00 20.61 H new ATOM 0 HD2 LYS A 266 24.664 6.299 100.863 1.00 24.54 H new ATOM 0 HD3 LYS A 266 24.777 5.935 102.375 1.00 24.54 H new ATOM 0 HE2 LYS A 266 26.986 5.238 102.098 1.00 27.12 H new ATOM 0 HE3 LYS A 266 26.884 5.405 100.551 1.00 27.12 H new ATOM 0 HZ1 LYS A 266 27.948 7.166 101.760 1.00 29.58 H new ATOM 0 HZ2 LYS A 266 27.014 7.588 100.729 1.00 29.58 H new ATOM 0 HZ3 LYS A 266 26.614 7.613 102.126 1.00 29.58 H new ATOM 2073 N MET A 267 22.338 3.786 98.257 1.00 11.70 N ATOM 2074 CA MET A 267 22.712 3.490 96.873 1.00 11.82 C ATOM 2075 C MET A 267 22.274 4.577 95.896 1.00 11.93 C ATOM 2076 O MET A 267 22.982 4.869 94.936 1.00 12.52 O ATOM 2077 CB MET A 267 22.102 2.156 96.423 1.00 13.07 C ATOM 2078 CG MET A 267 22.710 0.926 97.079 1.00 14.31 C ATOM 2079 SD MET A 267 21.794 -0.586 96.690 1.00 16.99 S ATOM 2080 CE MET A 267 22.221 -0.790 94.949 1.00 17.49 C ATOM 0 H MET A 267 21.818 3.205 98.620 1.00 11.70 H new ATOM 0 HA MET A 267 23.681 3.443 96.861 1.00 11.82 H new ATOM 0 HB2 MET A 267 21.150 2.170 96.610 1.00 13.07 H new ATOM 0 HB3 MET A 267 22.201 2.077 95.461 1.00 13.07 H new ATOM 0 HG2 MET A 267 23.630 0.828 96.787 1.00 14.31 H new ATOM 0 HG3 MET A 267 22.729 1.051 98.041 1.00 14.31 H new ATOM 0 HE1 MET A 267 21.907 -1.653 94.638 1.00 17.49 H new ATOM 0 HE2 MET A 267 21.802 -0.087 94.428 1.00 17.49 H new ATOM 0 HE3 MET A 267 23.184 -0.740 94.844 1.00 17.49 H new ATOM 2081 N SER A 268 21.111 5.171 96.144 1.00 10.55 N ATOM 2082 CA SER A 268 20.565 6.197 95.260 1.00 10.37 C ATOM 2083 C SER A 268 21.336 7.507 95.279 1.00 11.89 C ATOM 2084 O SER A 268 21.338 8.233 94.285 1.00 12.17 O ATOM 2085 CB SER A 268 19.094 6.485 95.615 1.00 11.61 C ATOM 2086 OG SER A 268 19.001 7.281 96.787 1.00 11.73 O ATOM 0 H SER A 268 20.618 4.992 96.826 1.00 10.55 H new ATOM 0 HA SER A 268 20.643 5.832 94.365 1.00 10.37 H new ATOM 0 HB2 SER A 268 18.662 6.940 94.875 1.00 11.61 H new ATOM 0 HB3 SER A 268 18.620 5.649 95.749 1.00 11.61 H new ATOM 0 HG SER A 268 19.503 6.965 97.381 1.00 11.73 H new ATOM 2087 N GLY A 269 21.965 7.815 96.406 1.00 11.40 N ATOM 2088 CA GLY A 269 22.705 9.056 96.527 1.00 11.10 C ATOM 2089 C GLY A 269 21.840 10.303 96.642 1.00 11.09 C ATOM 2090 O GLY A 269 22.375 11.405 96.533 1.00 11.73 O ATOM 0 H GLY A 269 21.974 7.319 97.109 1.00 11.40 H new ATOM 0 HA2 GLY A 269 23.278 9.002 97.307 1.00 11.10 H new ATOM 0 HA3 GLY A 269 23.285 9.149 95.755 1.00 11.10 H new ATOM 2091 N ILE A 270 20.529 10.165 96.866 1.00 9.79 N ATOM 2092 CA ILE A 270 19.704 11.370 96.972 1.00 9.37 C ATOM 2093 C ILE A 270 19.925 12.083 98.298 1.00 9.11 C ATOM 2094 O ILE A 270 20.488 11.522 99.239 1.00 10.38 O ATOM 2095 CB ILE A 270 18.173 11.090 96.764 1.00 9.60 C ATOM 2096 CG1 ILE A 270 17.570 10.352 97.964 1.00 9.87 C ATOM 2097 CG2 ILE A 270 17.962 10.337 95.444 1.00 10.00 C ATOM 2098 CD1 ILE A 270 16.037 10.263 97.886 1.00 10.41 C ATOM 0 H ILE A 270 20.114 9.417 96.956 1.00 9.79 H new ATOM 0 HA ILE A 270 19.993 11.948 96.249 1.00 9.37 H new ATOM 0 HB ILE A 270 17.700 11.935 96.705 1.00 9.60 H new ATOM 0 HG12 ILE A 270 17.942 9.457 98.010 1.00 9.87 H new ATOM 0 HG13 ILE A 270 17.824 10.808 98.782 1.00 9.87 H new ATOM 0 HG21 ILE A 270 17.016 10.165 95.317 1.00 10.00 H new ATOM 0 HG22 ILE A 270 18.294 10.875 94.708 1.00 10.00 H new ATOM 0 HG23 ILE A 270 18.443 9.495 95.471 1.00 10.00 H new ATOM 0 HD11 ILE A 270 15.700 9.790 98.663 1.00 10.41 H new ATOM 0 HD12 ILE A 270 15.661 11.157 97.865 1.00 10.41 H new ATOM 0 HD13 ILE A 270 15.781 9.786 97.081 1.00 10.41 H new ATOM 2099 N ASN A 271 19.509 13.340 98.343 1.00 8.66 N ATOM 2100 CA ASN A 271 19.654 14.193 99.519 1.00 8.21 C ATOM 2101 C ASN A 271 18.359 14.287 100.307 1.00 8.09 C ATOM 2102 O ASN A 271 17.280 14.145 99.748 1.00 9.06 O ATOM 2103 CB ASN A 271 20.050 15.606 99.077 1.00 9.21 C ATOM 2104 CG ASN A 271 21.293 15.611 98.242 1.00 10.13 C ATOM 2105 OD1 ASN A 271 22.382 15.425 98.764 1.00 11.46 O ATOM 2106 ND2 ASN A 271 21.139 15.795 96.928 1.00 12.32 N ATOM 0 H ASN A 271 19.127 13.731 97.679 1.00 8.66 H new ATOM 0 HA ASN A 271 20.337 13.800 100.085 1.00 8.21 H new ATOM 0 HB2 ASN A 271 19.322 16.001 98.572 1.00 9.21 H new ATOM 0 HB3 ASN A 271 20.186 16.162 99.860 1.00 9.21 H new ATOM 0 HD21 ASN A 271 21.825 15.786 96.409 1.00 12.32 H new ATOM 0 HD22 ASN A 271 20.354 15.923 96.601 1.00 12.32 H new ATOM 2107 N PHE A 272 18.484 14.587 101.598 1.00 9.10 N ATOM 2108 CA PHE A 272 17.341 14.734 102.487 1.00 8.65 C ATOM 2109 C PHE A 272 17.390 16.048 103.234 1.00 8.75 C ATOM 2110 O PHE A 272 18.451 16.476 103.716 1.00 8.72 O ATOM 2111 CB PHE A 272 17.332 13.576 103.496 1.00 8.82 C ATOM 2112 CG PHE A 272 17.061 12.251 102.864 1.00 8.31 C ATOM 2113 CD1 PHE A 272 15.768 11.770 102.784 1.00 10.86 C ATOM 2114 CD2 PHE A 272 18.089 11.531 102.264 1.00 10.03 C ATOM 2115 CE1 PHE A 272 15.493 10.583 102.106 1.00 11.72 C ATOM 2116 CE2 PHE A 272 17.824 10.344 101.584 1.00 11.84 C ATOM 2117 CZ PHE A 272 16.522 9.875 101.508 1.00 12.09 C ATOM 0 H PHE A 272 19.243 14.711 101.983 1.00 9.10 H new ATOM 0 HA PHE A 272 16.533 14.720 101.950 1.00 8.65 H new ATOM 0 HB2 PHE A 272 18.189 13.543 103.950 1.00 8.82 H new ATOM 0 HB3 PHE A 272 16.659 13.749 104.173 1.00 8.82 H new ATOM 0 HD1 PHE A 272 15.075 12.242 103.186 1.00 10.86 H new ATOM 0 HD2 PHE A 272 18.963 11.845 102.317 1.00 10.03 H new ATOM 0 HE1 PHE A 272 14.620 10.267 102.055 1.00 11.72 H new ATOM 0 HE2 PHE A 272 18.516 9.869 101.184 1.00 11.84 H new ATOM 0 HZ PHE A 272 16.339 9.084 101.055 1.00 12.09 H new ATOM 2118 N VAL A 273 16.238 16.696 103.330 1.00 8.20 N ATOM 2119 CA VAL A 273 16.119 17.921 104.097 1.00 8.28 C ATOM 2120 C VAL A 273 15.113 17.701 105.232 1.00 8.72 C ATOM 2121 O VAL A 273 13.997 17.226 105.009 1.00 9.19 O ATOM 2122 CB VAL A 273 15.600 19.122 103.252 1.00 8.10 C ATOM 2123 CG1 VAL A 273 15.413 20.346 104.151 1.00 10.68 C ATOM 2124 CG2 VAL A 273 16.580 19.443 102.128 1.00 9.58 C ATOM 0 H VAL A 273 15.508 16.439 102.954 1.00 8.20 H new ATOM 0 HA VAL A 273 17.008 18.134 104.421 1.00 8.28 H new ATOM 0 HB VAL A 273 14.746 18.883 102.859 1.00 8.10 H new ATOM 0 HG11 VAL A 273 15.090 21.091 103.621 1.00 10.68 H new ATOM 0 HG12 VAL A 273 14.769 20.141 104.847 1.00 10.68 H new ATOM 0 HG13 VAL A 273 16.262 20.583 104.557 1.00 10.68 H new ATOM 0 HG21 VAL A 273 16.245 20.192 101.610 1.00 9.58 H new ATOM 0 HG22 VAL A 273 17.443 19.673 102.507 1.00 9.58 H new ATOM 0 HG23 VAL A 273 16.676 18.669 101.551 1.00 9.58 H new ATOM 2125 N ALA A 274 15.523 18.035 106.447 1.00 8.10 N ATOM 2126 CA ALA A 274 14.643 17.999 107.618 1.00 8.53 C ATOM 2127 C ALA A 274 14.420 19.477 107.968 1.00 8.22 C ATOM 2128 O ALA A 274 15.329 20.294 107.803 1.00 8.88 O ATOM 2129 CB ALA A 274 15.314 17.267 108.776 1.00 10.20 C ATOM 0 H ALA A 274 16.325 18.292 106.622 1.00 8.10 H new ATOM 0 HA ALA A 274 13.813 17.528 107.444 1.00 8.53 H new ATOM 0 HB1 ALA A 274 14.717 17.254 109.540 1.00 10.20 H new ATOM 0 HB2 ALA A 274 15.517 16.357 108.509 1.00 10.20 H new ATOM 0 HB3 ALA A 274 16.135 17.724 109.016 1.00 10.20 H new ATOM 2130 N ASN A 275 13.233 19.830 108.448 1.00 8.26 N ATOM 2131 CA ASN A 275 12.909 21.229 108.756 1.00 8.15 C ATOM 2132 C ASN A 275 12.436 21.225 110.194 1.00 8.24 C ATOM 2133 O ASN A 275 11.244 21.320 110.468 1.00 8.40 O ATOM 2134 CB ASN A 275 11.819 21.689 107.791 1.00 10.52 C ATOM 2135 CG ASN A 275 12.304 21.670 106.349 1.00 11.70 C ATOM 2136 OD1 ASN A 275 11.791 20.916 105.499 1.00 17.75 O ATOM 2137 ND2 ASN A 275 13.313 22.460 106.073 1.00 9.42 N ATOM 0 H ASN A 275 12.595 19.275 108.605 1.00 8.26 H new ATOM 0 HA ASN A 275 13.658 21.837 108.655 1.00 8.15 H new ATOM 0 HB2 ASN A 275 11.043 21.114 107.880 1.00 10.52 H new ATOM 0 HB3 ASN A 275 11.535 22.586 108.026 1.00 10.52 H new ATOM 0 HD21 ASN A 275 13.646 22.471 105.280 1.00 9.42 H new ATOM 0 HD22 ASN A 275 13.642 22.967 106.685 1.00 9.42 H new ATOM 2138 N PRO A 276 13.386 21.171 111.146 1.00 8.19 N ATOM 2139 CA PRO A 276 13.062 21.104 112.574 1.00 8.86 C ATOM 2140 C PRO A 276 12.058 22.029 113.214 1.00 7.84 C ATOM 2141 O PRO A 276 11.222 21.563 114.000 1.00 8.35 O ATOM 2142 CB PRO A 276 14.424 21.204 113.266 1.00 10.71 C ATOM 2143 CG PRO A 276 15.421 20.867 112.235 1.00 12.40 C ATOM 2144 CD PRO A 276 14.836 21.322 110.929 1.00 8.07 C ATOM 0 HA PRO A 276 12.558 20.283 112.685 1.00 8.86 H new ATOM 0 HB2 PRO A 276 14.572 22.097 113.616 1.00 10.71 H new ATOM 0 HB3 PRO A 276 14.479 20.592 114.017 1.00 10.71 H new ATOM 0 HG2 PRO A 276 16.266 21.311 112.411 1.00 12.40 H new ATOM 0 HG3 PRO A 276 15.599 19.914 112.222 1.00 12.40 H new ATOM 0 HD2 PRO A 276 15.076 22.240 110.728 1.00 8.07 H new ATOM 0 HD3 PRO A 276 15.147 20.779 110.188 1.00 8.07 H new ATOM 2145 N LEU A 277 12.136 23.328 112.927 1.00 7.89 N ATOM 2146 CA LEU A 277 11.212 24.271 113.546 1.00 9.05 C ATOM 2147 C LEU A 277 9.774 24.021 113.122 1.00 8.58 C ATOM 2148 O LEU A 277 8.856 24.091 113.950 1.00 9.65 O ATOM 2149 CB LEU A 277 11.605 25.710 113.204 1.00 9.05 C ATOM 2150 CG LEU A 277 12.981 26.166 113.692 1.00 8.27 C ATOM 2151 CD1 LEU A 277 13.247 27.539 113.096 1.00 11.01 C ATOM 2152 CD2 LEU A 277 13.053 26.220 115.222 1.00 9.29 C ATOM 0 H LEU A 277 12.706 23.677 112.386 1.00 7.89 H new ATOM 0 HA LEU A 277 11.270 24.137 114.505 1.00 9.05 H new ATOM 0 HB2 LEU A 277 11.573 25.814 112.240 1.00 9.05 H new ATOM 0 HB3 LEU A 277 10.936 26.306 113.576 1.00 9.05 H new ATOM 0 HG LEU A 277 13.655 25.529 113.406 1.00 8.27 H new ATOM 0 HD11 LEU A 277 14.116 27.856 113.388 1.00 11.01 H new ATOM 0 HD12 LEU A 277 13.234 27.480 112.128 1.00 11.01 H new ATOM 0 HD13 LEU A 277 12.561 28.158 113.391 1.00 11.01 H new ATOM 0 HD21 LEU A 277 13.937 26.512 115.494 1.00 9.29 H new ATOM 0 HD22 LEU A 277 12.390 26.844 115.556 1.00 9.29 H new ATOM 0 HD23 LEU A 277 12.878 25.338 115.586 1.00 9.29 H new ATOM 2153 N VAL A 278 9.584 23.723 111.838 1.00 9.00 N ATOM 2154 CA VAL A 278 8.243 23.483 111.314 1.00 9.49 C ATOM 2155 C VAL A 278 7.772 22.066 111.634 1.00 8.10 C ATOM 2156 O VAL A 278 6.622 21.869 112.048 1.00 9.38 O ATOM 2157 CB VAL A 278 8.210 23.740 109.787 1.00 10.57 C ATOM 2158 CG1 VAL A 278 6.881 23.275 109.183 1.00 13.63 C ATOM 2159 CG2 VAL A 278 8.384 25.245 109.538 1.00 14.44 C ATOM 0 H VAL A 278 10.215 23.655 111.257 1.00 9.00 H new ATOM 0 HA VAL A 278 7.633 24.102 111.746 1.00 9.49 H new ATOM 0 HB VAL A 278 8.927 23.240 109.367 1.00 10.57 H new ATOM 0 HG11 VAL A 278 6.882 23.445 108.228 1.00 13.63 H new ATOM 0 HG12 VAL A 278 6.768 22.325 109.342 1.00 13.63 H new ATOM 0 HG13 VAL A 278 6.150 23.760 109.596 1.00 13.63 H new ATOM 0 HG21 VAL A 278 8.365 25.420 108.584 1.00 14.44 H new ATOM 0 HG22 VAL A 278 7.663 25.730 109.969 1.00 14.44 H new ATOM 0 HG23 VAL A 278 9.234 25.537 109.903 1.00 14.44 H new ATOM 2160 N ASN A 279 8.655 21.084 111.486 1.00 7.81 N ATOM 2161 CA ASN A 279 8.253 19.703 111.759 1.00 8.42 C ATOM 2162 C ASN A 279 7.778 19.490 113.208 1.00 9.08 C ATOM 2163 O ASN A 279 6.781 18.821 113.448 1.00 8.87 O ATOM 2164 CB ASN A 279 9.403 18.720 111.467 1.00 8.40 C ATOM 2165 CG ASN A 279 9.836 18.667 109.989 1.00 8.90 C ATOM 2166 OD1 ASN A 279 10.975 18.283 109.714 1.00 10.36 O ATOM 2167 ND2 ASN A 279 8.945 19.011 109.056 1.00 9.92 N ATOM 0 H ASN A 279 9.471 21.188 111.235 1.00 7.81 H new ATOM 0 HA ASN A 279 7.506 19.528 111.166 1.00 8.42 H new ATOM 0 HB2 ASN A 279 10.169 18.966 112.008 1.00 8.40 H new ATOM 0 HB3 ASN A 279 9.132 17.831 111.745 1.00 8.40 H new ATOM 0 HD21 ASN A 279 9.156 18.969 108.223 1.00 9.92 H new ATOM 0 HD22 ASN A 279 8.160 19.274 109.288 1.00 9.92 H new ATOM 2168 N ILE A 280 8.471 20.067 114.183 1.00 8.18 N ATOM 2169 CA ILE A 280 8.044 19.849 115.562 1.00 9.24 C ATOM 2170 C ILE A 280 6.684 20.498 115.827 1.00 8.69 C ATOM 2171 O ILE A 280 5.906 20.054 116.674 1.00 8.59 O ATOM 2172 CB ILE A 280 9.126 20.365 116.565 1.00 9.71 C ATOM 2173 CG1 ILE A 280 8.812 19.894 117.984 1.00 10.45 C ATOM 2174 CG2 ILE A 280 9.187 21.875 116.545 1.00 10.51 C ATOM 2175 CD1 ILE A 280 9.830 20.313 118.960 1.00 21.11 C ATOM 0 H ILE A 280 9.162 20.568 114.078 1.00 8.18 H new ATOM 0 HA ILE A 280 7.943 18.894 115.699 1.00 9.24 H new ATOM 0 HB ILE A 280 9.984 20.004 116.291 1.00 9.71 H new ATOM 0 HG12 ILE A 280 7.948 20.244 118.253 1.00 10.45 H new ATOM 0 HG13 ILE A 280 8.741 18.927 117.991 1.00 10.45 H new ATOM 0 HG21 ILE A 280 9.862 22.180 117.171 1.00 10.51 H new ATOM 0 HG22 ILE A 280 9.415 22.178 115.652 1.00 10.51 H new ATOM 0 HG23 ILE A 280 8.324 22.237 116.799 1.00 10.51 H new ATOM 0 HD11 ILE A 280 9.585 19.991 119.842 1.00 21.11 H new ATOM 0 HD12 ILE A 280 10.691 19.944 118.709 1.00 21.11 H new ATOM 0 HD13 ILE A 280 9.886 21.281 118.974 1.00 21.11 H new ATOM 2176 N HIS A 281 6.391 21.536 115.058 1.00 9.50 N ATOM 2177 CA HIS A 281 5.142 22.265 115.178 1.00 10.60 C ATOM 2178 C HIS A 281 3.982 21.585 114.431 1.00 9.91 C ATOM 2179 O HIS A 281 2.916 21.366 115.026 1.00 11.10 O ATOM 2180 CB HIS A 281 5.412 23.707 114.699 1.00 10.82 C ATOM 2181 CG HIS A 281 4.201 24.481 114.279 1.00 10.73 C ATOM 2182 ND1 HIS A 281 3.090 24.651 115.078 1.00 11.26 N ATOM 2183 CD2 HIS A 281 3.981 25.221 113.166 1.00 11.19 C ATOM 2184 CE1 HIS A 281 2.240 25.469 114.476 1.00 10.50 C ATOM 2185 NE2 HIS A 281 2.759 25.829 113.315 1.00 11.16 N ATOM 0 H HIS A 281 6.916 21.839 114.448 1.00 9.50 H new ATOM 0 HA HIS A 281 4.846 22.276 116.102 1.00 10.60 H new ATOM 0 HB2 HIS A 281 5.855 24.191 115.413 1.00 10.82 H new ATOM 0 HB3 HIS A 281 6.031 23.673 113.953 1.00 10.82 H new ATOM 0 HD2 HIS A 281 4.552 25.302 112.436 1.00 11.19 H new ATOM 0 HE1 HIS A 281 1.418 25.743 114.813 1.00 10.50 H new ATOM 0 HE2 HIS A 281 2.391 26.358 112.745 1.00 11.16 H new ATOM 2186 N LEU A 282 4.182 21.209 113.167 1.00 9.61 N ATOM 2187 CA LEU A 282 3.108 20.593 112.372 1.00 11.72 C ATOM 2188 C LEU A 282 2.904 19.104 112.527 1.00 10.06 C ATOM 2189 O LEU A 282 1.827 18.594 112.209 1.00 11.26 O ATOM 2190 CB LEU A 282 3.321 20.837 110.883 1.00 12.42 C ATOM 2191 CG LEU A 282 3.483 22.252 110.370 1.00 14.07 C ATOM 2192 CD1 LEU A 282 3.587 22.191 108.845 1.00 15.69 C ATOM 2193 CD2 LEU A 282 2.312 23.113 110.832 1.00 13.90 C ATOM 0 H LEU A 282 4.928 21.300 112.749 1.00 9.61 H new ATOM 0 HA LEU A 282 2.320 21.030 112.731 1.00 11.72 H new ATOM 0 HB2 LEU A 282 4.111 20.341 110.618 1.00 12.42 H new ATOM 0 HB3 LEU A 282 2.568 20.443 110.414 1.00 12.42 H new ATOM 0 HG LEU A 282 4.288 22.661 110.724 1.00 14.07 H new ATOM 0 HD11 LEU A 282 3.692 23.088 108.491 1.00 15.69 H new ATOM 0 HD12 LEU A 282 4.354 21.653 108.594 1.00 15.69 H new ATOM 0 HD13 LEU A 282 2.781 21.793 108.481 1.00 15.69 H new ATOM 0 HD21 LEU A 282 2.424 24.017 110.499 1.00 13.90 H new ATOM 0 HD22 LEU A 282 1.483 22.743 110.490 1.00 13.90 H new ATOM 0 HD23 LEU A 282 2.283 23.127 111.801 1.00 13.90 H new ATOM 2194 N GLN A 283 3.936 18.383 112.949 1.00 8.75 N ATOM 2195 CA GLN A 283 3.806 16.938 113.113 1.00 8.96 C ATOM 2196 C GLN A 283 3.312 16.613 114.505 1.00 9.81 C ATOM 2197 O GLN A 283 3.410 17.433 115.413 1.00 10.22 O ATOM 2198 CB GLN A 283 5.136 16.224 112.825 1.00 9.31 C ATOM 2199 CG GLN A 283 5.726 16.517 111.433 1.00 11.00 C ATOM 2200 CD GLN A 283 4.734 16.286 110.315 1.00 13.58 C ATOM 2201 OE1 GLN A 283 4.374 17.221 109.587 1.00 15.30 O ATOM 2202 NE2 GLN A 283 4.269 15.046 110.171 1.00 12.49 N ATOM 0 H GLN A 283 4.710 18.704 113.144 1.00 8.75 H new ATOM 0 HA GLN A 283 3.155 16.616 112.470 1.00 8.96 H new ATOM 0 HB2 GLN A 283 5.783 16.484 113.500 1.00 9.31 H new ATOM 0 HB3 GLN A 283 5.003 15.267 112.913 1.00 9.31 H new ATOM 0 HG2 GLN A 283 6.032 17.437 111.403 1.00 11.00 H new ATOM 0 HG3 GLN A 283 6.504 15.955 111.291 1.00 11.00 H new ATOM 0 HE21 GLN A 283 4.542 14.421 110.695 1.00 12.49 H new ATOM 0 HE22 GLN A 283 3.696 14.870 109.554 1.00 12.49 H new ATOM 2203 N GLY A 284 2.743 15.425 114.647 1.00 9.45 N ATOM 2204 CA GLY A 284 2.209 14.993 115.931 1.00 10.26 C ATOM 2205 C GLY A 284 0.884 15.636 116.289 1.00 10.33 C ATOM 2206 O GLY A 284 0.373 15.433 117.389 1.00 10.90 O ATOM 0 H GLY A 284 2.655 14.852 114.012 1.00 9.45 H new ATOM 0 HA2 GLY A 284 2.099 14.029 115.918 1.00 10.26 H new ATOM 0 HA3 GLY A 284 2.855 15.195 116.625 1.00 10.26 H new ATOM 2207 N ARG A 285 0.310 16.393 115.362 1.00 10.28 N ATOM 2208 CA ARG A 285 -0.952 17.077 115.614 1.00 10.66 C ATOM 2209 C ARG A 285 -2.184 16.171 115.680 1.00 11.11 C ATOM 2210 O ARG A 285 -3.239 16.612 116.140 1.00 12.95 O ATOM 2211 CB ARG A 285 -1.157 18.169 114.555 1.00 10.65 C ATOM 2212 CG ARG A 285 -0.198 19.338 114.708 1.00 11.24 C ATOM 2213 CD ARG A 285 -0.622 20.263 115.840 1.00 12.82 C ATOM 2214 NE ARG A 285 0.268 21.423 115.960 1.00 11.59 N ATOM 2215 CZ ARG A 285 0.026 22.486 116.721 1.00 12.94 C ATOM 2216 NH1 ARG A 285 -1.084 22.547 117.451 1.00 14.58 N ATOM 2217 NH2 ARG A 285 0.883 23.501 116.736 1.00 12.12 N ATOM 0 H ARG A 285 0.636 16.524 114.577 1.00 10.28 H new ATOM 0 HA ARG A 285 -0.873 17.456 116.503 1.00 10.66 H new ATOM 0 HB2 ARG A 285 -1.047 17.781 113.673 1.00 10.65 H new ATOM 0 HB3 ARG A 285 -2.068 18.497 114.609 1.00 10.65 H new ATOM 0 HG2 ARG A 285 0.696 19.004 114.879 1.00 11.24 H new ATOM 0 HG3 ARG A 285 -0.160 19.838 113.877 1.00 11.24 H new ATOM 0 HD2 ARG A 285 -1.530 20.567 115.686 1.00 12.82 H new ATOM 0 HD3 ARG A 285 -0.626 19.771 116.676 1.00 12.82 H new ATOM 0 HE ARG A 285 0.998 21.415 115.506 1.00 11.59 H new ATOM 0 HH11 ARG A 285 -1.648 21.898 117.432 1.00 14.58 H new ATOM 0 HH12 ARG A 285 -1.238 23.236 117.942 1.00 14.58 H new ATOM 0 HH21 ARG A 285 1.594 23.470 116.253 1.00 12.12 H new ATOM 0 HH22 ARG A 285 0.727 24.189 117.228 1.00 12.12 H new ATOM 2218 N PHE A 286 -2.061 14.921 115.243 1.00 10.80 N ATOM 2219 CA PHE A 286 -3.196 13.997 115.302 1.00 12.07 C ATOM 2220 C PHE A 286 -3.070 12.992 116.442 1.00 13.48 C ATOM 2221 O PHE A 286 -3.938 12.137 116.641 1.00 15.82 O ATOM 2222 CB PHE A 286 -3.393 13.310 113.948 1.00 12.45 C ATOM 2223 CG PHE A 286 -3.645 14.285 112.836 1.00 11.75 C ATOM 2224 CD1 PHE A 286 -2.591 14.820 112.101 1.00 12.83 C ATOM 2225 CD2 PHE A 286 -4.926 14.752 112.604 1.00 12.58 C ATOM 2226 CE1 PHE A 286 -2.816 15.818 111.153 1.00 13.52 C ATOM 2227 CE2 PHE A 286 -5.162 15.753 111.653 1.00 12.94 C ATOM 2228 CZ PHE A 286 -4.103 16.283 110.933 1.00 13.13 C ATOM 0 H PHE A 286 -1.340 14.589 114.912 1.00 10.80 H new ATOM 0 HA PHE A 286 -3.991 14.517 115.495 1.00 12.07 H new ATOM 0 HB2 PHE A 286 -2.606 12.783 113.739 1.00 12.45 H new ATOM 0 HB3 PHE A 286 -4.139 12.693 114.008 1.00 12.45 H new ATOM 0 HD1 PHE A 286 -1.726 14.508 112.244 1.00 12.83 H new ATOM 0 HD2 PHE A 286 -5.639 14.397 113.085 1.00 12.58 H new ATOM 0 HE1 PHE A 286 -2.104 16.171 110.670 1.00 13.52 H new ATOM 0 HE2 PHE A 286 -6.027 16.061 111.505 1.00 12.94 H new ATOM 0 HZ PHE A 286 -4.256 16.950 110.303 1.00 13.13 H new ATOM 2229 N ASP A 287 -1.976 13.108 117.193 1.00 12.00 N ATOM 2230 CA ASP A 287 -1.767 12.287 118.384 1.00 12.04 C ATOM 2231 C ASP A 287 -2.396 13.043 119.558 1.00 12.87 C ATOM 2232 O ASP A 287 -2.568 14.258 119.504 1.00 15.14 O ATOM 2233 CB ASP A 287 -0.279 12.163 118.737 1.00 11.48 C ATOM 2234 CG ASP A 287 0.478 11.233 117.832 1.00 11.71 C ATOM 2235 OD1 ASP A 287 -0.140 10.315 117.247 1.00 14.09 O ATOM 2236 OD2 ASP A 287 1.713 11.407 117.740 1.00 10.77 O ATOM 0 H ASP A 287 -1.338 13.661 117.028 1.00 12.00 H new ATOM 0 HA ASP A 287 -2.142 11.408 118.220 1.00 12.04 H new ATOM 0 HB2 ASP A 287 0.129 13.042 118.699 1.00 11.48 H new ATOM 0 HB3 ASP A 287 -0.196 11.851 119.652 1.00 11.48 H new ATOM 2237 N THR A 288 -2.748 12.318 120.610 1.00 14.88 N ATOM 2238 CA THR A 288 -3.207 12.987 121.816 1.00 15.53 C ATOM 2239 C THR A 288 -1.925 12.900 122.644 1.00 14.71 C ATOM 2240 O THR A 288 -1.042 13.740 122.487 1.00 17.22 O ATOM 2241 CB THR A 288 -4.398 12.257 122.494 1.00 17.04 C ATOM 2242 OG1 THR A 288 -4.122 10.863 122.638 1.00 19.29 O ATOM 2243 CG2 THR A 288 -5.660 12.447 121.652 1.00 19.99 C ATOM 0 H THR A 288 -2.730 11.459 120.647 1.00 14.88 H new ATOM 0 HA THR A 288 -3.558 13.881 121.681 1.00 15.53 H new ATOM 0 HB THR A 288 -4.532 12.637 123.376 1.00 17.04 H new ATOM 0 HG1 THR A 288 -4.775 10.485 123.007 1.00 19.29 H new ATOM 0 HG21 THR A 288 -6.404 11.991 122.076 1.00 19.99 H new ATOM 0 HG22 THR A 288 -5.861 13.393 121.579 1.00 19.99 H new ATOM 0 HG23 THR A 288 -5.517 12.078 120.766 1.00 19.99 H new ATOM 2244 N TYR A 289 -1.801 11.869 123.480 1.00 14.27 N ATOM 2245 CA TYR A 289 -0.599 11.646 124.288 1.00 13.70 C ATOM 2246 C TYR A 289 -0.367 10.140 124.386 1.00 13.90 C ATOM 2247 O TYR A 289 -1.312 9.379 124.608 1.00 16.49 O ATOM 2248 CB TYR A 289 -0.786 12.217 125.693 1.00 14.98 C ATOM 2249 CG TYR A 289 -0.580 13.702 125.789 1.00 16.01 C ATOM 2250 CD1 TYR A 289 0.707 14.240 125.839 1.00 19.30 C ATOM 2251 CD2 TYR A 289 -1.662 14.573 125.855 1.00 18.71 C ATOM 2252 CE1 TYR A 289 0.910 15.605 125.961 1.00 20.13 C ATOM 2253 CE2 TYR A 289 -1.474 15.944 125.975 1.00 19.88 C ATOM 2254 CZ TYR A 289 -0.185 16.452 126.032 1.00 21.13 C ATOM 2255 OH TYR A 289 0.009 17.803 126.185 1.00 24.09 O ATOM 0 H TYR A 289 -2.414 11.277 123.595 1.00 14.27 H new ATOM 0 HA TYR A 289 0.159 12.087 123.874 1.00 13.70 H new ATOM 0 HB2 TYR A 289 -1.681 12.005 126.001 1.00 14.98 H new ATOM 0 HB3 TYR A 289 -0.167 11.776 126.295 1.00 14.98 H new ATOM 0 HD1 TYR A 289 1.442 13.672 125.790 1.00 19.30 H new ATOM 0 HD2 TYR A 289 -2.526 14.232 125.818 1.00 18.71 H new ATOM 0 HE1 TYR A 289 1.773 15.950 125.995 1.00 20.13 H new ATOM 0 HE2 TYR A 289 -2.206 16.516 126.017 1.00 19.88 H new ATOM 0 HH TYR A 289 -0.735 18.192 126.212 1.00 24.09 H new ATOM 2256 N PRO A 290 0.881 9.671 124.200 1.00 12.45 N ATOM 2257 CA PRO A 290 2.083 10.455 123.901 1.00 12.42 C ATOM 2258 C PRO A 290 2.004 11.050 122.511 1.00 11.46 C ATOM 2259 O PRO A 290 1.204 10.614 121.680 1.00 12.86 O ATOM 2260 CB PRO A 290 3.206 9.434 124.047 1.00 12.36 C ATOM 2261 CG PRO A 290 2.546 8.143 123.636 1.00 15.30 C ATOM 2262 CD PRO A 290 1.213 8.242 124.334 1.00 14.12 C ATOM 0 HA PRO A 290 2.211 11.220 124.484 1.00 12.42 H new ATOM 0 HB2 PRO A 290 3.962 9.648 123.478 1.00 12.36 H new ATOM 0 HB3 PRO A 290 3.538 9.393 124.957 1.00 12.36 H new ATOM 0 HG2 PRO A 290 2.448 8.075 122.673 1.00 15.30 H new ATOM 0 HG3 PRO A 290 3.052 7.368 123.926 1.00 15.30 H new ATOM 0 HD2 PRO A 290 0.545 7.676 123.916 1.00 14.12 H new ATOM 0 HD3 PRO A 290 1.272 7.972 125.264 1.00 14.12 H new ATOM 2263 N LYS A 291 2.839 12.048 122.262 1.00 10.11 N ATOM 2264 CA LYS A 291 2.860 12.772 120.993 1.00 11.33 C ATOM 2265 C LYS A 291 4.219 12.583 120.331 1.00 9.63 C ATOM 2266 O LYS A 291 5.255 12.881 120.936 1.00 10.48 O ATOM 2267 CB LYS A 291 2.646 14.253 121.279 1.00 13.86 C ATOM 2268 CG LYS A 291 2.017 15.048 120.157 1.00 19.44 C ATOM 2269 CD LYS A 291 1.816 16.508 120.578 1.00 21.51 C ATOM 2270 CE LYS A 291 1.073 16.663 121.924 1.00 24.04 C ATOM 2271 NZ LYS A 291 -0.414 16.439 121.893 1.00 24.52 N ATOM 0 H LYS A 291 3.419 12.330 122.831 1.00 10.11 H new ATOM 0 HA LYS A 291 2.164 12.439 120.406 1.00 11.33 H new ATOM 0 HB2 LYS A 291 2.087 14.337 122.067 1.00 13.86 H new ATOM 0 HB3 LYS A 291 3.503 14.652 121.496 1.00 13.86 H new ATOM 0 HG2 LYS A 291 2.582 15.008 119.369 1.00 19.44 H new ATOM 0 HG3 LYS A 291 1.164 14.656 119.915 1.00 19.44 H new ATOM 0 HD2 LYS A 291 2.682 16.941 120.643 1.00 21.51 H new ATOM 0 HD3 LYS A 291 1.318 16.971 119.886 1.00 21.51 H new ATOM 0 HE2 LYS A 291 1.461 16.042 122.560 1.00 24.04 H new ATOM 0 HE3 LYS A 291 1.239 17.557 122.263 1.00 24.04 H new ATOM 0 HZ1 LYS A 291 -0.805 16.959 122.500 1.00 24.52 H new ATOM 0 HZ2 LYS A 291 -0.728 16.640 121.085 1.00 24.52 H new ATOM 0 HZ3 LYS A 291 -0.590 15.586 122.075 1.00 24.52 H new ATOM 2272 N ARG A 292 4.232 12.120 119.083 1.00 8.93 N ATOM 2273 CA ARG A 292 5.500 11.880 118.395 1.00 8.29 C ATOM 2274 C ARG A 292 6.181 13.183 117.983 1.00 8.33 C ATOM 2275 O ARG A 292 5.528 14.215 117.817 1.00 9.29 O ATOM 2276 CB ARG A 292 5.271 10.989 117.170 1.00 7.64 C ATOM 2277 CG ARG A 292 4.607 11.675 115.974 1.00 7.82 C ATOM 2278 CD ARG A 292 4.027 10.637 114.988 1.00 9.12 C ATOM 2279 NE ARG A 292 2.918 9.940 115.640 1.00 10.49 N ATOM 2280 CZ ARG A 292 2.600 8.667 115.452 1.00 13.14 C ATOM 2281 NH1 ARG A 292 3.293 7.904 114.613 1.00 15.89 N ATOM 2282 NH2 ARG A 292 1.587 8.146 116.133 1.00 15.54 N ATOM 0 H ARG A 292 3.529 11.940 118.622 1.00 8.93 H new ATOM 0 HA ARG A 292 6.092 11.428 119.016 1.00 8.29 H new ATOM 0 HB2 ARG A 292 6.126 10.632 116.885 1.00 7.64 H new ATOM 0 HB3 ARG A 292 4.723 10.234 117.436 1.00 7.64 H new ATOM 0 HG2 ARG A 292 3.899 12.260 116.285 1.00 7.82 H new ATOM 0 HG3 ARG A 292 5.255 12.233 115.516 1.00 7.82 H new ATOM 0 HD2 ARG A 292 3.719 11.076 114.180 1.00 9.12 H new ATOM 0 HD3 ARG A 292 4.713 10.004 114.724 1.00 9.12 H new ATOM 0 HE ARG A 292 2.434 10.392 116.189 1.00 10.49 H new ATOM 0 HH11 ARG A 292 3.960 8.235 114.182 1.00 15.89 H new ATOM 0 HH12 ARG A 292 3.075 7.080 114.501 1.00 15.89 H new ATOM 0 HH21 ARG A 292 1.146 8.633 116.688 1.00 15.54 H new ATOM 0 HH22 ARG A 292 1.371 7.321 116.019 1.00 15.54 H new ATOM 2283 N ARG A 293 7.499 13.123 117.831 1.00 9.41 N ATOM 2284 CA ARG A 293 8.268 14.306 117.439 1.00 8.91 C ATOM 2285 C ARG A 293 8.035 14.604 115.965 1.00 9.48 C ATOM 2286 O ARG A 293 7.806 15.754 115.593 1.00 9.99 O ATOM 2287 CB ARG A 293 9.748 14.082 117.743 1.00 9.21 C ATOM 2288 CG ARG A 293 10.005 13.947 119.231 1.00 9.50 C ATOM 2289 CD ARG A 293 11.371 13.390 119.554 1.00 9.77 C ATOM 2290 NE ARG A 293 11.411 13.158 120.997 1.00 9.28 N ATOM 2291 CZ ARG A 293 12.365 13.589 121.818 1.00 8.93 C ATOM 2292 NH1 ARG A 293 13.408 14.276 121.362 1.00 8.94 N ATOM 2293 NH2 ARG A 293 12.225 13.394 123.119 1.00 9.44 N ATOM 0 H ARG A 293 7.968 12.412 117.949 1.00 9.41 H new ATOM 0 HA ARG A 293 7.973 15.077 117.949 1.00 8.91 H new ATOM 0 HB2 ARG A 293 10.054 13.282 117.288 1.00 9.21 H new ATOM 0 HB3 ARG A 293 10.266 14.823 117.392 1.00 9.21 H new ATOM 0 HG2 ARG A 293 9.910 14.817 119.649 1.00 9.50 H new ATOM 0 HG3 ARG A 293 9.328 13.371 119.619 1.00 9.50 H new ATOM 0 HD2 ARG A 293 11.528 12.564 119.070 1.00 9.77 H new ATOM 0 HD3 ARG A 293 12.066 14.012 119.287 1.00 9.77 H new ATOM 0 HE ARG A 293 10.766 12.707 121.343 1.00 9.28 H new ATOM 0 HH11 ARG A 293 13.475 14.449 120.522 1.00 8.94 H new ATOM 0 HH12 ARG A 293 14.016 14.547 121.907 1.00 8.94 H new ATOM 0 HH21 ARG A 293 11.526 12.994 123.421 1.00 9.44 H new ATOM 0 HH22 ARG A 293 12.833 13.667 123.663 1.00 9.44 H new ATOM 2294 N GLY A 294 8.116 13.584 115.117 1.00 9.46 N ATOM 2295 CA GLY A 294 7.814 13.792 113.710 1.00 9.58 C ATOM 2296 C GLY A 294 8.906 14.276 112.785 1.00 10.85 C ATOM 2297 O GLY A 294 8.599 14.719 111.681 1.00 11.70 O ATOM 0 H GLY A 294 8.339 12.781 115.331 1.00 9.46 H new ATOM 0 HA2 GLY A 294 7.482 12.952 113.356 1.00 9.58 H new ATOM 0 HA3 GLY A 294 7.085 14.429 113.659 1.00 9.58 H new ATOM 2298 N ILE A 295 10.159 14.235 113.214 1.00 10.75 N ATOM 2299 CA ILE A 295 11.244 14.634 112.327 1.00 10.75 C ATOM 2300 C ILE A 295 11.776 13.339 111.708 1.00 9.86 C ATOM 2301 O ILE A 295 11.729 12.272 112.323 1.00 9.84 O ATOM 2302 CB ILE A 295 12.383 15.399 113.086 1.00 11.82 C ATOM 2303 CG1 ILE A 295 11.882 16.773 113.552 1.00 14.53 C ATOM 2304 CG2 ILE A 295 13.564 15.664 112.162 1.00 13.22 C ATOM 2305 CD1 ILE A 295 10.693 16.748 114.468 1.00 19.47 C ATOM 0 H ILE A 295 10.401 13.984 114.000 1.00 10.75 H new ATOM 0 HA ILE A 295 10.922 15.253 111.653 1.00 10.75 H new ATOM 0 HB ILE A 295 12.647 14.845 113.837 1.00 11.82 H new ATOM 0 HG12 ILE A 295 12.609 17.230 114.003 1.00 14.53 H new ATOM 0 HG13 ILE A 295 11.658 17.301 112.770 1.00 14.53 H new ATOM 0 HG21 ILE A 295 14.257 16.137 112.649 1.00 13.22 H new ATOM 0 HG22 ILE A 295 13.916 14.821 111.837 1.00 13.22 H new ATOM 0 HG23 ILE A 295 13.272 16.203 111.410 1.00 13.22 H new ATOM 0 HD11 ILE A 295 10.450 17.656 114.708 1.00 19.47 H new ATOM 0 HD12 ILE A 295 9.947 16.322 114.018 1.00 19.47 H new ATOM 0 HD13 ILE A 295 10.913 16.250 115.271 1.00 19.47 H new ATOM 2306 N THR A 296 12.244 13.418 110.468 1.00 9.17 N ATOM 2307 CA THR A 296 12.777 12.235 109.806 1.00 8.40 C ATOM 2308 C THR A 296 13.996 11.682 110.561 1.00 8.90 C ATOM 2309 O THR A 296 14.492 12.295 111.519 1.00 9.16 O ATOM 2310 CB THR A 296 13.101 12.536 108.336 1.00 8.82 C ATOM 2311 OG1 THR A 296 13.315 11.292 107.657 1.00 9.45 O ATOM 2312 CG2 THR A 296 14.315 13.438 108.192 1.00 8.31 C ATOM 0 H THR A 296 12.262 14.138 109.997 1.00 9.17 H new ATOM 0 HA THR A 296 12.097 11.544 109.819 1.00 8.40 H new ATOM 0 HB THR A 296 12.354 13.013 107.942 1.00 8.82 H new ATOM 0 HG1 THR A 296 13.109 11.376 106.847 1.00 9.45 H new ATOM 0 HG21 THR A 296 14.486 13.604 107.252 1.00 8.31 H new ATOM 0 HG22 THR A 296 14.148 14.280 108.643 1.00 8.31 H new ATOM 0 HG23 THR A 296 15.088 13.007 108.589 1.00 8.31 H new ATOM 2313 N ARG A 297 14.471 10.523 110.129 1.00 8.98 N ATOM 2314 CA ARG A 297 15.549 9.820 110.830 1.00 9.10 C ATOM 2315 C ARG A 297 16.942 10.360 110.589 1.00 9.91 C ATOM 2316 O ARG A 297 17.828 9.668 110.076 1.00 10.55 O ATOM 2317 CB ARG A 297 15.453 8.338 110.480 1.00 9.68 C ATOM 2318 CG ARG A 297 14.120 7.743 110.879 1.00 10.90 C ATOM 2319 CD ARG A 297 14.110 6.214 110.759 1.00 13.42 C ATOM 2320 NE ARG A 297 12.769 5.715 111.051 1.00 14.30 N ATOM 2321 CZ ARG A 297 12.485 4.574 111.670 1.00 13.96 C ATOM 2322 NH1 ARG A 297 11.212 4.254 111.869 1.00 15.34 N ATOM 2323 NH2 ARG A 297 13.451 3.770 112.099 1.00 17.75 N ATOM 0 H ARG A 297 14.183 10.119 109.426 1.00 8.98 H new ATOM 0 HA ARG A 297 15.415 9.968 111.779 1.00 9.10 H new ATOM 0 HB2 ARG A 297 15.584 8.223 109.526 1.00 9.68 H new ATOM 0 HB3 ARG A 297 16.167 7.855 110.925 1.00 9.68 H new ATOM 0 HG2 ARG A 297 13.915 7.996 111.793 1.00 10.90 H new ATOM 0 HG3 ARG A 297 13.421 8.115 110.319 1.00 10.90 H new ATOM 0 HD2 ARG A 297 14.378 5.948 109.866 1.00 13.42 H new ATOM 0 HD3 ARG A 297 14.752 5.827 111.375 1.00 13.42 H new ATOM 0 HE ARG A 297 12.106 6.202 110.801 1.00 14.30 H new ATOM 0 HH11 ARG A 297 10.589 4.781 111.599 1.00 15.34 H new ATOM 0 HH12 ARG A 297 11.011 3.519 112.268 1.00 15.34 H new ATOM 0 HH21 ARG A 297 14.275 3.985 111.978 1.00 17.75 H new ATOM 0 HH22 ARG A 297 13.253 3.034 112.498 1.00 17.75 H new ATOM 2324 N VAL A 298 17.129 11.606 111.016 1.00 9.03 N ATOM 2325 CA VAL A 298 18.385 12.320 110.840 1.00 9.93 C ATOM 2326 C VAL A 298 19.591 11.608 111.449 1.00 9.64 C ATOM 2327 O VAL A 298 20.625 11.467 110.796 1.00 9.92 O ATOM 2328 CB VAL A 298 18.272 13.756 111.426 1.00 9.58 C ATOM 2329 CG1 VAL A 298 19.618 14.495 111.256 1.00 10.63 C ATOM 2330 CG2 VAL A 298 17.120 14.515 110.735 1.00 8.70 C ATOM 0 H VAL A 298 16.523 12.063 111.420 1.00 9.03 H new ATOM 0 HA VAL A 298 18.541 12.356 109.883 1.00 9.93 H new ATOM 0 HB VAL A 298 18.072 13.709 112.374 1.00 9.58 H new ATOM 0 HG11 VAL A 298 19.544 15.390 111.622 1.00 10.63 H new ATOM 0 HG12 VAL A 298 20.315 14.010 111.725 1.00 10.63 H new ATOM 0 HG13 VAL A 298 19.841 14.549 110.314 1.00 10.63 H new ATOM 0 HG21 VAL A 298 17.054 15.410 111.104 1.00 8.70 H new ATOM 0 HG22 VAL A 298 17.295 14.571 109.782 1.00 8.70 H new ATOM 0 HG23 VAL A 298 16.286 14.042 110.883 1.00 8.70 H new ATOM 2331 N LYS A 299 19.470 11.176 112.700 1.00 10.70 N ATOM 2332 CA LYS A 299 20.580 10.505 113.362 1.00 11.02 C ATOM 2333 C LYS A 299 21.015 9.256 112.593 1.00 10.09 C ATOM 2334 O LYS A 299 22.216 9.041 112.368 1.00 11.12 O ATOM 2335 CB LYS A 299 20.178 10.140 114.795 1.00 12.40 C ATOM 2336 CG LYS A 299 21.264 9.387 115.557 1.00 12.55 C ATOM 2337 CD LYS A 299 20.855 9.055 116.989 1.00 16.40 C ATOM 2338 CE LYS A 299 20.843 10.286 117.876 1.00 15.68 C ATOM 2339 NZ LYS A 299 20.466 9.927 119.290 1.00 15.81 N ATOM 0 H LYS A 299 18.760 11.261 113.178 1.00 10.70 H new ATOM 0 HA LYS A 299 21.336 11.112 113.385 1.00 11.02 H new ATOM 0 HB2 LYS A 299 19.957 10.952 115.278 1.00 12.40 H new ATOM 0 HB3 LYS A 299 19.375 9.597 114.770 1.00 12.40 H new ATOM 0 HG2 LYS A 299 21.474 8.566 115.086 1.00 12.55 H new ATOM 0 HG3 LYS A 299 22.074 9.921 115.571 1.00 12.55 H new ATOM 0 HD2 LYS A 299 19.974 8.650 116.987 1.00 16.40 H new ATOM 0 HD3 LYS A 299 21.468 8.399 117.356 1.00 16.40 H new ATOM 0 HE2 LYS A 299 21.718 10.704 117.867 1.00 15.68 H new ATOM 0 HE3 LYS A 299 20.214 10.936 117.525 1.00 15.68 H new ATOM 0 HZ1 LYS A 299 20.535 10.647 119.808 1.00 15.81 H new ATOM 0 HZ2 LYS A 299 19.628 9.629 119.307 1.00 15.81 H new ATOM 0 HZ3 LYS A 299 21.012 9.292 119.591 1.00 15.81 H new ATOM 2340 N GLU A 300 20.048 8.442 112.183 1.00 10.83 N ATOM 2341 CA GLU A 300 20.372 7.221 111.451 1.00 10.65 C ATOM 2342 C GLU A 300 20.946 7.544 110.077 1.00 10.97 C ATOM 2343 O GLU A 300 21.857 6.864 109.613 1.00 11.48 O ATOM 2344 CB GLU A 300 19.134 6.331 111.354 1.00 12.64 C ATOM 2345 CG GLU A 300 18.722 5.765 112.716 1.00 16.35 C ATOM 2346 CD GLU A 300 18.120 6.807 113.675 1.00 19.35 C ATOM 2347 OE1 GLU A 300 18.128 6.526 114.896 1.00 22.86 O ATOM 2348 OE2 GLU A 300 17.629 7.883 113.234 1.00 21.54 O ATOM 0 H GLU A 300 19.209 8.575 112.316 1.00 10.83 H new ATOM 0 HA GLU A 300 21.057 6.734 111.936 1.00 10.65 H new ATOM 0 HB2 GLU A 300 18.398 6.842 110.982 1.00 12.64 H new ATOM 0 HB3 GLU A 300 19.310 5.600 110.741 1.00 12.64 H new ATOM 0 HG2 GLU A 300 18.075 5.055 112.578 1.00 16.35 H new ATOM 0 HG3 GLU A 300 19.498 5.363 113.137 1.00 16.35 H new ATOM 2349 N MET A 301 20.438 8.584 109.418 1.00 10.03 N ATOM 2350 CA MET A 301 21.001 8.959 108.130 1.00 11.27 C ATOM 2351 C MET A 301 22.478 9.318 108.283 1.00 11.28 C ATOM 2352 O MET A 301 23.316 8.876 107.495 1.00 11.35 O ATOM 2353 CB MET A 301 20.230 10.138 107.542 1.00 10.20 C ATOM 2354 CG MET A 301 18.860 9.749 107.027 1.00 9.79 C ATOM 2355 SD MET A 301 17.899 11.220 106.571 1.00 10.86 S ATOM 2356 CE MET A 301 16.339 10.445 105.999 1.00 11.33 C ATOM 0 H MET A 301 19.785 9.072 109.692 1.00 10.03 H new ATOM 0 HA MET A 301 20.926 8.204 107.525 1.00 11.27 H new ATOM 0 HB2 MET A 301 20.132 10.825 108.220 1.00 10.20 H new ATOM 0 HB3 MET A 301 20.745 10.526 106.817 1.00 10.20 H new ATOM 0 HG2 MET A 301 18.953 9.167 106.257 1.00 9.79 H new ATOM 0 HG3 MET A 301 18.385 9.246 107.707 1.00 9.79 H new ATOM 0 HE1 MET A 301 15.718 11.136 105.718 1.00 11.33 H new ATOM 0 HE2 MET A 301 16.525 9.855 105.252 1.00 11.33 H new ATOM 0 HE3 MET A 301 15.947 9.934 106.724 1.00 11.33 H new ATOM 2357 N LEU A 302 22.797 10.120 109.293 1.00 11.38 N ATOM 2358 CA LEU A 302 24.186 10.509 109.522 1.00 12.12 C ATOM 2359 C LEU A 302 25.057 9.280 109.782 1.00 12.64 C ATOM 2360 O LEU A 302 26.172 9.174 109.262 1.00 13.09 O ATOM 2361 CB LEU A 302 24.277 11.474 110.708 1.00 12.55 C ATOM 2362 CG LEU A 302 23.696 12.862 110.444 1.00 10.75 C ATOM 2363 CD1 LEU A 302 23.674 13.638 111.752 1.00 13.59 C ATOM 2364 CD2 LEU A 302 24.535 13.590 109.378 1.00 13.13 C ATOM 0 H LEU A 302 22.232 10.447 109.852 1.00 11.38 H new ATOM 0 HA LEU A 302 24.512 10.955 108.725 1.00 12.12 H new ATOM 0 HB2 LEU A 302 23.815 11.082 111.465 1.00 12.55 H new ATOM 0 HB3 LEU A 302 25.208 11.569 110.962 1.00 12.55 H new ATOM 0 HG LEU A 302 22.790 12.788 110.105 1.00 10.75 H new ATOM 0 HD11 LEU A 302 23.307 14.522 111.598 1.00 13.59 H new ATOM 0 HD12 LEU A 302 23.124 13.168 112.398 1.00 13.59 H new ATOM 0 HD13 LEU A 302 24.577 13.719 112.096 1.00 13.59 H new ATOM 0 HD21 LEU A 302 24.160 14.470 109.216 1.00 13.13 H new ATOM 0 HD22 LEU A 302 25.448 13.681 109.691 1.00 13.13 H new ATOM 0 HD23 LEU A 302 24.526 13.078 108.554 1.00 13.13 H new ATOM 2365 N GLU A 303 24.546 8.342 110.572 1.00 12.26 N ATOM 2366 CA GLU A 303 25.309 7.130 110.872 1.00 14.16 C ATOM 2367 C GLU A 303 25.525 6.274 109.628 1.00 14.24 C ATOM 2368 O GLU A 303 26.538 5.583 109.507 1.00 15.95 O ATOM 2369 CB GLU A 303 24.587 6.338 111.974 1.00 16.35 C ATOM 2370 CG GLU A 303 24.687 7.044 113.328 1.00 22.72 C ATOM 2371 CD GLU A 303 23.774 6.488 114.409 1.00 26.46 C ATOM 2372 OE1 GLU A 303 23.872 6.984 115.554 1.00 29.62 O ATOM 2373 OE2 GLU A 303 22.963 5.580 114.126 1.00 28.83 O ATOM 0 H GLU A 303 23.770 8.384 110.941 1.00 12.26 H new ATOM 0 HA GLU A 303 26.190 7.387 111.187 1.00 14.16 H new ATOM 0 HB2 GLU A 303 23.654 6.225 111.735 1.00 16.35 H new ATOM 0 HB3 GLU A 303 24.972 5.450 112.041 1.00 16.35 H new ATOM 0 HG2 GLU A 303 25.604 6.991 113.639 1.00 22.72 H new ATOM 0 HG3 GLU A 303 24.484 7.984 113.204 1.00 22.72 H new ATOM 2374 N SER A 304 24.590 6.344 108.686 1.00 13.37 N ATOM 2375 CA SER A 304 24.668 5.561 107.456 1.00 13.06 C ATOM 2376 C SER A 304 25.345 6.282 106.303 1.00 13.44 C ATOM 2377 O SER A 304 25.442 5.731 105.207 1.00 15.00 O ATOM 2378 CB SER A 304 23.265 5.145 107.012 1.00 15.15 C ATOM 2379 OG SER A 304 22.669 4.274 107.957 1.00 18.24 O ATOM 0 H SER A 304 23.894 6.846 108.741 1.00 13.37 H new ATOM 0 HA SER A 304 25.216 4.790 107.672 1.00 13.06 H new ATOM 0 HB2 SER A 304 22.711 5.933 106.900 1.00 15.15 H new ATOM 0 HB3 SER A 304 23.313 4.706 106.148 1.00 15.15 H new ATOM 0 HG SER A 304 21.840 4.409 107.979 1.00 18.24 H new ATOM 2380 N GLY A 305 25.798 7.509 106.544 1.00 12.63 N ATOM 2381 CA GLY A 305 26.454 8.267 105.493 1.00 13.68 C ATOM 2382 C GLY A 305 25.522 8.801 104.416 1.00 13.78 C ATOM 2383 O GLY A 305 25.951 9.059 103.290 1.00 14.31 O ATOM 0 H GLY A 305 25.735 7.914 107.300 1.00 12.63 H new ATOM 0 HA2 GLY A 305 26.924 9.014 105.895 1.00 13.68 H new ATOM 0 HA3 GLY A 305 27.123 7.703 105.074 1.00 13.68 H new ATOM 2384 N ILE A 306 24.241 8.959 104.748 1.00 12.27 N ATOM 2385 CA ILE A 306 23.242 9.492 103.819 1.00 12.45 C ATOM 2386 C ILE A 306 23.230 10.999 104.044 1.00 11.54 C ATOM 2387 O ILE A 306 23.149 11.455 105.188 1.00 12.07 O ATOM 2388 CB ILE A 306 21.856 8.903 104.142 1.00 11.51 C ATOM 2389 CG1 ILE A 306 21.826 7.420 103.754 1.00 13.04 C ATOM 2390 CG2 ILE A 306 20.761 9.679 103.409 1.00 11.85 C ATOM 2391 CD1 ILE A 306 20.656 6.647 104.351 1.00 13.32 C ATOM 0 H ILE A 306 23.925 8.759 105.522 1.00 12.27 H new ATOM 0 HA ILE A 306 23.451 9.267 102.899 1.00 12.45 H new ATOM 0 HB ILE A 306 21.690 8.981 105.094 1.00 11.51 H new ATOM 0 HG12 ILE A 306 21.789 7.349 102.787 1.00 13.04 H new ATOM 0 HG13 ILE A 306 22.655 7.004 104.038 1.00 13.04 H new ATOM 0 HG21 ILE A 306 19.895 9.297 103.622 1.00 11.85 H new ATOM 0 HG22 ILE A 306 20.781 10.608 103.687 1.00 11.85 H new ATOM 0 HG23 ILE A 306 20.911 9.625 102.452 1.00 11.85 H new ATOM 0 HD11 ILE A 306 20.700 5.721 104.065 1.00 13.32 H new ATOM 0 HD12 ILE A 306 20.701 6.689 105.319 1.00 13.32 H new ATOM 0 HD13 ILE A 306 19.821 7.039 104.049 1.00 13.32 H new ATOM 2392 N ASN A 307 23.304 11.784 102.972 1.00 11.28 N ATOM 2393 CA ASN A 307 23.328 13.229 103.138 1.00 10.57 C ATOM 2394 C ASN A 307 21.995 13.817 103.595 1.00 9.81 C ATOM 2395 O ASN A 307 20.977 13.710 102.905 1.00 11.28 O ATOM 2396 CB ASN A 307 23.781 13.917 101.854 1.00 9.62 C ATOM 2397 CG ASN A 307 24.065 15.389 102.074 1.00 9.39 C ATOM 2398 OD1 ASN A 307 24.872 15.736 102.930 1.00 12.79 O ATOM 2399 ND2 ASN A 307 23.399 16.261 101.323 1.00 9.73 N ATOM 0 H ASN A 307 23.340 11.506 102.159 1.00 11.28 H new ATOM 0 HA ASN A 307 23.968 13.399 103.847 1.00 10.57 H new ATOM 0 HB2 ASN A 307 24.579 13.480 101.517 1.00 9.62 H new ATOM 0 HB3 ASN A 307 23.096 13.818 101.175 1.00 9.62 H new ATOM 0 HD21 ASN A 307 23.527 17.105 101.428 1.00 9.73 H new ATOM 0 HD22 ASN A 307 22.840 15.981 100.732 1.00 9.73 H new ATOM 2400 N VAL A 308 22.028 14.439 104.768 1.00 9.32 N ATOM 2401 CA VAL A 308 20.856 15.065 105.357 1.00 8.89 C ATOM 2402 C VAL A 308 21.272 16.443 105.868 1.00 9.11 C ATOM 2403 O VAL A 308 22.414 16.649 106.305 1.00 9.31 O ATOM 2404 CB VAL A 308 20.250 14.166 106.475 1.00 8.66 C ATOM 2405 CG1 VAL A 308 21.281 13.904 107.570 1.00 10.82 C ATOM 2406 CG2 VAL A 308 18.973 14.798 107.023 1.00 10.14 C ATOM 0 H VAL A 308 22.739 14.509 105.247 1.00 9.32 H new ATOM 0 HA VAL A 308 20.153 15.173 104.697 1.00 8.89 H new ATOM 0 HB VAL A 308 20.010 13.305 106.098 1.00 8.66 H new ATOM 0 HG11 VAL A 308 20.888 13.344 108.257 1.00 10.82 H new ATOM 0 HG12 VAL A 308 22.051 13.455 107.189 1.00 10.82 H new ATOM 0 HG13 VAL A 308 21.559 14.747 107.961 1.00 10.82 H new ATOM 0 HG21 VAL A 308 18.604 14.231 107.718 1.00 10.14 H new ATOM 0 HG22 VAL A 308 19.177 15.671 107.393 1.00 10.14 H new ATOM 0 HG23 VAL A 308 18.326 14.894 106.307 1.00 10.14 H new ATOM 2407 N CYS A 309 20.352 17.396 105.785 1.00 8.03 N ATOM 2408 CA CYS A 309 20.629 18.768 106.182 1.00 8.72 C ATOM 2409 C CYS A 309 19.346 19.422 106.701 1.00 8.35 C ATOM 2410 O CYS A 309 18.263 18.841 106.583 1.00 8.67 O ATOM 2411 CB CYS A 309 21.195 19.544 104.975 1.00 9.20 C ATOM 2412 SG CYS A 309 20.024 19.755 103.596 1.00 9.41 S ATOM 0 H CYS A 309 19.552 17.265 105.498 1.00 8.03 H new ATOM 0 HA CYS A 309 21.287 18.781 106.894 1.00 8.72 H new ATOM 0 HB2 CYS A 309 21.485 20.420 105.275 1.00 9.20 H new ATOM 0 HB3 CYS A 309 21.982 19.081 104.648 1.00 9.20 H new ATOM 0 HG CYS A 309 19.059 20.358 103.978 1.00 9.41 H new ATOM 2413 N PHE A 310 19.473 20.641 107.230 1.00 9.48 N ATOM 2414 CA PHE A 310 18.337 21.334 107.831 1.00 8.22 C ATOM 2415 C PHE A 310 17.907 22.615 107.146 1.00 9.78 C ATOM 2416 O PHE A 310 18.741 23.448 106.787 1.00 9.97 O ATOM 2417 CB PHE A 310 18.629 21.734 109.297 1.00 9.76 C ATOM 2418 CG PHE A 310 18.757 20.589 110.279 1.00 8.95 C ATOM 2419 CD1 PHE A 310 18.163 19.359 110.062 1.00 11.79 C ATOM 2420 CD2 PHE A 310 19.403 20.802 111.492 1.00 11.18 C ATOM 2421 CE1 PHE A 310 18.203 18.355 111.042 1.00 12.13 C ATOM 2422 CE2 PHE A 310 19.448 19.806 112.477 1.00 12.50 C ATOM 2423 CZ PHE A 310 18.847 18.586 112.252 1.00 9.92 C ATOM 0 H PHE A 310 20.211 21.083 107.250 1.00 9.48 H new ATOM 0 HA PHE A 310 17.627 20.679 107.744 1.00 8.22 H new ATOM 0 HB2 PHE A 310 19.451 22.248 109.317 1.00 9.76 H new ATOM 0 HB3 PHE A 310 17.920 22.321 109.602 1.00 9.76 H new ATOM 0 HD1 PHE A 310 17.731 19.195 109.255 1.00 11.79 H new ATOM 0 HD2 PHE A 310 19.813 21.621 111.653 1.00 11.18 H new ATOM 0 HE1 PHE A 310 17.798 17.533 110.881 1.00 12.13 H new ATOM 0 HE2 PHE A 310 19.883 19.968 113.283 1.00 12.50 H new ATOM 0 HZ PHE A 310 18.872 17.923 112.904 1.00 9.92 H new ATOM 2424 N GLY A 311 16.596 22.772 106.992 1.00 9.02 N ATOM 2425 CA GLY A 311 16.056 24.003 106.437 1.00 9.06 C ATOM 2426 C GLY A 311 15.152 24.689 107.455 1.00 8.10 C ATOM 2427 O GLY A 311 14.689 24.056 108.422 1.00 9.23 O ATOM 0 H GLY A 311 16.007 22.181 107.202 1.00 9.02 H new ATOM 0 HA2 GLY A 311 16.780 24.597 106.186 1.00 9.06 H new ATOM 0 HA3 GLY A 311 15.555 23.809 105.629 1.00 9.06 H new ATOM 2428 N HIS A 312 14.884 25.978 107.248 1.00 8.52 N ATOM 2429 CA HIS A 312 14.000 26.726 108.139 1.00 8.58 C ATOM 2430 C HIS A 312 12.544 26.524 107.708 1.00 8.84 C ATOM 2431 O HIS A 312 11.629 26.572 108.543 1.00 9.01 O ATOM 2432 CB HIS A 312 14.375 28.229 108.137 1.00 9.95 C ATOM 2433 CG HIS A 312 13.748 29.024 109.244 1.00 9.89 C ATOM 2434 ND1 HIS A 312 12.449 29.200 109.577 1.00 12.25 N flip ATOM 2435 CD2 HIS A 312 14.477 29.796 110.130 1.00 7.02 C flip ATOM 2436 CE1 HIS A 312 12.416 30.072 110.640 1.00 7.59 C flip ATOM 2437 NE2 HIS A 312 13.652 30.418 110.954 1.00 12.11 N flip ATOM 0 H HIS A 312 15.205 26.438 106.596 1.00 8.52 H new ATOM 0 HA HIS A 312 14.105 26.395 109.045 1.00 8.58 H new ATOM 0 HB2 HIS A 312 15.339 28.311 108.201 1.00 9.95 H new ATOM 0 HB3 HIS A 312 14.113 28.616 107.287 1.00 9.95 H new ATOM 0 HD1 HIS A 312 11.770 28.835 109.195 1.00 12.25 H new ATOM 0 HD2 HIS A 312 15.404 29.867 110.144 1.00 7.02 H new ATOM 0 HE1 HIS A 312 11.647 30.370 111.069 1.00 7.59 H new ATOM 2438 N ASP A 313 12.359 26.278 106.406 1.00 9.44 N ATOM 2439 CA ASP A 313 11.074 26.036 105.753 1.00 11.29 C ATOM 2440 C ASP A 313 10.169 27.266 105.649 1.00 10.27 C ATOM 2441 O ASP A 313 9.873 27.723 104.546 1.00 10.16 O ATOM 2442 CB ASP A 313 10.331 24.883 106.451 1.00 12.09 C ATOM 2443 CG ASP A 313 9.233 24.272 105.582 1.00 14.63 C ATOM 2444 OD1 ASP A 313 8.548 23.351 106.072 1.00 14.10 O ATOM 2445 OD2 ASP A 313 9.062 24.691 104.414 1.00 15.64 O ATOM 0 H ASP A 313 13.017 26.247 105.854 1.00 9.44 H new ATOM 0 HA ASP A 313 11.288 25.794 104.838 1.00 11.29 H new ATOM 0 HB2 ASP A 313 10.968 24.193 106.692 1.00 12.09 H new ATOM 0 HB3 ASP A 313 9.940 25.209 107.277 1.00 12.09 H new ATOM 2446 N ALA A 314 9.745 27.816 106.774 1.00 9.99 N ATOM 2447 CA ALA A 314 8.844 28.950 106.754 1.00 9.87 C ATOM 2448 C ALA A 314 9.247 30.018 107.758 1.00 10.38 C ATOM 2449 O ALA A 314 9.774 29.713 108.835 1.00 10.94 O ATOM 2450 CB ALA A 314 7.425 28.466 107.060 1.00 12.01 C ATOM 0 H ALA A 314 9.968 27.547 107.560 1.00 9.99 H new ATOM 0 HA ALA A 314 8.885 29.350 105.871 1.00 9.87 H new ATOM 0 HB1 ALA A 314 6.816 29.221 107.048 1.00 12.01 H new ATOM 0 HB2 ALA A 314 7.152 27.820 106.390 1.00 12.01 H new ATOM 0 HB3 ALA A 314 7.407 28.050 107.936 1.00 12.01 H new ATOM 2451 N VAL A 315 9.002 31.276 107.397 1.00 10.99 N ATOM 2452 CA VAL A 315 9.293 32.410 108.272 1.00 11.78 C ATOM 2453 C VAL A 315 8.037 33.285 108.311 1.00 14.79 C ATOM 2454 O VAL A 315 7.702 33.960 107.330 1.00 14.55 O ATOM 2455 CB VAL A 315 10.528 33.206 107.771 1.00 11.89 C ATOM 2456 CG1 VAL A 315 10.729 34.461 108.618 1.00 14.20 C ATOM 2457 CG2 VAL A 315 11.771 32.326 107.862 1.00 11.67 C ATOM 0 H VAL A 315 8.662 31.496 106.638 1.00 10.99 H new ATOM 0 HA VAL A 315 9.516 32.103 109.165 1.00 11.78 H new ATOM 0 HB VAL A 315 10.380 33.470 106.849 1.00 11.89 H new ATOM 0 HG11 VAL A 315 11.503 34.949 108.295 1.00 14.20 H new ATOM 0 HG12 VAL A 315 9.942 35.024 108.554 1.00 14.20 H new ATOM 0 HG13 VAL A 315 10.870 34.208 109.544 1.00 14.20 H new ATOM 0 HG21 VAL A 315 12.543 32.823 107.549 1.00 11.67 H new ATOM 0 HG22 VAL A 315 11.911 32.058 108.784 1.00 11.67 H new ATOM 0 HG23 VAL A 315 11.650 31.537 107.311 1.00 11.67 H new ATOM 2458 N PHE A 316 7.335 33.236 109.446 1.00 15.22 N ATOM 2459 CA PHE A 316 6.078 33.957 109.695 1.00 18.57 C ATOM 2460 C PHE A 316 5.037 33.817 108.580 1.00 17.86 C ATOM 2461 O PHE A 316 4.702 34.786 107.878 1.00 18.61 O ATOM 2462 CB PHE A 316 6.338 35.436 109.995 1.00 19.01 C ATOM 2463 CG PHE A 316 5.154 36.133 110.624 1.00 19.53 C ATOM 2464 CD1 PHE A 316 4.371 37.027 109.893 1.00 20.07 C ATOM 2465 CD2 PHE A 316 4.787 35.849 111.937 1.00 20.55 C ATOM 2466 CE1 PHE A 316 3.236 37.622 110.464 1.00 20.40 C ATOM 2467 CE2 PHE A 316 3.660 36.434 112.518 1.00 21.16 C ATOM 2468 CZ PHE A 316 2.879 37.324 111.777 1.00 21.59 C ATOM 0 H PHE A 316 7.586 32.764 110.119 1.00 15.22 H new ATOM 0 HA PHE A 316 5.694 33.529 110.476 1.00 18.57 H new ATOM 0 HB2 PHE A 316 7.102 35.510 110.588 1.00 19.01 H new ATOM 0 HB3 PHE A 316 6.573 35.891 109.171 1.00 19.01 H new ATOM 0 HD1 PHE A 316 4.604 37.231 109.016 1.00 20.07 H new ATOM 0 HD2 PHE A 316 5.303 35.258 112.437 1.00 20.55 H new ATOM 0 HE1 PHE A 316 2.722 38.216 109.966 1.00 20.40 H new ATOM 0 HE2 PHE A 316 3.430 36.232 113.396 1.00 21.16 H new ATOM 0 HZ PHE A 316 2.126 37.715 112.158 1.00 21.59 H new ATOM 2469 N ASP A 317 4.511 32.606 108.420 1.00 18.38 N ATOM 2470 CA ASP A 317 3.520 32.327 107.383 1.00 18.63 C ATOM 2471 C ASP A 317 2.513 31.243 107.849 1.00 17.35 C ATOM 2472 O ASP A 317 2.543 30.846 109.017 1.00 17.43 O ATOM 2473 CB ASP A 317 4.250 31.957 106.081 1.00 18.85 C ATOM 2474 CG ASP A 317 4.722 30.526 106.040 1.00 17.10 C ATOM 2475 OD1 ASP A 317 5.358 30.147 105.035 1.00 18.71 O ATOM 2476 OD2 ASP A 317 4.458 29.762 106.996 1.00 19.08 O ATOM 0 H ASP A 317 4.716 31.927 108.906 1.00 18.38 H new ATOM 0 HA ASP A 317 2.987 33.119 107.210 1.00 18.63 H new ATOM 0 HB2 ASP A 317 3.657 32.116 105.330 1.00 18.85 H new ATOM 0 HB3 ASP A 317 5.013 32.545 105.969 1.00 18.85 H new ATOM 2477 N PRO A 318 1.626 30.737 106.956 1.00 17.17 N ATOM 2478 CA PRO A 318 0.645 29.719 107.371 1.00 17.68 C ATOM 2479 C PRO A 318 1.154 28.501 108.131 1.00 18.80 C ATOM 2480 O PRO A 318 0.429 27.924 108.950 1.00 18.32 O ATOM 2481 CB PRO A 318 -0.015 29.310 106.052 1.00 18.48 C ATOM 2482 CG PRO A 318 0.097 30.548 105.225 1.00 18.23 C ATOM 2483 CD PRO A 318 1.499 31.005 105.511 1.00 18.53 C ATOM 0 HA PRO A 318 0.057 30.108 108.037 1.00 17.68 H new ATOM 0 HB2 PRO A 318 0.441 28.560 105.639 1.00 18.48 H new ATOM 0 HB3 PRO A 318 -0.939 29.045 106.179 1.00 18.48 H new ATOM 0 HG2 PRO A 318 -0.038 30.366 104.282 1.00 18.23 H new ATOM 0 HG3 PRO A 318 -0.559 31.214 105.482 1.00 18.23 H new ATOM 0 HD2 PRO A 318 2.154 30.512 104.992 1.00 18.53 H new ATOM 0 HD3 PRO A 318 1.623 31.945 105.305 1.00 18.53 H new ATOM 2484 N TRP A 319 2.385 28.096 107.847 1.00 17.23 N ATOM 2485 CA TRP A 319 2.952 26.934 108.493 1.00 16.78 C ATOM 2486 C TRP A 319 3.887 27.239 109.663 1.00 16.55 C ATOM 2487 O TRP A 319 4.348 26.299 110.310 1.00 16.75 O ATOM 2488 CB TRP A 319 3.678 26.084 107.446 1.00 16.90 C ATOM 2489 CG TRP A 319 2.783 25.677 106.319 1.00 16.56 C ATOM 2490 CD1 TRP A 319 1.918 24.619 106.295 1.00 17.54 C ATOM 2491 CD2 TRP A 319 2.625 26.356 105.067 1.00 16.96 C ATOM 2492 NE1 TRP A 319 1.228 24.598 105.100 1.00 16.30 N ATOM 2493 CE2 TRP A 319 1.643 25.653 104.330 1.00 16.59 C ATOM 2494 CE3 TRP A 319 3.222 27.491 104.493 1.00 17.60 C ATOM 2495 CZ2 TRP A 319 1.240 26.049 103.049 1.00 17.28 C ATOM 2496 CZ3 TRP A 319 2.823 27.882 103.218 1.00 17.22 C ATOM 2497 CH2 TRP A 319 1.839 27.161 102.513 1.00 17.84 C ATOM 0 H TRP A 319 2.905 28.484 107.282 1.00 17.23 H new ATOM 0 HA TRP A 319 2.207 26.452 108.885 1.00 16.78 H new ATOM 0 HB2 TRP A 319 4.431 26.584 107.093 1.00 16.90 H new ATOM 0 HB3 TRP A 319 4.039 25.290 107.871 1.00 16.90 H new ATOM 0 HD1 TRP A 319 1.810 24.003 106.983 1.00 17.54 H new ATOM 0 HE1 TRP A 319 0.634 24.018 104.875 1.00 16.30 H new ATOM 0 HE3 TRP A 319 3.870 27.971 104.955 1.00 17.60 H new ATOM 0 HZ2 TRP A 319 0.591 25.576 102.579 1.00 17.28 H new ATOM 0 HZ3 TRP A 319 3.212 28.630 102.826 1.00 17.22 H new ATOM 0 HH2 TRP A 319 1.589 27.446 101.664 1.00 17.84 H new ATOM 2498 N TYR A 320 4.163 28.516 109.954 1.00 14.20 N ATOM 2499 CA TYR A 320 5.088 28.841 111.054 1.00 12.90 C ATOM 2500 C TYR A 320 5.029 30.307 111.466 1.00 12.74 C ATOM 2501 O TYR A 320 5.496 31.187 110.739 1.00 12.67 O ATOM 2502 CB TYR A 320 6.515 28.499 110.641 1.00 11.26 C ATOM 2503 CG TYR A 320 7.482 28.499 111.797 1.00 10.14 C ATOM 2504 CD1 TYR A 320 8.500 29.448 111.880 1.00 9.27 C ATOM 2505 CD2 TYR A 320 7.385 27.537 112.803 1.00 10.91 C ATOM 2506 CE1 TYR A 320 9.403 29.441 112.930 1.00 9.58 C ATOM 2507 CE2 TYR A 320 8.276 27.520 113.862 1.00 10.57 C ATOM 2508 CZ TYR A 320 9.280 28.475 113.917 1.00 8.77 C ATOM 2509 OH TYR A 320 10.167 28.487 114.960 1.00 9.47 O ATOM 0 H TYR A 320 3.836 29.195 109.540 1.00 14.20 H new ATOM 0 HA TYR A 320 4.812 28.312 111.819 1.00 12.90 H new ATOM 0 HB2 TYR A 320 6.523 27.625 110.220 1.00 11.26 H new ATOM 0 HB3 TYR A 320 6.815 29.138 109.976 1.00 11.26 H new ATOM 0 HD1 TYR A 320 8.574 30.097 111.218 1.00 9.27 H new ATOM 0 HD2 TYR A 320 6.711 26.897 112.761 1.00 10.91 H new ATOM 0 HE1 TYR A 320 10.082 30.075 112.972 1.00 9.58 H new ATOM 0 HE2 TYR A 320 8.202 26.876 114.529 1.00 10.57 H new ATOM 0 HH TYR A 320 9.988 27.858 115.487 1.00 9.47 H new ATOM 2510 N PRO A 321 4.518 30.587 112.671 1.00 14.66 N ATOM 2511 CA PRO A 321 4.384 31.952 113.175 1.00 14.81 C ATOM 2512 C PRO A 321 5.607 32.673 113.708 1.00 15.73 C ATOM 2513 O PRO A 321 5.487 33.803 114.174 1.00 19.00 O ATOM 2514 CB PRO A 321 3.326 31.795 114.264 1.00 16.01 C ATOM 2515 CG PRO A 321 3.720 30.485 114.872 1.00 15.60 C ATOM 2516 CD PRO A 321 4.010 29.612 113.656 1.00 15.59 C ATOM 0 HA PRO A 321 4.171 32.534 112.429 1.00 14.81 H new ATOM 0 HB2 PRO A 321 3.354 32.520 114.908 1.00 16.01 H new ATOM 0 HB3 PRO A 321 2.427 31.773 113.900 1.00 16.01 H new ATOM 0 HG2 PRO A 321 4.499 30.575 115.443 1.00 15.60 H new ATOM 0 HG3 PRO A 321 3.009 30.115 115.418 1.00 15.60 H new ATOM 0 HD2 PRO A 321 4.665 28.925 113.854 1.00 15.59 H new ATOM 0 HD3 PRO A 321 3.213 29.161 113.338 1.00 15.59 H new ATOM 2517 N LEU A 322 6.779 32.052 113.635 1.00 12.64 N ATOM 2518 CA LEU A 322 7.988 32.659 114.180 1.00 11.67 C ATOM 2519 C LEU A 322 9.129 32.724 113.165 1.00 11.31 C ATOM 2520 O LEU A 322 8.895 32.614 111.954 1.00 11.17 O ATOM 2521 CB LEU A 322 8.425 31.855 115.421 1.00 11.27 C ATOM 2522 CG LEU A 322 7.431 31.895 116.585 1.00 10.57 C ATOM 2523 CD1 LEU A 322 7.795 30.861 117.652 1.00 11.61 C ATOM 2524 CD2 LEU A 322 7.445 33.296 117.183 1.00 10.90 C ATOM 0 H LEU A 322 6.896 31.280 113.275 1.00 12.64 H new ATOM 0 HA LEU A 322 7.782 33.576 114.419 1.00 11.67 H new ATOM 0 HB2 LEU A 322 8.564 30.931 115.161 1.00 11.27 H new ATOM 0 HB3 LEU A 322 9.280 32.195 115.728 1.00 11.27 H new ATOM 0 HG LEU A 322 6.543 31.679 116.258 1.00 10.57 H new ATOM 0 HD11 LEU A 322 7.153 30.905 118.378 1.00 11.61 H new ATOM 0 HD12 LEU A 322 7.780 29.973 117.261 1.00 11.61 H new ATOM 0 HD13 LEU A 322 8.683 31.048 117.995 1.00 11.61 H new ATOM 0 HD21 LEU A 322 6.819 33.338 117.923 1.00 10.90 H new ATOM 0 HD22 LEU A 322 8.337 33.503 117.502 1.00 10.90 H new ATOM 0 HD23 LEU A 322 7.187 33.940 116.505 1.00 10.90 H new ATOM 2525 N GLY A 323 10.342 32.907 113.688 1.00 10.77 N ATOM 2526 CA GLY A 323 11.556 32.949 112.890 1.00 11.74 C ATOM 2527 C GLY A 323 12.220 34.274 112.573 1.00 11.33 C ATOM 2528 O GLY A 323 11.559 35.315 112.458 1.00 12.48 O ATOM 0 H GLY A 323 10.479 33.011 114.531 1.00 10.77 H new ATOM 0 HA2 GLY A 323 12.215 32.399 113.341 1.00 11.74 H new ATOM 0 HA3 GLY A 323 11.358 32.518 112.044 1.00 11.74 H new ATOM 2529 N THR A 324 13.546 34.227 112.475 1.00 10.96 N ATOM 2530 CA THR A 324 14.341 35.371 112.035 1.00 10.83 C ATOM 2531 C THR A 324 15.293 34.852 110.940 1.00 11.03 C ATOM 2532 O THR A 324 16.303 35.480 110.631 1.00 11.75 O ATOM 2533 CB THR A 324 15.155 36.032 113.175 1.00 10.94 C ATOM 2534 OG1 THR A 324 15.958 35.042 113.828 1.00 11.78 O ATOM 2535 CG2 THR A 324 14.227 36.719 114.175 1.00 11.23 C ATOM 0 H THR A 324 14.012 33.529 112.662 1.00 10.96 H new ATOM 0 HA THR A 324 13.743 36.062 111.709 1.00 10.83 H new ATOM 0 HB THR A 324 15.736 36.710 112.795 1.00 10.94 H new ATOM 0 HG1 THR A 324 16.768 35.176 113.650 1.00 11.78 H new ATOM 0 HG21 THR A 324 14.755 37.126 114.880 1.00 11.23 H new ATOM 0 HG22 THR A 324 13.712 37.404 113.721 1.00 11.23 H new ATOM 0 HG23 THR A 324 13.624 36.064 114.560 1.00 11.23 H new ATOM 2536 N ALA A 325 14.938 33.709 110.340 1.00 11.10 N ATOM 2537 CA ALA A 325 15.727 33.077 109.267 1.00 10.60 C ATOM 2538 C ALA A 325 17.149 32.768 109.728 1.00 11.41 C ATOM 2539 O ALA A 325 18.104 32.910 108.983 1.00 12.36 O ATOM 2540 CB ALA A 325 15.761 33.990 108.012 1.00 11.49 C ATOM 0 H ALA A 325 14.226 33.273 110.545 1.00 11.10 H new ATOM 0 HA ALA A 325 15.296 32.238 109.039 1.00 10.60 H new ATOM 0 HB1 ALA A 325 16.283 33.563 107.315 1.00 11.49 H new ATOM 0 HB2 ALA A 325 14.856 34.137 107.694 1.00 11.49 H new ATOM 0 HB3 ALA A 325 16.165 34.841 108.242 1.00 11.49 H new ATOM 2541 N ASN A 326 17.266 32.291 110.963 1.00 10.45 N ATOM 2542 CA ASN A 326 18.553 32.003 111.594 1.00 11.06 C ATOM 2543 C ASN A 326 18.887 30.510 111.575 1.00 9.94 C ATOM 2544 O ASN A 326 18.231 29.710 112.255 1.00 9.97 O ATOM 2545 CB ASN A 326 18.477 32.521 113.033 1.00 13.42 C ATOM 2546 CG ASN A 326 19.798 32.461 113.752 1.00 16.93 C ATOM 2547 OD1 ASN A 326 20.390 31.395 113.911 1.00 16.78 O ATOM 2548 ND2 ASN A 326 20.272 33.620 114.199 1.00 21.38 N ATOM 0 H ASN A 326 16.590 32.122 111.467 1.00 10.45 H new ATOM 0 HA ASN A 326 19.263 32.442 111.100 1.00 11.06 H new ATOM 0 HB2 ASN A 326 18.161 33.438 113.025 1.00 13.42 H new ATOM 0 HB3 ASN A 326 17.823 32.000 113.525 1.00 13.42 H new ATOM 0 HD21 ASN A 326 21.022 33.645 114.619 1.00 21.38 H new ATOM 0 HD22 ASN A 326 19.828 34.345 114.068 1.00 21.38 H new ATOM 2549 N MET A 327 19.924 30.131 110.827 1.00 9.79 N ATOM 2550 CA MET A 327 20.261 28.712 110.714 1.00 9.57 C ATOM 2551 C MET A 327 20.788 28.065 111.995 1.00 9.11 C ATOM 2552 O MET A 327 20.532 26.883 112.226 1.00 8.69 O ATOM 2553 CB MET A 327 21.228 28.467 109.553 1.00 9.95 C ATOM 2554 CG MET A 327 20.702 28.927 108.172 1.00 10.06 C ATOM 2555 SD MET A 327 18.927 28.647 107.818 1.00 10.90 S ATOM 2556 CE MET A 327 18.884 26.842 107.643 1.00 12.10 C ATOM 0 H MET A 327 20.434 30.665 110.387 1.00 9.79 H new ATOM 0 HA MET A 327 19.414 28.273 110.536 1.00 9.57 H new ATOM 0 HB2 MET A 327 22.062 28.927 109.739 1.00 9.95 H new ATOM 0 HB3 MET A 327 21.431 27.519 109.510 1.00 9.95 H new ATOM 0 HG2 MET A 327 20.880 29.876 108.083 1.00 10.06 H new ATOM 0 HG3 MET A 327 21.220 28.476 107.487 1.00 10.06 H new ATOM 0 HE1 MET A 327 17.977 26.557 107.449 1.00 12.10 H new ATOM 0 HE2 MET A 327 19.469 26.573 106.918 1.00 12.10 H new ATOM 0 HE3 MET A 327 19.182 26.429 108.469 1.00 12.10 H new ATOM 2557 N LEU A 328 21.512 28.806 112.829 1.00 9.43 N ATOM 2558 CA LEU A 328 21.982 28.222 114.086 1.00 8.86 C ATOM 2559 C LEU A 328 20.783 27.913 114.996 1.00 9.68 C ATOM 2560 O LEU A 328 20.846 27.001 115.821 1.00 9.59 O ATOM 2561 CB LEU A 328 22.970 29.158 114.803 1.00 9.74 C ATOM 2562 CG LEU A 328 24.410 29.147 114.264 1.00 10.13 C ATOM 2563 CD1 LEU A 328 25.231 30.211 115.006 1.00 11.47 C ATOM 2564 CD2 LEU A 328 25.039 27.763 114.444 1.00 11.33 C ATOM 0 H LEU A 328 21.738 29.625 112.694 1.00 9.43 H new ATOM 0 HA LEU A 328 22.451 27.398 113.882 1.00 8.86 H new ATOM 0 HB2 LEU A 328 22.629 30.064 114.749 1.00 9.74 H new ATOM 0 HB3 LEU A 328 22.992 28.919 115.743 1.00 9.74 H new ATOM 0 HG LEU A 328 24.401 29.350 113.316 1.00 10.13 H new ATOM 0 HD11 LEU A 328 26.141 30.210 114.671 1.00 11.47 H new ATOM 0 HD12 LEU A 328 24.835 31.085 114.861 1.00 11.47 H new ATOM 0 HD13 LEU A 328 25.236 30.012 115.955 1.00 11.47 H new ATOM 0 HD21 LEU A 328 25.946 27.772 114.100 1.00 11.33 H new ATOM 0 HD22 LEU A 328 25.054 27.534 115.386 1.00 11.33 H new ATOM 0 HD23 LEU A 328 24.517 27.104 113.960 1.00 11.33 H new ATOM 2565 N GLN A 329 19.690 28.656 114.843 1.00 9.30 N ATOM 2566 CA GLN A 329 18.487 28.406 115.646 1.00 8.32 C ATOM 2567 C GLN A 329 17.780 27.148 115.130 1.00 9.07 C ATOM 2568 O GLN A 329 17.280 26.342 115.919 1.00 8.96 O ATOM 2569 CB GLN A 329 17.570 29.618 115.573 1.00 9.08 C ATOM 2570 CG GLN A 329 16.383 29.571 116.508 1.00 9.97 C ATOM 2571 CD GLN A 329 15.584 30.837 116.393 1.00 10.49 C ATOM 2572 OE1 GLN A 329 14.723 30.968 115.527 1.00 11.08 O ATOM 2573 NE2 GLN A 329 15.889 31.802 117.245 1.00 12.58 N ATOM 0 H GLN A 329 19.621 29.306 114.285 1.00 9.30 H new ATOM 0 HA GLN A 329 18.730 28.261 116.574 1.00 8.32 H new ATOM 0 HB2 GLN A 329 18.089 30.413 115.770 1.00 9.08 H new ATOM 0 HB3 GLN A 329 17.246 29.708 114.663 1.00 9.08 H new ATOM 0 HG2 GLN A 329 15.824 28.807 116.295 1.00 9.97 H new ATOM 0 HG3 GLN A 329 16.687 29.454 117.422 1.00 9.97 H new ATOM 0 HE21 GLN A 329 16.498 31.675 117.839 1.00 12.58 H new ATOM 0 HE22 GLN A 329 15.478 32.557 117.205 1.00 12.58 H new ATOM 2574 N VAL A 330 17.746 26.979 113.811 1.00 8.52 N ATOM 2575 CA VAL A 330 17.168 25.789 113.192 1.00 9.46 C ATOM 2576 C VAL A 330 17.991 24.582 113.681 1.00 8.60 C ATOM 2577 O VAL A 330 17.425 23.572 114.097 1.00 9.12 O ATOM 2578 CB VAL A 330 17.251 25.844 111.642 1.00 8.93 C ATOM 2579 CG1 VAL A 330 16.778 24.514 111.052 1.00 9.17 C ATOM 2580 CG2 VAL A 330 16.384 26.973 111.099 1.00 9.26 C ATOM 0 H VAL A 330 18.057 27.551 113.249 1.00 8.52 H new ATOM 0 HA VAL A 330 16.231 25.726 113.436 1.00 9.46 H new ATOM 0 HB VAL A 330 18.173 26.006 111.389 1.00 8.93 H new ATOM 0 HG11 VAL A 330 16.831 24.552 110.084 1.00 9.17 H new ATOM 0 HG12 VAL A 330 17.343 23.796 111.379 1.00 9.17 H new ATOM 0 HG13 VAL A 330 15.860 24.350 111.319 1.00 9.17 H new ATOM 0 HG21 VAL A 330 16.447 26.993 110.131 1.00 9.26 H new ATOM 0 HG22 VAL A 330 15.461 26.826 111.359 1.00 9.26 H new ATOM 0 HG23 VAL A 330 16.691 27.819 111.460 1.00 9.26 H new ATOM 2581 N LEU A 331 19.325 24.696 113.616 1.00 8.44 N ATOM 2582 CA LEU A 331 20.217 23.626 114.051 1.00 8.37 C ATOM 2583 C LEU A 331 19.982 23.280 115.523 1.00 8.46 C ATOM 2584 O LEU A 331 19.882 22.109 115.886 1.00 8.21 O ATOM 2585 CB LEU A 331 21.674 24.049 113.819 1.00 8.67 C ATOM 2586 CG LEU A 331 22.713 23.047 114.342 1.00 8.27 C ATOM 2587 CD1 LEU A 331 22.569 21.688 113.658 1.00 9.14 C ATOM 2588 CD2 LEU A 331 24.102 23.620 114.108 1.00 9.81 C ATOM 0 H LEU A 331 19.730 25.394 113.319 1.00 8.44 H new ATOM 0 HA LEU A 331 20.029 22.830 113.530 1.00 8.37 H new ATOM 0 HB2 LEU A 331 21.815 24.178 112.868 1.00 8.67 H new ATOM 0 HB3 LEU A 331 21.823 24.907 114.247 1.00 8.67 H new ATOM 0 HG LEU A 331 22.570 22.906 115.291 1.00 8.27 H new ATOM 0 HD11 LEU A 331 23.237 21.077 114.008 1.00 9.14 H new ATOM 0 HD12 LEU A 331 21.683 21.331 113.830 1.00 9.14 H new ATOM 0 HD13 LEU A 331 22.695 21.792 112.702 1.00 9.14 H new ATOM 0 HD21 LEU A 331 24.769 22.996 114.434 1.00 9.81 H new ATOM 0 HD22 LEU A 331 24.235 23.768 113.159 1.00 9.81 H new ATOM 0 HD23 LEU A 331 24.189 24.462 114.581 1.00 9.81 H new ATOM 2589 N HIS A 332 19.878 24.297 116.368 1.00 8.72 N ATOM 2590 CA HIS A 332 19.623 24.078 117.789 1.00 8.25 C ATOM 2591 C HIS A 332 18.370 23.209 117.983 1.00 8.55 C ATOM 2592 O HIS A 332 18.384 22.227 118.725 1.00 9.12 O ATOM 2593 CB HIS A 332 19.483 25.446 118.471 1.00 8.94 C ATOM 2594 CG HIS A 332 19.122 25.390 119.918 1.00 8.87 C ATOM 2595 ND1 HIS A 332 17.818 25.278 120.351 1.00 10.59 N ATOM 2596 CD2 HIS A 332 19.881 25.527 121.029 1.00 10.41 C ATOM 2597 CE1 HIS A 332 17.788 25.361 121.670 1.00 10.89 C ATOM 2598 NE2 HIS A 332 19.028 25.513 122.107 1.00 10.38 N ATOM 0 H HIS A 332 19.952 25.123 116.141 1.00 8.72 H new ATOM 0 HA HIS A 332 20.361 23.598 118.195 1.00 8.25 H new ATOM 0 HB2 HIS A 332 20.320 25.927 118.378 1.00 8.94 H new ATOM 0 HB3 HIS A 332 18.807 25.960 118.002 1.00 8.94 H new ATOM 0 HD2 HIS A 332 20.806 25.614 121.058 1.00 10.41 H new ATOM 0 HE1 HIS A 332 17.025 25.320 122.201 1.00 10.89 H new ATOM 0 HE2 HIS A 332 19.262 25.590 122.931 1.00 10.38 H new ATOM 2599 N MET A 333 17.281 23.550 117.304 1.00 8.93 N ATOM 2600 CA MET A 333 16.064 22.760 117.468 1.00 7.92 C ATOM 2601 C MET A 333 16.265 21.330 116.994 1.00 8.18 C ATOM 2602 O MET A 333 15.874 20.369 117.672 1.00 8.94 O ATOM 2603 CB MET A 333 14.898 23.398 116.703 1.00 8.44 C ATOM 2604 CG MET A 333 13.564 22.672 116.870 1.00 9.66 C ATOM 2605 SD MET A 333 12.907 22.620 118.553 1.00 8.88 S ATOM 2606 CE MET A 333 12.613 24.373 118.859 1.00 11.87 C ATOM 0 H MET A 333 17.223 24.213 116.760 1.00 8.93 H new ATOM 0 HA MET A 333 15.853 22.743 118.415 1.00 7.92 H new ATOM 0 HB2 MET A 333 14.794 24.316 116.999 1.00 8.44 H new ATOM 0 HB3 MET A 333 15.122 23.428 115.760 1.00 8.44 H new ATOM 0 HG2 MET A 333 12.908 23.099 116.297 1.00 9.66 H new ATOM 0 HG3 MET A 333 13.668 21.761 116.552 1.00 9.66 H new ATOM 0 HE1 MET A 333 12.068 24.476 119.655 1.00 11.87 H new ATOM 0 HE2 MET A 333 13.461 24.826 118.988 1.00 11.87 H new ATOM 0 HE3 MET A 333 12.152 24.761 118.099 1.00 11.87 H new ATOM 2607 N GLY A 334 16.877 21.172 115.827 1.00 7.84 N ATOM 2608 CA GLY A 334 17.104 19.841 115.290 1.00 7.61 C ATOM 2609 C GLY A 334 17.947 18.954 116.184 1.00 7.87 C ATOM 2610 O GLY A 334 17.650 17.770 116.350 1.00 8.74 O ATOM 0 H GLY A 334 17.165 21.816 115.336 1.00 7.84 H new ATOM 0 HA2 GLY A 334 16.247 19.412 115.139 1.00 7.61 H new ATOM 0 HA3 GLY A 334 17.538 19.920 114.426 1.00 7.61 H new ATOM 2611 N LEU A 335 19.010 19.506 116.762 1.00 8.01 N ATOM 2612 CA LEU A 335 19.857 18.696 117.641 1.00 8.61 C ATOM 2613 C LEU A 335 19.080 18.199 118.858 1.00 8.30 C ATOM 2614 O LEU A 335 19.278 17.071 119.297 1.00 9.10 O ATOM 2615 CB LEU A 335 21.079 19.499 118.085 1.00 9.17 C ATOM 2616 CG LEU A 335 22.046 19.915 116.971 1.00 8.94 C ATOM 2617 CD1 LEU A 335 23.070 20.880 117.559 1.00 10.94 C ATOM 2618 CD2 LEU A 335 22.726 18.694 116.356 1.00 10.36 C ATOM 0 H LEU A 335 19.256 20.324 116.664 1.00 8.01 H new ATOM 0 HA LEU A 335 20.153 17.921 117.139 1.00 8.61 H new ATOM 0 HB2 LEU A 335 20.771 20.299 118.538 1.00 9.17 H new ATOM 0 HB3 LEU A 335 21.570 18.975 118.737 1.00 9.17 H new ATOM 0 HG LEU A 335 21.558 20.355 116.258 1.00 8.94 H new ATOM 0 HD11 LEU A 335 23.691 21.154 116.867 1.00 10.94 H new ATOM 0 HD12 LEU A 335 22.614 21.660 117.912 1.00 10.94 H new ATOM 0 HD13 LEU A 335 23.557 20.440 118.274 1.00 10.94 H new ATOM 0 HD21 LEU A 335 23.332 18.980 115.655 1.00 10.36 H new ATOM 0 HD22 LEU A 335 23.224 18.222 117.041 1.00 10.36 H new ATOM 0 HD23 LEU A 335 22.054 18.104 115.981 1.00 10.36 H new ATOM 2619 N HIS A 336 18.199 19.034 119.397 1.00 8.14 N ATOM 2620 CA HIS A 336 17.392 18.632 120.541 1.00 9.27 C ATOM 2621 C HIS A 336 16.349 17.577 120.176 1.00 9.18 C ATOM 2622 O HIS A 336 16.278 16.510 120.791 1.00 8.60 O ATOM 2623 CB HIS A 336 16.675 19.845 121.145 1.00 8.71 C ATOM 2624 CG HIS A 336 17.557 20.721 121.987 1.00 8.36 C ATOM 2625 ND1 HIS A 336 18.459 21.612 121.444 1.00 9.40 N ATOM 2626 CD2 HIS A 336 17.668 20.844 123.333 1.00 9.73 C ATOM 2627 CE1 HIS A 336 19.086 22.246 122.422 1.00 9.48 C ATOM 2628 NE2 HIS A 336 18.626 21.798 123.577 1.00 9.37 N ATOM 0 H HIS A 336 18.054 19.834 119.117 1.00 8.14 H new ATOM 0 HA HIS A 336 18.004 18.246 121.187 1.00 9.27 H new ATOM 0 HB2 HIS A 336 16.298 20.377 120.427 1.00 8.71 H new ATOM 0 HB3 HIS A 336 15.933 19.534 121.687 1.00 8.71 H new ATOM 0 HD1 HIS A 336 18.593 21.736 120.604 1.00 9.40 H new ATOM 0 HD2 HIS A 336 17.186 20.371 123.972 1.00 9.73 H new ATOM 0 HE1 HIS A 336 19.741 22.898 122.314 1.00 9.48 H new ATOM 2629 N VAL A 337 15.540 17.863 119.161 1.00 8.91 N ATOM 2630 CA VAL A 337 14.482 16.930 118.813 1.00 9.20 C ATOM 2631 C VAL A 337 14.995 15.591 118.294 1.00 9.45 C ATOM 2632 O VAL A 337 14.402 14.546 118.592 1.00 11.26 O ATOM 2633 CB VAL A 337 13.495 17.573 117.829 1.00 8.95 C ATOM 2634 CG1 VAL A 337 12.404 16.569 117.468 1.00 12.61 C ATOM 2635 CG2 VAL A 337 12.883 18.832 118.470 1.00 9.22 C ATOM 0 H VAL A 337 15.585 18.571 118.675 1.00 8.91 H new ATOM 0 HA VAL A 337 14.013 16.727 119.638 1.00 9.20 H new ATOM 0 HB VAL A 337 13.959 17.829 117.017 1.00 8.95 H new ATOM 0 HG11 VAL A 337 11.781 16.977 116.846 1.00 12.61 H new ATOM 0 HG12 VAL A 337 12.806 15.788 117.057 1.00 12.61 H new ATOM 0 HG13 VAL A 337 11.930 16.303 118.271 1.00 12.61 H new ATOM 0 HG21 VAL A 337 12.259 19.240 117.850 1.00 9.22 H new ATOM 0 HG22 VAL A 337 12.416 18.586 119.284 1.00 9.22 H new ATOM 0 HG23 VAL A 337 13.588 19.464 118.681 1.00 9.22 H new ATOM 2636 N CYS A 338 16.114 15.609 117.575 1.00 8.79 N ATOM 2637 CA CYS A 338 16.705 14.378 117.039 1.00 9.41 C ATOM 2638 C CYS A 338 17.662 13.714 118.034 1.00 10.03 C ATOM 2639 O CYS A 338 18.250 12.667 117.737 1.00 11.62 O ATOM 2640 CB CYS A 338 17.471 14.675 115.742 1.00 8.66 C ATOM 2641 SG CYS A 338 16.470 15.369 114.413 1.00 11.83 S ATOM 0 H CYS A 338 16.550 16.325 117.384 1.00 8.79 H new ATOM 0 HA CYS A 338 15.971 13.768 116.866 1.00 9.41 H new ATOM 0 HB2 CYS A 338 18.193 15.292 115.942 1.00 8.66 H new ATOM 0 HB3 CYS A 338 17.879 13.853 115.427 1.00 8.66 H new ATOM 0 HG CYS A 338 17.161 15.565 113.452 1.00 11.83 H new ATOM 2642 N GLN A 339 17.842 14.333 119.197 1.00 10.09 N ATOM 2643 CA GLN A 339 18.719 13.813 120.235 1.00 10.17 C ATOM 2644 C GLN A 339 20.155 13.586 119.775 1.00 10.17 C ATOM 2645 O GLN A 339 20.793 12.579 120.103 1.00 11.61 O ATOM 2646 CB GLN A 339 18.108 12.541 120.852 1.00 10.34 C ATOM 2647 CG GLN A 339 16.818 12.884 121.596 1.00 10.16 C ATOM 2648 CD GLN A 339 16.090 11.695 122.169 1.00 11.22 C ATOM 2649 OE1 GLN A 339 16.141 10.596 121.622 1.00 15.25 O ATOM 2650 NE2 GLN A 339 15.375 11.918 123.270 1.00 11.96 N ATOM 0 H GLN A 339 17.455 15.072 119.405 1.00 10.09 H new ATOM 0 HA GLN A 339 18.783 14.499 120.918 1.00 10.17 H new ATOM 0 HB2 GLN A 339 17.925 11.891 120.155 1.00 10.34 H new ATOM 0 HB3 GLN A 339 18.742 12.132 121.462 1.00 10.34 H new ATOM 0 HG2 GLN A 339 17.028 13.498 122.317 1.00 10.16 H new ATOM 0 HG3 GLN A 339 16.223 13.351 120.989 1.00 10.16 H new ATOM 0 HE21 GLN A 339 15.364 12.702 123.624 1.00 11.96 H new ATOM 0 HE22 GLN A 339 14.924 11.278 123.627 1.00 11.96 H new ATOM 2651 N LEU A 340 20.658 14.555 119.014 1.00 10.64 N ATOM 2652 CA LEU A 340 22.050 14.550 118.541 1.00 9.96 C ATOM 2653 C LEU A 340 22.721 15.475 119.551 1.00 10.60 C ATOM 2654 O LEU A 340 23.201 16.566 119.225 1.00 11.03 O ATOM 2655 CB LEU A 340 22.131 15.125 117.120 1.00 10.79 C ATOM 2656 CG LEU A 340 21.674 14.140 116.035 1.00 11.15 C ATOM 2657 CD1 LEU A 340 21.306 14.870 114.743 1.00 12.14 C ATOM 2658 CD2 LEU A 340 22.800 13.129 115.795 1.00 12.51 C ATOM 0 H LEU A 340 20.204 15.238 118.754 1.00 10.64 H new ATOM 0 HA LEU A 340 22.456 13.670 118.489 1.00 9.96 H new ATOM 0 HB2 LEU A 340 21.585 15.925 117.071 1.00 10.79 H new ATOM 0 HB3 LEU A 340 23.045 15.394 116.939 1.00 10.79 H new ATOM 0 HG LEU A 340 20.875 13.677 116.332 1.00 11.15 H new ATOM 0 HD11 LEU A 340 21.022 14.225 114.077 1.00 12.14 H new ATOM 0 HD12 LEU A 340 20.584 15.494 114.918 1.00 12.14 H new ATOM 0 HD13 LEU A 340 22.079 15.355 114.414 1.00 12.14 H new ATOM 0 HD21 LEU A 340 22.528 12.498 115.111 1.00 12.51 H new ATOM 0 HD22 LEU A 340 23.598 13.597 115.504 1.00 12.51 H new ATOM 0 HD23 LEU A 340 22.988 12.652 116.618 1.00 12.51 H new ATOM 2659 N MET A 341 22.747 15.013 120.800 1.00 10.97 N ATOM 2660 CA MET A 341 23.245 15.803 121.913 1.00 11.41 C ATOM 2661 C MET A 341 24.590 15.423 122.499 1.00 12.11 C ATOM 2662 O MET A 341 24.969 15.948 123.543 1.00 13.31 O ATOM 2663 CB MET A 341 22.156 15.841 122.994 1.00 11.56 C ATOM 2664 CG MET A 341 20.856 16.527 122.510 1.00 12.22 C ATOM 2665 SD MET A 341 20.974 18.331 122.299 1.00 11.48 S ATOM 2666 CE MET A 341 20.952 18.778 124.035 1.00 11.48 C ATOM 0 H MET A 341 22.474 14.228 121.022 1.00 10.97 H new ATOM 0 HA MET A 341 23.433 16.680 121.543 1.00 11.41 H new ATOM 0 HB2 MET A 341 21.953 14.935 123.275 1.00 11.56 H new ATOM 0 HB3 MET A 341 22.495 16.311 123.772 1.00 11.56 H new ATOM 0 HG2 MET A 341 20.593 16.132 121.664 1.00 12.22 H new ATOM 0 HG3 MET A 341 20.148 16.334 123.145 1.00 12.22 H new ATOM 0 HE1 MET A 341 20.180 19.337 124.216 1.00 11.48 H new ATOM 0 HE2 MET A 341 20.903 17.974 124.576 1.00 11.48 H new ATOM 0 HE3 MET A 341 21.762 19.265 124.254 1.00 11.48 H new ATOM 2667 N GLY A 342 25.298 14.516 121.833 1.00 12.08 N ATOM 2668 CA GLY A 342 26.643 14.189 122.284 1.00 13.46 C ATOM 2669 C GLY A 342 27.517 15.386 121.910 1.00 13.41 C ATOM 2670 O GLY A 342 27.199 16.125 120.969 1.00 12.77 O ATOM 0 H GLY A 342 25.027 14.090 121.137 1.00 12.08 H new ATOM 0 HA2 GLY A 342 26.660 14.033 123.241 1.00 13.46 H new ATOM 0 HA3 GLY A 342 26.964 13.379 121.859 1.00 13.46 H new ATOM 2671 N TYR A 343 28.623 15.596 122.614 1.00 13.25 N ATOM 2672 CA TYR A 343 29.472 16.743 122.311 1.00 12.29 C ATOM 2673 C TYR A 343 29.891 16.784 120.839 1.00 12.67 C ATOM 2674 O TYR A 343 29.778 17.831 120.175 1.00 11.45 O ATOM 2675 CB TYR A 343 30.725 16.744 123.201 1.00 14.55 C ATOM 2676 CG TYR A 343 31.624 17.907 122.903 1.00 15.48 C ATOM 2677 CD1 TYR A 343 31.403 19.154 123.483 1.00 18.33 C ATOM 2678 CD2 TYR A 343 32.662 17.778 121.987 1.00 17.65 C ATOM 2679 CE1 TYR A 343 32.196 20.246 123.153 1.00 19.37 C ATOM 2680 CE2 TYR A 343 33.459 18.862 121.650 1.00 20.43 C ATOM 2681 CZ TYR A 343 33.219 20.090 122.236 1.00 20.20 C ATOM 2682 OH TYR A 343 34.013 21.158 121.892 1.00 24.26 O ATOM 0 H TYR A 343 28.897 15.098 123.259 1.00 13.25 H new ATOM 0 HA TYR A 343 28.943 17.535 122.493 1.00 12.29 H new ATOM 0 HB2 TYR A 343 30.459 16.773 124.133 1.00 14.55 H new ATOM 0 HB3 TYR A 343 31.214 15.916 123.071 1.00 14.55 H new ATOM 0 HD1 TYR A 343 30.715 19.257 124.100 1.00 18.33 H new ATOM 0 HD2 TYR A 343 32.825 16.951 121.594 1.00 17.65 H new ATOM 0 HE1 TYR A 343 32.040 21.075 123.545 1.00 19.37 H new ATOM 0 HE2 TYR A 343 34.149 18.763 121.035 1.00 20.43 H new ATOM 0 HH TYR A 343 33.888 21.787 122.435 1.00 24.26 H new ATOM 2683 N GLY A 344 30.370 15.658 120.323 1.00 11.84 N ATOM 2684 CA GLY A 344 30.794 15.609 118.938 1.00 12.60 C ATOM 2685 C GLY A 344 29.660 15.836 117.958 1.00 12.12 C ATOM 2686 O GLY A 344 29.843 16.488 116.921 1.00 13.00 O ATOM 0 H GLY A 344 30.456 14.920 120.756 1.00 11.84 H new ATOM 0 HA2 GLY A 344 31.479 16.280 118.792 1.00 12.60 H new ATOM 0 HA3 GLY A 344 31.199 14.746 118.760 1.00 12.60 H new ATOM 2687 N GLN A 345 28.489 15.294 118.276 1.00 11.43 N ATOM 2688 CA GLN A 345 27.322 15.446 117.412 1.00 11.58 C ATOM 2689 C GLN A 345 26.926 16.913 117.336 1.00 11.77 C ATOM 2690 O GLN A 345 26.586 17.423 116.263 1.00 10.89 O ATOM 2691 CB GLN A 345 26.163 14.612 117.951 1.00 12.46 C ATOM 2692 CG GLN A 345 26.452 13.122 117.894 1.00 14.20 C ATOM 2693 CD GLN A 345 25.372 12.289 118.541 1.00 15.34 C ATOM 2694 OE1 GLN A 345 24.785 12.681 119.547 1.00 15.99 O ATOM 2695 NE2 GLN A 345 25.125 11.110 117.980 1.00 17.90 N ATOM 0 H GLN A 345 28.348 14.834 118.989 1.00 11.43 H new ATOM 0 HA GLN A 345 27.542 15.133 116.520 1.00 11.58 H new ATOM 0 HB2 GLN A 345 25.981 14.869 118.868 1.00 12.46 H new ATOM 0 HB3 GLN A 345 25.362 14.804 117.438 1.00 12.46 H new ATOM 0 HG2 GLN A 345 26.551 12.852 116.968 1.00 14.20 H new ATOM 0 HG3 GLN A 345 27.298 12.944 118.334 1.00 14.20 H new ATOM 0 HE21 GLN A 345 25.556 10.870 117.276 1.00 17.90 H new ATOM 0 HE22 GLN A 345 24.534 10.587 118.321 1.00 17.90 H new ATOM 2696 N ILE A 346 26.973 17.599 118.473 1.00 10.06 N ATOM 2697 CA ILE A 346 26.635 19.016 118.496 1.00 11.10 C ATOM 2698 C ILE A 346 27.703 19.805 117.741 1.00 11.10 C ATOM 2699 O ILE A 346 27.390 20.651 116.901 1.00 11.75 O ATOM 2700 CB ILE A 346 26.536 19.558 119.940 1.00 9.81 C ATOM 2701 CG1 ILE A 346 25.354 18.904 120.668 1.00 10.00 C ATOM 2702 CG2 ILE A 346 26.390 21.075 119.908 1.00 10.31 C ATOM 2703 CD1 ILE A 346 25.388 19.085 122.185 1.00 11.14 C ATOM 0 H ILE A 346 27.196 17.267 119.234 1.00 10.06 H new ATOM 0 HA ILE A 346 25.769 19.121 118.072 1.00 11.10 H new ATOM 0 HB ILE A 346 27.346 19.337 120.426 1.00 9.81 H new ATOM 0 HG12 ILE A 346 24.527 19.277 120.325 1.00 10.00 H new ATOM 0 HG13 ILE A 346 25.344 17.956 120.464 1.00 10.00 H new ATOM 0 HG21 ILE A 346 26.328 21.414 120.815 1.00 10.31 H new ATOM 0 HG22 ILE A 346 27.162 21.465 119.470 1.00 10.31 H new ATOM 0 HG23 ILE A 346 25.587 21.313 119.419 1.00 10.31 H new ATOM 0 HD11 ILE A 346 24.617 18.650 122.580 1.00 11.14 H new ATOM 0 HD12 ILE A 346 26.199 18.689 122.540 1.00 11.14 H new ATOM 0 HD13 ILE A 346 25.370 20.031 122.399 1.00 11.14 H new ATOM 2704 N ASN A 347 28.973 19.523 118.029 1.00 11.81 N ATOM 2705 CA ASN A 347 30.058 20.231 117.370 1.00 13.01 C ATOM 2706 C ASN A 347 30.014 20.067 115.851 1.00 13.06 C ATOM 2707 O ASN A 347 30.230 21.037 115.115 1.00 14.95 O ATOM 2708 CB ASN A 347 31.400 19.739 117.911 1.00 13.13 C ATOM 2709 CG ASN A 347 32.549 20.625 117.486 1.00 15.75 C ATOM 2710 OD1 ASN A 347 32.563 21.823 117.767 1.00 15.27 O ATOM 2711 ND2 ASN A 347 33.526 20.038 116.801 1.00 18.45 N ATOM 0 H ASN A 347 29.222 18.929 118.599 1.00 11.81 H new ATOM 0 HA ASN A 347 29.952 21.176 117.562 1.00 13.01 H new ATOM 0 HB2 ASN A 347 31.363 19.704 118.880 1.00 13.13 H new ATOM 0 HB3 ASN A 347 31.560 18.834 117.600 1.00 13.13 H new ATOM 0 HD21 ASN A 347 34.202 20.499 116.536 1.00 18.45 H new ATOM 0 HD22 ASN A 347 33.482 19.198 116.623 1.00 18.45 H new ATOM 2712 N ASP A 348 29.715 18.859 115.376 1.00 12.68 N ATOM 2713 CA ASP A 348 29.660 18.595 113.935 1.00 13.20 C ATOM 2714 C ASP A 348 28.342 19.082 113.327 1.00 12.78 C ATOM 2715 O ASP A 348 28.131 18.979 112.110 1.00 12.85 O ATOM 2716 CB ASP A 348 29.801 17.095 113.647 1.00 14.22 C ATOM 2717 CG ASP A 348 31.165 16.538 114.021 1.00 16.46 C ATOM 2718 OD1 ASP A 348 32.112 17.325 114.220 1.00 18.00 O ATOM 2719 OD2 ASP A 348 31.273 15.295 114.097 1.00 19.33 O ATOM 0 H ASP A 348 29.540 18.177 115.870 1.00 12.68 H new ATOM 0 HA ASP A 348 30.398 19.079 113.533 1.00 13.20 H new ATOM 0 HB2 ASP A 348 29.116 16.612 114.136 1.00 14.22 H new ATOM 0 HB3 ASP A 348 29.641 16.937 112.703 1.00 14.22 H new ATOM 2720 N GLY A 349 27.473 19.612 114.182 1.00 11.88 N ATOM 2721 CA GLY A 349 26.171 20.090 113.752 1.00 12.87 C ATOM 2722 C GLY A 349 26.240 21.103 112.637 1.00 11.66 C ATOM 2723 O GLY A 349 25.334 21.158 111.804 1.00 10.74 O ATOM 0 H GLY A 349 27.624 19.703 115.024 1.00 11.88 H new ATOM 0 HA2 GLY A 349 25.637 19.334 113.460 1.00 12.87 H new ATOM 0 HA3 GLY A 349 25.713 20.485 114.510 1.00 12.87 H new ATOM 2724 N LEU A 350 27.302 21.908 112.610 1.00 11.74 N ATOM 2725 CA LEU A 350 27.443 22.910 111.562 1.00 11.31 C ATOM 2726 C LEU A 350 27.371 22.299 110.173 1.00 10.69 C ATOM 2727 O LEU A 350 26.969 22.975 109.236 1.00 10.47 O ATOM 2728 CB LEU A 350 28.764 23.679 111.683 1.00 13.80 C ATOM 2729 CG LEU A 350 28.960 24.616 112.869 1.00 14.58 C ATOM 2730 CD1 LEU A 350 30.293 25.356 112.681 1.00 13.70 C ATOM 2731 CD2 LEU A 350 27.816 25.606 112.975 1.00 15.89 C ATOM 0 H LEU A 350 27.943 21.889 113.183 1.00 11.74 H new ATOM 0 HA LEU A 350 26.699 23.520 111.682 1.00 11.31 H new ATOM 0 HB2 LEU A 350 29.483 23.028 111.701 1.00 13.80 H new ATOM 0 HB3 LEU A 350 28.875 24.202 110.874 1.00 13.80 H new ATOM 0 HG LEU A 350 28.975 24.102 113.691 1.00 14.58 H new ATOM 0 HD11 LEU A 350 30.437 25.959 113.427 1.00 13.70 H new ATOM 0 HD12 LEU A 350 31.018 24.713 112.641 1.00 13.70 H new ATOM 0 HD13 LEU A 350 30.267 25.865 111.855 1.00 13.70 H new ATOM 0 HD21 LEU A 350 27.963 26.190 113.735 1.00 15.89 H new ATOM 0 HD22 LEU A 350 27.771 26.136 112.164 1.00 15.89 H new ATOM 0 HD23 LEU A 350 26.982 25.125 113.093 1.00 15.89 H new ATOM 2732 N ASN A 351 27.772 21.042 110.014 1.00 11.00 N ATOM 2733 CA ASN A 351 27.711 20.440 108.684 1.00 11.19 C ATOM 2734 C ASN A 351 26.283 20.411 108.151 1.00 11.08 C ATOM 2735 O ASN A 351 26.068 20.507 106.941 1.00 11.11 O ATOM 2736 CB ASN A 351 28.255 19.010 108.686 1.00 13.19 C ATOM 2737 CG ASN A 351 29.746 18.955 108.898 1.00 15.91 C ATOM 2738 OD1 ASN A 351 30.480 19.849 108.477 1.00 20.57 O ATOM 2739 ND2 ASN A 351 30.208 17.883 109.534 1.00 18.82 N ATOM 0 H ASN A 351 28.073 20.534 110.639 1.00 11.00 H new ATOM 0 HA ASN A 351 28.262 20.994 108.109 1.00 11.19 H new ATOM 0 HB2 ASN A 351 27.814 18.501 109.384 1.00 13.19 H new ATOM 0 HB3 ASN A 351 28.036 18.584 107.843 1.00 13.19 H new ATOM 0 HD21 ASN A 351 31.053 17.793 109.666 1.00 18.82 H new ATOM 0 HD22 ASN A 351 29.662 17.280 109.813 1.00 18.82 H new ATOM 2740 N LEU A 352 25.316 20.291 109.060 1.00 9.69 N ATOM 2741 CA LEU A 352 23.905 20.211 108.677 1.00 10.33 C ATOM 2742 C LEU A 352 23.358 21.502 108.102 1.00 10.38 C ATOM 2743 O LEU A 352 22.277 21.501 107.500 1.00 9.75 O ATOM 2744 CB LEU A 352 23.054 19.793 109.882 1.00 9.74 C ATOM 2745 CG LEU A 352 23.350 18.398 110.440 1.00 10.99 C ATOM 2746 CD1 LEU A 352 22.784 18.262 111.853 1.00 10.75 C ATOM 2747 CD2 LEU A 352 22.738 17.347 109.529 1.00 15.43 C ATOM 0 H LEU A 352 25.456 20.254 109.908 1.00 9.69 H new ATOM 0 HA LEU A 352 23.855 19.544 107.974 1.00 10.33 H new ATOM 0 HB2 LEU A 352 23.182 20.443 110.591 1.00 9.74 H new ATOM 0 HB3 LEU A 352 22.119 19.832 109.628 1.00 9.74 H new ATOM 0 HG LEU A 352 24.311 18.268 110.479 1.00 10.99 H new ATOM 0 HD11 LEU A 352 22.978 17.375 112.195 1.00 10.75 H new ATOM 0 HD12 LEU A 352 23.191 18.927 112.430 1.00 10.75 H new ATOM 0 HD13 LEU A 352 21.824 18.397 111.832 1.00 10.75 H new ATOM 0 HD21 LEU A 352 22.925 16.463 109.882 1.00 15.43 H new ATOM 0 HD22 LEU A 352 21.778 17.479 109.482 1.00 15.43 H new ATOM 0 HD23 LEU A 352 23.119 17.427 108.641 1.00 15.43 H new ATOM 2748 N ILE A 353 24.081 22.604 108.310 1.00 8.50 N ATOM 2749 CA ILE A 353 23.651 23.905 107.789 1.00 9.09 C ATOM 2750 C ILE A 353 24.696 24.557 106.880 1.00 8.39 C ATOM 2751 O ILE A 353 24.552 25.730 106.497 1.00 9.57 O ATOM 2752 CB ILE A 353 23.221 24.870 108.935 1.00 9.13 C ATOM 2753 CG1 ILE A 353 24.316 24.987 109.997 1.00 9.71 C ATOM 2754 CG2 ILE A 353 21.914 24.344 109.566 1.00 9.02 C ATOM 2755 CD1 ILE A 353 25.627 25.467 109.499 1.00 21.08 C ATOM 0 H ILE A 353 24.821 22.621 108.748 1.00 8.50 H new ATOM 0 HA ILE A 353 22.873 23.730 107.237 1.00 9.09 H new ATOM 0 HB ILE A 353 23.076 25.755 108.566 1.00 9.13 H new ATOM 0 HG12 ILE A 353 24.010 25.590 110.692 1.00 9.71 H new ATOM 0 HG13 ILE A 353 24.441 24.118 110.410 1.00 9.71 H new ATOM 0 HG21 ILE A 353 21.638 24.938 110.281 1.00 9.02 H new ATOM 0 HG22 ILE A 353 21.220 24.308 108.890 1.00 9.02 H new ATOM 0 HG23 ILE A 353 22.062 23.455 109.924 1.00 9.02 H new ATOM 0 HD11 ILE A 353 26.257 25.510 110.235 1.00 21.08 H new ATOM 0 HD12 ILE A 353 25.961 24.855 108.824 1.00 21.08 H new ATOM 0 HD13 ILE A 353 25.523 26.350 109.111 1.00 21.08 H new ATOM 2756 N THR A 354 25.718 23.782 106.519 1.00 9.35 N ATOM 2757 CA THR A 354 26.758 24.263 105.609 1.00 9.20 C ATOM 2758 C THR A 354 27.019 23.231 104.512 1.00 9.06 C ATOM 2759 O THR A 354 26.272 23.167 103.547 1.00 9.39 O ATOM 2760 CB THR A 354 28.093 24.639 106.339 1.00 8.80 C ATOM 2761 OG1 THR A 354 28.565 23.528 107.113 1.00 9.84 O ATOM 2762 CG2 THR A 354 27.891 25.858 107.223 1.00 10.17 C ATOM 0 H THR A 354 25.828 22.973 106.790 1.00 9.35 H new ATOM 0 HA THR A 354 26.424 25.082 105.212 1.00 9.20 H new ATOM 0 HB THR A 354 28.761 24.856 105.670 1.00 8.80 H new ATOM 0 HG1 THR A 354 28.043 23.394 107.758 1.00 9.84 H new ATOM 0 HG21 THR A 354 28.725 26.078 107.667 1.00 10.17 H new ATOM 0 HG22 THR A 354 27.607 26.609 106.679 1.00 10.17 H new ATOM 0 HG23 THR A 354 27.212 25.667 107.888 1.00 10.17 H new ATOM 2763 N HIS A 355 28.031 22.389 104.681 1.00 8.80 N ATOM 2764 CA HIS A 355 28.394 21.418 103.654 1.00 9.56 C ATOM 2765 C HIS A 355 27.302 20.477 103.171 1.00 8.96 C ATOM 2766 O HIS A 355 27.169 20.245 101.979 1.00 10.24 O ATOM 2767 CB HIS A 355 29.590 20.596 104.130 1.00 10.52 C ATOM 2768 CG HIS A 355 30.834 21.407 104.279 1.00 12.01 C ATOM 2769 ND1 HIS A 355 31.585 21.812 103.197 1.00 13.23 N ATOM 2770 CD2 HIS A 355 31.417 21.952 105.373 1.00 12.64 C ATOM 2771 CE1 HIS A 355 32.580 22.574 103.621 1.00 14.08 C ATOM 2772 NE2 HIS A 355 32.499 22.674 104.935 1.00 13.68 N ATOM 0 H HIS A 355 28.523 22.363 105.386 1.00 8.80 H new ATOM 0 HA HIS A 355 28.598 21.964 102.879 1.00 9.56 H new ATOM 0 HB2 HIS A 355 29.375 20.184 104.981 1.00 10.52 H new ATOM 0 HB3 HIS A 355 29.753 19.877 103.500 1.00 10.52 H new ATOM 0 HD1 HIS A 355 31.431 21.603 102.377 1.00 13.23 H new ATOM 0 HD2 HIS A 355 31.137 21.855 106.255 1.00 12.64 H new ATOM 0 HE1 HIS A 355 33.227 22.972 103.084 1.00 14.08 H new ATOM 2773 N HIS A 356 26.515 19.923 104.087 1.00 9.75 N ATOM 2774 CA HIS A 356 25.486 18.989 103.648 1.00 9.81 C ATOM 2775 C HIS A 356 24.428 19.704 102.824 1.00 8.99 C ATOM 2776 O HIS A 356 23.894 19.143 101.867 1.00 9.99 O ATOM 2777 CB HIS A 356 24.835 18.276 104.843 1.00 10.14 C ATOM 2778 CG HIS A 356 25.752 17.342 105.578 1.00 11.89 C ATOM 2779 ND1 HIS A 356 25.290 16.459 106.528 1.00 12.34 N ATOM 2780 CD2 HIS A 356 27.093 17.149 105.506 1.00 11.09 C ATOM 2781 CE1 HIS A 356 26.305 15.760 107.012 1.00 12.57 C ATOM 2782 NE2 HIS A 356 27.411 16.160 106.408 1.00 12.21 N ATOM 0 H HIS A 356 26.556 20.066 104.934 1.00 9.75 H new ATOM 0 HA HIS A 356 25.914 18.319 103.092 1.00 9.81 H new ATOM 0 HB2 HIS A 356 24.505 18.944 105.464 1.00 10.14 H new ATOM 0 HB3 HIS A 356 24.066 17.776 104.528 1.00 10.14 H new ATOM 0 HD1 HIS A 356 24.469 16.375 106.770 1.00 12.34 H new ATOM 0 HD2 HIS A 356 27.686 17.601 104.951 1.00 11.09 H new ATOM 0 HE1 HIS A 356 26.249 15.100 107.665 1.00 12.57 H new ATOM 0 HE2 HIS A 356 28.200 15.852 106.555 1.00 12.21 H new ATOM 2783 N SER A 357 24.125 20.944 103.188 1.00 9.85 N ATOM 2784 CA SER A 357 23.133 21.706 102.440 1.00 9.71 C ATOM 2785 C SER A 357 23.672 22.125 101.075 1.00 9.75 C ATOM 2786 O SER A 357 22.918 22.182 100.103 1.00 9.92 O ATOM 2787 CB SER A 357 22.714 22.927 103.250 1.00 9.71 C ATOM 2788 OG SER A 357 22.184 22.502 104.489 1.00 12.67 O ATOM 0 H SER A 357 24.476 21.358 103.855 1.00 9.85 H new ATOM 0 HA SER A 357 22.359 21.142 102.287 1.00 9.71 H new ATOM 0 HB2 SER A 357 23.476 23.510 103.394 1.00 9.71 H new ATOM 0 HB3 SER A 357 22.052 23.441 102.762 1.00 9.71 H new ATOM 0 HG SER A 357 22.165 23.150 105.023 1.00 12.67 H new ATOM 2789 N ALA A 358 24.970 22.407 100.997 1.00 9.47 N ATOM 2790 CA ALA A 358 25.573 22.777 99.718 1.00 10.59 C ATOM 2791 C ALA A 358 25.454 21.579 98.769 1.00 10.92 C ATOM 2792 O ALA A 358 25.174 21.735 97.575 1.00 11.17 O ATOM 2793 CB ALA A 358 27.022 23.155 99.919 1.00 10.00 C ATOM 0 H ALA A 358 25.514 22.391 101.663 1.00 9.47 H new ATOM 0 HA ALA A 358 25.115 23.543 99.338 1.00 10.59 H new ATOM 0 HB1 ALA A 358 27.414 23.399 99.066 1.00 10.00 H new ATOM 0 HB2 ALA A 358 27.079 23.908 100.528 1.00 10.00 H new ATOM 0 HB3 ALA A 358 27.505 22.401 100.292 1.00 10.00 H new ATOM 2794 N ARG A 359 25.650 20.368 99.292 1.00 11.11 N ATOM 2795 CA ARG A 359 25.522 19.165 98.471 1.00 11.19 C ATOM 2796 C ARG A 359 24.068 19.010 98.009 1.00 10.55 C ATOM 2797 O ARG A 359 23.804 18.647 96.857 1.00 11.27 O ATOM 2798 CB ARG A 359 25.974 17.929 99.263 1.00 11.91 C ATOM 2799 CG ARG A 359 25.899 16.625 98.495 1.00 13.62 C ATOM 2800 CD ARG A 359 26.552 15.510 99.303 1.00 16.36 C ATOM 2801 NE ARG A 359 26.452 14.220 98.628 1.00 19.39 N ATOM 2802 CZ ARG A 359 26.836 13.067 99.170 1.00 21.23 C ATOM 2803 NH1 ARG A 359 27.348 13.040 100.395 1.00 23.64 N ATOM 2804 NH2 ARG A 359 26.703 11.938 98.486 1.00 24.00 N ATOM 0 H ARG A 359 25.856 20.223 100.114 1.00 11.11 H new ATOM 0 HA ARG A 359 26.092 19.248 97.690 1.00 11.19 H new ATOM 0 HB2 ARG A 359 26.888 18.065 99.558 1.00 11.91 H new ATOM 0 HB3 ARG A 359 25.427 17.853 100.061 1.00 11.91 H new ATOM 0 HG2 ARG A 359 24.973 16.402 98.310 1.00 13.62 H new ATOM 0 HG3 ARG A 359 26.345 16.719 97.639 1.00 13.62 H new ATOM 0 HD2 ARG A 359 27.486 15.724 99.454 1.00 16.36 H new ATOM 0 HD3 ARG A 359 26.130 15.452 100.174 1.00 16.36 H new ATOM 0 HE ARG A 359 26.125 14.204 97.833 1.00 19.39 H new ATOM 0 HH11 ARG A 359 27.433 13.770 100.842 1.00 23.64 H new ATOM 0 HH12 ARG A 359 27.595 12.293 100.741 1.00 23.64 H new ATOM 0 HH21 ARG A 359 26.369 11.952 97.694 1.00 24.00 H new ATOM 0 HH22 ARG A 359 26.951 11.192 98.835 1.00 24.00 H new ATOM 2805 N THR A 360 23.123 19.276 98.913 1.00 9.53 N ATOM 2806 CA THR A 360 21.710 19.193 98.565 1.00 10.55 C ATOM 2807 C THR A 360 21.372 20.131 97.395 1.00 10.17 C ATOM 2808 O THR A 360 20.568 19.783 96.531 1.00 11.10 O ATOM 2809 CB THR A 360 20.858 19.498 99.810 1.00 9.94 C ATOM 2810 OG1 THR A 360 21.067 18.437 100.756 1.00 11.08 O ATOM 2811 CG2 THR A 360 19.371 19.596 99.458 1.00 9.99 C ATOM 0 H THR A 360 23.281 19.504 99.727 1.00 9.53 H new ATOM 0 HA THR A 360 21.506 18.293 98.267 1.00 10.55 H new ATOM 0 HB THR A 360 21.125 20.353 100.183 1.00 9.94 H new ATOM 0 HG1 THR A 360 20.826 18.691 101.520 1.00 11.08 H new ATOM 0 HG21 THR A 360 18.860 19.788 100.260 1.00 9.99 H new ATOM 0 HG22 THR A 360 19.237 20.307 98.812 1.00 9.99 H new ATOM 0 HG23 THR A 360 19.072 18.755 99.079 1.00 9.99 H new ATOM 2812 N LEU A 361 21.991 21.314 97.365 1.00 10.06 N ATOM 2813 CA LEU A 361 21.753 22.269 96.279 1.00 9.64 C ATOM 2814 C LEU A 361 22.642 22.027 95.060 1.00 10.35 C ATOM 2815 O LEU A 361 22.580 22.792 94.102 1.00 10.63 O ATOM 2816 CB LEU A 361 21.927 23.702 96.785 1.00 9.28 C ATOM 2817 CG LEU A 361 20.634 24.369 97.284 1.00 9.20 C ATOM 2818 CD1 LEU A 361 19.960 23.529 98.385 1.00 11.34 C ATOM 2819 CD2 LEU A 361 20.947 25.769 97.787 1.00 11.55 C ATOM 0 H LEU A 361 22.550 21.582 97.961 1.00 10.06 H new ATOM 0 HA LEU A 361 20.838 22.134 95.987 1.00 9.64 H new ATOM 0 HB2 LEU A 361 22.575 23.701 97.507 1.00 9.28 H new ATOM 0 HB3 LEU A 361 22.300 24.241 96.070 1.00 9.28 H new ATOM 0 HG LEU A 361 20.009 24.429 96.544 1.00 9.20 H new ATOM 0 HD11 LEU A 361 19.149 23.972 98.680 1.00 11.34 H new ATOM 0 HD12 LEU A 361 19.739 22.652 98.034 1.00 11.34 H new ATOM 0 HD13 LEU A 361 20.567 23.432 99.136 1.00 11.34 H new ATOM 0 HD21 LEU A 361 20.132 26.190 98.102 1.00 11.55 H new ATOM 0 HD22 LEU A 361 21.585 25.716 98.516 1.00 11.55 H new ATOM 0 HD23 LEU A 361 21.324 26.296 97.065 1.00 11.55 H new ATOM 2820 N ASN A 362 23.453 20.967 95.103 1.00 11.40 N ATOM 2821 CA ASN A 362 24.357 20.587 94.012 1.00 12.20 C ATOM 2822 C ASN A 362 25.312 21.731 93.675 1.00 13.08 C ATOM 2823 O ASN A 362 25.650 21.937 92.505 1.00 13.61 O ATOM 2824 CB ASN A 362 23.537 20.198 92.770 1.00 13.29 C ATOM 2825 CG ASN A 362 24.310 19.333 91.793 1.00 15.92 C ATOM 2826 OD1 ASN A 362 24.177 19.496 90.573 1.00 19.19 O ATOM 2827 ND2 ASN A 362 25.096 18.395 92.312 1.00 14.80 N ATOM 0 H ASN A 362 23.494 20.438 95.780 1.00 11.40 H new ATOM 0 HA ASN A 362 24.886 19.826 94.299 1.00 12.20 H new ATOM 0 HB2 ASN A 362 22.739 19.724 93.052 1.00 13.29 H new ATOM 0 HB3 ASN A 362 23.243 21.004 92.318 1.00 13.29 H new ATOM 0 HD21 ASN A 362 25.539 17.870 91.794 1.00 14.80 H new ATOM 0 HD22 ASN A 362 25.162 18.313 93.166 1.00 14.80 H new ATOM 2828 N LEU A 363 25.768 22.452 94.696 1.00 12.46 N ATOM 2829 CA LEU A 363 26.674 23.585 94.483 1.00 14.26 C ATOM 2830 C LEU A 363 28.046 23.140 94.002 1.00 15.96 C ATOM 2831 O LEU A 363 28.622 22.180 94.518 1.00 17.05 O ATOM 2832 CB LEU A 363 26.814 24.417 95.761 1.00 13.41 C ATOM 2833 CG LEU A 363 25.499 24.970 96.316 1.00 12.39 C ATOM 2834 CD1 LEU A 363 25.810 25.871 97.495 1.00 13.74 C ATOM 2835 CD2 LEU A 363 24.740 25.769 95.241 1.00 14.34 C ATOM 0 H LEU A 363 25.567 22.304 95.519 1.00 12.46 H new ATOM 0 HA LEU A 363 26.279 24.133 93.787 1.00 14.26 H new ATOM 0 HB2 LEU A 363 27.233 23.870 96.443 1.00 13.41 H new ATOM 0 HB3 LEU A 363 27.413 25.159 95.584 1.00 13.41 H new ATOM 0 HG LEU A 363 24.937 24.230 96.595 1.00 12.39 H new ATOM 0 HD11 LEU A 363 24.984 26.228 97.856 1.00 13.74 H new ATOM 0 HD12 LEU A 363 26.268 25.360 98.181 1.00 13.74 H new ATOM 0 HD13 LEU A 363 26.377 26.602 97.203 1.00 13.74 H new ATOM 0 HD21 LEU A 363 23.912 26.109 95.615 1.00 14.34 H new ATOM 0 HD22 LEU A 363 25.288 26.511 94.942 1.00 14.34 H new ATOM 0 HD23 LEU A 363 24.541 25.191 94.488 1.00 14.34 H new ATOM 2836 N GLN A 364 28.567 23.882 93.026 1.00 18.77 N ATOM 2837 CA GLN A 364 29.856 23.588 92.408 1.00 22.32 C ATOM 2838 C GLN A 364 31.008 24.472 92.868 1.00 23.07 C ATOM 2839 O GLN A 364 32.158 24.217 92.505 1.00 24.39 O ATOM 2840 CB GLN A 364 29.725 23.718 90.891 1.00 24.37 C ATOM 2841 CG GLN A 364 28.587 22.903 90.287 1.00 26.96 C ATOM 2842 CD GLN A 364 28.787 21.418 90.481 1.00 29.55 C ATOM 2843 OE1 GLN A 364 29.823 20.869 90.105 1.00 32.24 O ATOM 2844 NE2 GLN A 364 27.796 20.755 91.069 1.00 29.22 N ATOM 0 H GLN A 364 28.177 24.577 92.702 1.00 18.77 H new ATOM 0 HA GLN A 364 30.077 22.686 92.686 1.00 22.32 H new ATOM 0 HB2 GLN A 364 29.594 24.653 90.667 1.00 24.37 H new ATOM 0 HB3 GLN A 364 30.559 23.443 90.480 1.00 24.37 H new ATOM 0 HG2 GLN A 364 27.748 23.171 90.693 1.00 26.96 H new ATOM 0 HG3 GLN A 364 28.519 23.098 89.339 1.00 26.96 H new ATOM 0 HE21 GLN A 364 27.087 21.173 91.318 1.00 29.22 H new ATOM 0 HE22 GLN A 364 27.864 19.908 91.200 1.00 29.22 H new ATOM 2845 N ASP A 365 30.707 25.509 93.642 1.00 21.49 N ATOM 2846 CA ASP A 365 31.731 26.444 94.124 1.00 21.93 C ATOM 2847 C ASP A 365 31.385 26.732 95.578 1.00 20.21 C ATOM 2848 O ASP A 365 30.747 27.744 95.893 1.00 21.96 O ATOM 2849 CB ASP A 365 31.669 27.730 93.288 1.00 22.89 C ATOM 2850 CG ASP A 365 32.759 28.738 93.642 1.00 24.52 C ATOM 2851 OD1 ASP A 365 32.784 29.801 92.987 1.00 26.85 O ATOM 2852 OD2 ASP A 365 33.579 28.488 94.548 1.00 25.09 O ATOM 0 H ASP A 365 29.909 25.694 93.904 1.00 21.49 H new ATOM 0 HA ASP A 365 32.628 26.082 94.048 1.00 21.93 H new ATOM 0 HB2 ASP A 365 31.743 27.501 92.348 1.00 22.89 H new ATOM 0 HB3 ASP A 365 30.801 28.146 93.411 1.00 22.89 H new ATOM 2853 N TYR A 366 31.812 25.835 96.461 1.00 18.07 N ATOM 2854 CA TYR A 366 31.497 25.961 97.875 1.00 15.46 C ATOM 2855 C TYR A 366 32.546 25.300 98.750 1.00 15.24 C ATOM 2856 O TYR A 366 32.923 24.152 98.519 1.00 16.22 O ATOM 2857 CB TYR A 366 30.122 25.320 98.142 1.00 14.36 C ATOM 2858 CG TYR A 366 29.619 25.474 99.565 1.00 11.53 C ATOM 2859 CD1 TYR A 366 29.985 24.569 100.569 1.00 11.20 C ATOM 2860 CD2 TYR A 366 28.807 26.545 99.911 1.00 10.94 C ATOM 2861 CE1 TYR A 366 29.551 24.739 101.880 1.00 10.51 C ATOM 2862 CE2 TYR A 366 28.370 26.727 101.224 1.00 10.19 C ATOM 2863 CZ TYR A 366 28.749 25.819 102.200 1.00 9.65 C ATOM 2864 OH TYR A 366 28.349 26.007 103.492 1.00 10.77 O ATOM 0 H TYR A 366 32.286 25.146 96.259 1.00 18.07 H new ATOM 0 HA TYR A 366 31.482 26.905 98.099 1.00 15.46 H new ATOM 0 HB2 TYR A 366 29.473 25.712 97.538 1.00 14.36 H new ATOM 0 HB3 TYR A 366 30.172 24.375 97.930 1.00 14.36 H new ATOM 0 HD1 TYR A 366 30.526 23.843 100.356 1.00 11.20 H new ATOM 0 HD2 TYR A 366 28.549 27.153 99.256 1.00 10.94 H new ATOM 0 HE1 TYR A 366 29.799 24.130 102.537 1.00 10.51 H new ATOM 0 HE2 TYR A 366 27.829 27.451 101.442 1.00 10.19 H new ATOM 0 HH TYR A 366 28.198 26.823 103.623 1.00 10.77 H new ATOM 2865 N GLY A 367 33.001 26.030 99.762 1.00 14.13 N ATOM 2866 CA GLY A 367 33.989 25.494 100.677 1.00 15.41 C ATOM 2867 C GLY A 367 35.247 26.333 100.722 1.00 15.90 C ATOM 2868 O GLY A 367 35.575 27.035 99.763 1.00 17.25 O ATOM 0 H GLY A 367 32.749 26.834 99.933 1.00 14.13 H new ATOM 0 HA2 GLY A 367 33.607 25.440 101.567 1.00 15.41 H new ATOM 0 HA3 GLY A 367 34.216 24.589 100.411 1.00 15.41 H new ATOM 2869 N ILE A 368 35.947 26.275 101.844 1.00 16.89 N ATOM 2870 CA ILE A 368 37.188 27.020 101.984 1.00 17.99 C ATOM 2871 C ILE A 368 38.302 26.154 101.387 1.00 17.20 C ATOM 2872 O ILE A 368 38.893 25.312 102.069 1.00 18.60 O ATOM 2873 CB ILE A 368 37.467 27.328 103.468 1.00 17.81 C ATOM 2874 CG1 ILE A 368 36.258 28.058 104.066 1.00 21.03 C ATOM 2875 CG2 ILE A 368 38.726 28.189 103.603 1.00 19.56 C ATOM 2876 CD1 ILE A 368 36.450 28.526 105.476 1.00 24.24 C ATOM 0 H ILE A 368 35.723 25.813 102.534 1.00 16.89 H new ATOM 0 HA ILE A 368 37.135 27.871 101.521 1.00 17.99 H new ATOM 0 HB ILE A 368 37.613 26.498 103.948 1.00 17.81 H new ATOM 0 HG12 ILE A 368 36.049 28.824 103.509 1.00 21.03 H new ATOM 0 HG13 ILE A 368 35.490 27.467 104.035 1.00 21.03 H new ATOM 0 HG21 ILE A 368 38.891 28.376 104.540 1.00 19.56 H new ATOM 0 HG22 ILE A 368 39.485 27.714 103.230 1.00 19.56 H new ATOM 0 HG23 ILE A 368 38.601 29.023 103.124 1.00 19.56 H new ATOM 0 HD11 ILE A 368 35.646 28.975 105.780 1.00 24.24 H new ATOM 0 HD12 ILE A 368 36.630 27.764 106.048 1.00 24.24 H new ATOM 0 HD13 ILE A 368 37.198 29.142 105.514 1.00 24.24 H new ATOM 2877 N ALA A 369 38.547 26.350 100.093 1.00 18.23 N ATOM 2878 CA ALA A 369 39.568 25.607 99.361 1.00 19.00 C ATOM 2879 C ALA A 369 40.121 26.499 98.260 1.00 19.20 C ATOM 2880 O ALA A 369 39.406 27.333 97.702 1.00 20.11 O ATOM 2881 CB ALA A 369 38.969 24.346 98.751 1.00 19.08 C ATOM 0 H ALA A 369 38.122 26.922 99.612 1.00 18.23 H new ATOM 0 HA ALA A 369 40.278 25.346 99.968 1.00 19.00 H new ATOM 0 HB1 ALA A 369 39.657 23.862 98.268 1.00 19.08 H new ATOM 0 HB2 ALA A 369 38.613 23.783 99.456 1.00 19.08 H new ATOM 0 HB3 ALA A 369 38.256 24.589 98.140 1.00 19.08 H new ATOM 2882 N ALA A 370 41.399 26.316 97.942 1.00 21.03 N ATOM 2883 CA ALA A 370 42.044 27.113 96.906 1.00 21.83 C ATOM 2884 C ALA A 370 41.326 26.955 95.574 1.00 21.81 C ATOM 2885 O ALA A 370 40.964 25.844 95.181 1.00 23.08 O ATOM 2886 CB ALA A 370 43.502 26.697 96.761 1.00 22.23 C ATOM 0 H ALA A 370 41.910 25.734 98.316 1.00 21.03 H new ATOM 0 HA ALA A 370 42.001 28.046 97.168 1.00 21.83 H new ATOM 0 HB1 ALA A 370 43.924 27.231 96.070 1.00 22.23 H new ATOM 0 HB2 ALA A 370 43.963 26.835 97.603 1.00 22.23 H new ATOM 0 HB3 ALA A 370 43.548 25.759 96.517 1.00 22.23 H new ATOM 2887 N GLY A 371 41.116 28.071 94.884 1.00 22.04 N ATOM 2888 CA GLY A 371 40.449 28.027 93.599 1.00 21.84 C ATOM 2889 C GLY A 371 38.984 28.402 93.675 1.00 21.36 C ATOM 2890 O GLY A 371 38.396 28.828 92.683 1.00 22.55 O ATOM 0 H GLY A 371 41.352 28.856 95.144 1.00 22.04 H new ATOM 0 HA2 GLY A 371 40.900 28.629 92.986 1.00 21.84 H new ATOM 0 HA3 GLY A 371 40.530 27.134 93.230 1.00 21.84 H new ATOM 2891 N ASN A 372 38.393 28.238 94.857 1.00 21.61 N ATOM 2892 CA ASN A 372 36.988 28.571 95.065 1.00 20.33 C ATOM 2893 C ASN A 372 36.804 30.072 95.259 1.00 19.90 C ATOM 2894 O ASN A 372 37.736 30.784 95.644 1.00 19.53 O ATOM 2895 CB ASN A 372 36.442 27.854 96.312 1.00 20.20 C ATOM 2896 CG ASN A 372 36.185 26.374 96.086 1.00 20.84 C ATOM 2897 OD1 ASN A 372 36.460 25.831 95.015 1.00 22.01 O ATOM 2898 ND2 ASN A 372 35.644 25.712 97.108 1.00 18.67 N ATOM 0 H ASN A 372 38.792 27.933 95.555 1.00 21.61 H new ATOM 0 HA ASN A 372 36.504 28.283 94.275 1.00 20.33 H new ATOM 0 HB2 ASN A 372 37.073 27.959 97.041 1.00 20.20 H new ATOM 0 HB3 ASN A 372 35.616 28.281 96.588 1.00 20.20 H new ATOM 0 HD21 ASN A 372 35.473 24.872 97.034 1.00 18.67 H new ATOM 0 HD22 ASN A 372 35.465 26.124 97.841 1.00 18.67 H new ATOM 2899 N SER A 373 35.596 30.555 94.992 1.00 18.50 N ATOM 2900 CA SER A 373 35.300 31.963 95.200 1.00 18.15 C ATOM 2901 C SER A 373 35.474 32.244 96.687 1.00 17.39 C ATOM 2902 O SER A 373 35.230 31.371 97.533 1.00 16.61 O ATOM 2903 CB SER A 373 33.858 32.284 94.801 1.00 18.27 C ATOM 2904 OG SER A 373 33.644 32.049 93.424 1.00 21.25 O ATOM 0 H SER A 373 34.940 30.087 94.692 1.00 18.50 H new ATOM 0 HA SER A 373 35.892 32.507 94.658 1.00 18.15 H new ATOM 0 HB2 SER A 373 33.247 31.741 95.323 1.00 18.27 H new ATOM 0 HB3 SER A 373 33.661 33.211 95.008 1.00 18.27 H new ATOM 0 HG SER A 373 33.661 31.223 93.275 1.00 21.25 H new ATOM 2905 N ALA A 374 35.895 33.460 97.013 1.00 16.20 N ATOM 2906 CA ALA A 374 36.093 33.837 98.402 1.00 15.12 C ATOM 2907 C ALA A 374 34.765 34.188 99.064 1.00 15.56 C ATOM 2908 O ALA A 374 34.462 35.357 99.316 1.00 14.89 O ATOM 2909 CB ALA A 374 37.067 35.016 98.499 1.00 16.04 C ATOM 0 H ALA A 374 36.071 34.080 96.444 1.00 16.20 H new ATOM 0 HA ALA A 374 36.474 33.079 98.872 1.00 15.12 H new ATOM 0 HB1 ALA A 374 37.191 35.258 99.430 1.00 16.04 H new ATOM 0 HB2 ALA A 374 37.921 34.763 98.115 1.00 16.04 H new ATOM 0 HB3 ALA A 374 36.707 35.774 98.013 1.00 16.04 H new ATOM 2910 N ASN A 375 33.974 33.148 99.319 1.00 14.61 N ATOM 2911 CA ASN A 375 32.667 33.270 99.970 1.00 14.04 C ATOM 2912 C ASN A 375 32.827 32.530 101.288 1.00 12.65 C ATOM 2913 O ASN A 375 33.028 31.308 101.310 1.00 13.67 O ATOM 2914 CB ASN A 375 31.568 32.593 99.153 1.00 14.19 C ATOM 2915 CG ASN A 375 31.452 33.137 97.749 1.00 14.92 C ATOM 2916 OD1 ASN A 375 31.911 34.244 97.448 1.00 15.59 O ATOM 2917 ND2 ASN A 375 30.813 32.366 96.881 1.00 15.63 N ATOM 0 H ASN A 375 34.183 32.339 99.116 1.00 14.61 H new ATOM 0 HA ASN A 375 32.412 34.200 100.073 1.00 14.04 H new ATOM 0 HB2 ASN A 375 31.744 31.640 99.111 1.00 14.19 H new ATOM 0 HB3 ASN A 375 30.719 32.705 99.608 1.00 14.19 H new ATOM 0 HD21 ASN A 375 30.704 32.631 96.070 1.00 15.63 H new ATOM 0 HD22 ASN A 375 30.508 31.601 97.129 1.00 15.63 H new ATOM 2918 N LEU A 376 32.745 33.270 102.378 1.00 12.42 N ATOM 2919 CA LEU A 376 32.939 32.680 103.687 1.00 13.13 C ATOM 2920 C LEU A 376 32.368 33.577 104.765 1.00 12.72 C ATOM 2921 O LEU A 376 32.090 34.762 104.537 1.00 14.14 O ATOM 2922 CB LEU A 376 34.444 32.453 103.909 1.00 14.42 C ATOM 2923 CG LEU A 376 35.348 33.684 103.724 1.00 15.40 C ATOM 2924 CD1 LEU A 376 35.467 34.435 105.037 1.00 16.33 C ATOM 2925 CD2 LEU A 376 36.732 33.255 103.233 1.00 17.00 C ATOM 0 H LEU A 376 32.578 34.114 102.382 1.00 12.42 H new ATOM 0 HA LEU A 376 32.473 31.831 103.734 1.00 13.13 H new ATOM 0 HB2 LEU A 376 34.572 32.112 104.808 1.00 14.42 H new ATOM 0 HB3 LEU A 376 34.742 31.761 103.298 1.00 14.42 H new ATOM 0 HG LEU A 376 34.953 34.270 103.059 1.00 15.40 H new ATOM 0 HD11 LEU A 376 36.038 35.210 104.916 1.00 16.33 H new ATOM 0 HD12 LEU A 376 34.587 34.724 105.326 1.00 16.33 H new ATOM 0 HD13 LEU A 376 35.853 33.852 105.710 1.00 16.33 H new ATOM 0 HD21 LEU A 376 37.293 34.038 103.120 1.00 17.00 H new ATOM 0 HD22 LEU A 376 37.136 32.660 103.884 1.00 17.00 H new ATOM 0 HD23 LEU A 376 36.646 32.794 102.384 1.00 17.00 H new ATOM 2926 N ILE A 377 32.163 33.010 105.944 1.00 12.00 N ATOM 2927 CA ILE A 377 31.648 33.787 107.049 1.00 12.52 C ATOM 2928 C ILE A 377 32.492 33.511 108.285 1.00 11.72 C ATOM 2929 O ILE A 377 33.147 32.466 108.394 1.00 12.53 O ATOM 2930 CB ILE A 377 30.130 33.505 107.318 1.00 12.07 C ATOM 2931 CG1 ILE A 377 29.900 32.068 107.790 1.00 12.97 C ATOM 2932 CG2 ILE A 377 29.325 33.790 106.046 1.00 12.16 C ATOM 2933 CD1 ILE A 377 28.431 31.787 108.189 1.00 12.22 C ATOM 0 H ILE A 377 32.315 32.182 106.121 1.00 12.00 H new ATOM 0 HA ILE A 377 31.708 34.727 106.819 1.00 12.52 H new ATOM 0 HB ILE A 377 29.830 34.093 108.029 1.00 12.07 H new ATOM 0 HG12 ILE A 377 30.160 31.456 107.084 1.00 12.97 H new ATOM 0 HG13 ILE A 377 30.476 31.887 108.549 1.00 12.97 H new ATOM 0 HG21 ILE A 377 28.385 33.616 106.212 1.00 12.16 H new ATOM 0 HG22 ILE A 377 29.441 34.719 105.791 1.00 12.16 H new ATOM 0 HG23 ILE A 377 29.638 33.216 105.329 1.00 12.16 H new ATOM 0 HD11 ILE A 377 28.345 30.865 108.479 1.00 12.22 H new ATOM 0 HD12 ILE A 377 28.173 32.378 108.913 1.00 12.22 H new ATOM 0 HD13 ILE A 377 27.853 31.941 107.425 1.00 12.22 H new ATOM 2934 N ILE A 378 32.473 34.463 109.205 1.00 11.94 N ATOM 2935 CA ILE A 378 33.259 34.377 110.428 1.00 12.67 C ATOM 2936 C ILE A 378 32.331 34.418 111.632 1.00 12.70 C ATOM 2937 O ILE A 378 31.552 35.361 111.796 1.00 13.22 O ATOM 2938 CB ILE A 378 34.252 35.565 110.499 1.00 13.52 C ATOM 2939 CG1 ILE A 378 35.191 35.518 109.293 1.00 15.71 C ATOM 2940 CG2 ILE A 378 35.021 35.537 111.818 1.00 15.71 C ATOM 2941 CD1 ILE A 378 36.175 36.687 109.229 1.00 17.80 C ATOM 0 H ILE A 378 32.003 35.180 109.139 1.00 11.94 H new ATOM 0 HA ILE A 378 33.756 33.544 110.430 1.00 12.67 H new ATOM 0 HB ILE A 378 33.763 36.402 110.469 1.00 13.52 H new ATOM 0 HG12 ILE A 378 35.691 34.687 109.315 1.00 15.71 H new ATOM 0 HG13 ILE A 378 34.660 35.508 108.481 1.00 15.71 H new ATOM 0 HG21 ILE A 378 35.638 36.285 111.849 1.00 15.71 H new ATOM 0 HG22 ILE A 378 34.397 35.602 112.558 1.00 15.71 H new ATOM 0 HG23 ILE A 378 35.517 34.706 111.886 1.00 15.71 H new ATOM 0 HD11 ILE A 378 36.737 36.595 108.444 1.00 17.80 H new ATOM 0 HD12 ILE A 378 35.683 37.522 109.178 1.00 17.80 H new ATOM 0 HD13 ILE A 378 36.730 36.687 110.025 1.00 17.80 H new ATOM 2942 N LEU A 379 32.398 33.376 112.457 1.00 12.65 N ATOM 2943 CA LEU A 379 31.582 33.297 113.669 1.00 13.01 C ATOM 2944 C LEU A 379 32.472 33.594 114.871 1.00 13.49 C ATOM 2945 O LEU A 379 33.574 33.059 114.968 1.00 14.06 O ATOM 2946 CB LEU A 379 30.980 31.896 113.843 1.00 13.09 C ATOM 2947 CG LEU A 379 30.194 31.290 112.677 1.00 12.10 C ATOM 2948 CD1 LEU A 379 29.636 29.943 113.124 1.00 13.51 C ATOM 2949 CD2 LEU A 379 29.069 32.223 112.239 1.00 14.18 C ATOM 0 H LEU A 379 32.913 32.699 112.332 1.00 12.65 H new ATOM 0 HA LEU A 379 30.858 33.939 113.598 1.00 13.01 H new ATOM 0 HB2 LEU A 379 31.705 31.288 114.058 1.00 13.09 H new ATOM 0 HB3 LEU A 379 30.392 31.921 114.614 1.00 13.09 H new ATOM 0 HG LEU A 379 30.780 31.167 111.914 1.00 12.10 H new ATOM 0 HD11 LEU A 379 29.134 29.543 112.397 1.00 13.51 H new ATOM 0 HD12 LEU A 379 30.367 29.356 113.373 1.00 13.51 H new ATOM 0 HD13 LEU A 379 29.052 30.072 113.887 1.00 13.51 H new ATOM 0 HD21 LEU A 379 28.584 31.822 111.501 1.00 14.18 H new ATOM 0 HD22 LEU A 379 28.463 32.370 112.982 1.00 14.18 H new ATOM 0 HD23 LEU A 379 29.444 33.072 111.956 1.00 14.18 H new ATOM 2950 N PRO A 380 32.006 34.439 115.804 1.00 13.40 N ATOM 2951 CA PRO A 380 32.805 34.775 116.994 1.00 13.71 C ATOM 2952 C PRO A 380 32.681 33.651 118.029 1.00 11.90 C ATOM 2953 O PRO A 380 32.112 33.832 119.107 1.00 14.60 O ATOM 2954 CB PRO A 380 32.181 36.086 117.460 1.00 13.47 C ATOM 2955 CG PRO A 380 30.719 35.919 117.082 1.00 13.68 C ATOM 2956 CD PRO A 380 30.775 35.250 115.727 1.00 14.13 C ATOM 0 HA PRO A 380 33.757 34.869 116.835 1.00 13.71 H new ATOM 0 HB2 PRO A 380 32.293 36.218 118.414 1.00 13.47 H new ATOM 0 HB3 PRO A 380 32.581 36.852 117.019 1.00 13.47 H new ATOM 0 HG2 PRO A 380 30.243 35.375 117.729 1.00 13.68 H new ATOM 0 HG3 PRO A 380 30.262 36.773 117.039 1.00 13.68 H new ATOM 0 HD2 PRO A 380 29.993 34.700 115.566 1.00 14.13 H new ATOM 0 HD3 PRO A 380 30.818 35.900 115.008 1.00 14.13 H new ATOM 2957 N ALA A 381 33.225 32.493 117.675 1.00 13.09 N ATOM 2958 CA ALA A 381 33.142 31.300 118.512 1.00 13.20 C ATOM 2959 C ALA A 381 34.348 30.414 118.238 1.00 13.69 C ATOM 2960 O ALA A 381 34.967 30.508 117.177 1.00 14.65 O ATOM 2961 CB ALA A 381 31.848 30.541 118.186 1.00 13.96 C ATOM 0 H ALA A 381 33.655 32.375 116.939 1.00 13.09 H new ATOM 0 HA ALA A 381 33.136 31.552 119.449 1.00 13.20 H new ATOM 0 HB1 ALA A 381 31.790 29.747 118.741 1.00 13.96 H new ATOM 0 HB2 ALA A 381 31.084 31.113 118.360 1.00 13.96 H new ATOM 0 HB3 ALA A 381 31.851 30.282 117.251 1.00 13.96 H new ATOM 2962 N GLU A 382 34.656 29.525 119.178 1.00 14.84 N ATOM 2963 CA GLU A 382 35.820 28.652 119.062 1.00 16.31 C ATOM 2964 C GLU A 382 35.639 27.427 118.187 1.00 15.80 C ATOM 2965 O GLU A 382 36.598 26.900 117.621 1.00 16.96 O ATOM 2966 CB GLU A 382 36.265 28.206 120.455 1.00 19.90 C ATOM 2967 CG GLU A 382 36.565 29.353 121.397 1.00 25.94 C ATOM 2968 CD GLU A 382 37.194 28.893 122.697 1.00 29.09 C ATOM 2969 OE1 GLU A 382 37.418 29.751 123.579 1.00 32.50 O ATOM 2970 OE2 GLU A 382 37.468 27.679 122.836 1.00 31.38 O ATOM 0 H GLU A 382 34.199 29.411 119.897 1.00 14.84 H new ATOM 0 HA GLU A 382 36.493 29.191 118.617 1.00 16.31 H new ATOM 0 HB2 GLU A 382 35.571 27.651 120.845 1.00 19.90 H new ATOM 0 HB3 GLU A 382 37.057 27.652 120.371 1.00 19.90 H new ATOM 0 HG2 GLU A 382 37.161 29.980 120.958 1.00 25.94 H new ATOM 0 HG3 GLU A 382 35.743 29.831 121.591 1.00 25.94 H new ATOM 2971 N ASN A 383 34.401 26.970 118.074 1.00 14.64 N ATOM 2972 CA ASN A 383 34.104 25.789 117.290 1.00 13.56 C ATOM 2973 C ASN A 383 32.593 25.709 117.118 1.00 12.02 C ATOM 2974 O ASN A 383 31.870 26.585 117.596 1.00 11.57 O ATOM 2975 CB ASN A 383 34.637 24.544 118.014 1.00 14.36 C ATOM 2976 CG ASN A 383 34.279 24.532 119.490 1.00 16.16 C ATOM 2977 OD1 ASN A 383 33.129 24.726 119.858 1.00 13.75 O ATOM 2978 ND2 ASN A 383 35.274 24.317 120.348 1.00 19.29 N ATOM 0 H ASN A 383 33.716 27.333 118.447 1.00 14.64 H new ATOM 0 HA ASN A 383 34.530 25.835 116.420 1.00 13.56 H new ATOM 0 HB2 ASN A 383 34.278 23.749 117.591 1.00 14.36 H new ATOM 0 HB3 ASN A 383 35.601 24.506 117.918 1.00 14.36 H new ATOM 0 HD21 ASN A 383 35.119 24.311 121.194 1.00 19.29 H new ATOM 0 HD22 ASN A 383 36.072 24.184 120.056 1.00 19.29 H new ATOM 2979 N GLY A 384 32.139 24.664 116.429 1.00 12.17 N ATOM 2980 CA GLY A 384 30.712 24.486 116.191 1.00 12.49 C ATOM 2981 C GLY A 384 29.882 24.386 117.456 1.00 11.65 C ATOM 2982 O GLY A 384 28.774 24.929 117.532 1.00 11.15 O ATOM 0 H GLY A 384 32.639 24.050 116.093 1.00 12.17 H new ATOM 0 HA2 GLY A 384 30.387 25.230 115.660 1.00 12.49 H new ATOM 0 HA3 GLY A 384 30.579 23.682 115.664 1.00 12.49 H new ATOM 2983 N PHE A 385 30.406 23.667 118.444 1.00 11.41 N ATOM 2984 CA PHE A 385 29.704 23.510 119.711 1.00 10.23 C ATOM 2985 C PHE A 385 29.467 24.876 120.355 1.00 10.44 C ATOM 2986 O PHE A 385 28.353 25.211 120.779 1.00 10.59 O ATOM 2987 CB PHE A 385 30.527 22.619 120.653 1.00 10.60 C ATOM 2988 CG PHE A 385 29.943 22.500 122.034 1.00 10.56 C ATOM 2989 CD1 PHE A 385 29.031 21.491 122.339 1.00 11.96 C ATOM 2990 CD2 PHE A 385 30.279 23.425 123.020 1.00 11.74 C ATOM 2991 CE1 PHE A 385 28.466 21.411 123.613 1.00 12.30 C ATOM 2992 CE2 PHE A 385 29.717 23.350 124.295 1.00 12.35 C ATOM 2993 CZ PHE A 385 28.813 22.345 124.587 1.00 12.18 C ATOM 0 H PHE A 385 31.164 23.264 118.400 1.00 11.41 H new ATOM 0 HA PHE A 385 28.845 23.091 119.547 1.00 10.23 H new ATOM 0 HB2 PHE A 385 30.602 21.733 120.265 1.00 10.60 H new ATOM 0 HB3 PHE A 385 31.426 22.976 120.720 1.00 10.60 H new ATOM 0 HD1 PHE A 385 28.798 20.867 121.690 1.00 11.96 H new ATOM 0 HD2 PHE A 385 30.886 24.102 122.826 1.00 11.74 H new ATOM 0 HE1 PHE A 385 27.859 20.735 123.811 1.00 12.30 H new ATOM 0 HE2 PHE A 385 29.949 23.973 124.945 1.00 12.35 H new ATOM 0 HZ PHE A 385 28.436 22.292 125.435 1.00 12.18 H new ATOM 2994 N ASP A 386 30.530 25.666 120.437 1.00 10.78 N ATOM 2995 CA ASP A 386 30.469 26.979 121.056 1.00 11.01 C ATOM 2996 C ASP A 386 29.511 27.916 120.303 1.00 10.28 C ATOM 2997 O ASP A 386 28.713 28.624 120.924 1.00 10.49 O ATOM 2998 CB ASP A 386 31.899 27.547 121.119 1.00 12.15 C ATOM 2999 CG ASP A 386 32.004 28.852 121.893 1.00 13.11 C ATOM 3000 OD1 ASP A 386 31.378 29.007 122.959 1.00 12.98 O ATOM 3001 OD2 ASP A 386 32.760 29.734 121.430 1.00 14.22 O ATOM 0 H ASP A 386 31.307 25.454 120.135 1.00 10.78 H new ATOM 0 HA ASP A 386 30.112 26.902 121.955 1.00 11.01 H new ATOM 0 HB2 ASP A 386 32.482 26.889 121.529 1.00 12.15 H new ATOM 0 HB3 ASP A 386 32.222 27.689 120.216 1.00 12.15 H new ATOM 3002 N ALA A 387 29.587 27.909 118.974 1.00 10.36 N ATOM 3003 CA ALA A 387 28.721 28.756 118.157 1.00 11.08 C ATOM 3004 C ALA A 387 27.261 28.406 118.394 1.00 11.03 C ATOM 3005 O ALA A 387 26.416 29.291 118.522 1.00 11.26 O ATOM 3006 CB ALA A 387 29.063 28.579 116.689 1.00 11.92 C ATOM 0 H ALA A 387 30.134 27.420 118.525 1.00 10.36 H new ATOM 0 HA ALA A 387 28.863 29.682 118.409 1.00 11.08 H new ATOM 0 HB1 ALA A 387 28.485 29.143 116.152 1.00 11.92 H new ATOM 0 HB2 ALA A 387 29.988 28.829 116.540 1.00 11.92 H new ATOM 0 HB3 ALA A 387 28.934 27.651 116.436 1.00 11.92 H new ATOM 3007 N LEU A 388 26.979 27.105 118.459 1.00 10.40 N ATOM 3008 CA LEU A 388 25.618 26.613 118.669 1.00 10.99 C ATOM 3009 C LEU A 388 25.125 26.931 120.075 1.00 10.65 C ATOM 3010 O LEU A 388 24.027 27.464 120.246 1.00 10.49 O ATOM 3011 CB LEU A 388 25.588 25.104 118.402 1.00 11.42 C ATOM 3012 CG LEU A 388 24.272 24.303 118.409 1.00 10.46 C ATOM 3013 CD1 LEU A 388 23.782 24.107 119.841 1.00 10.86 C ATOM 3014 CD2 LEU A 388 23.213 24.997 117.559 1.00 9.91 C ATOM 0 H LEU A 388 27.570 26.485 118.383 1.00 10.40 H new ATOM 0 HA LEU A 388 25.019 27.061 118.052 1.00 10.99 H new ATOM 0 HB2 LEU A 388 25.996 24.965 117.533 1.00 11.42 H new ATOM 0 HB3 LEU A 388 26.171 24.691 119.059 1.00 11.42 H new ATOM 0 HG LEU A 388 24.438 23.430 118.021 1.00 10.46 H new ATOM 0 HD11 LEU A 388 22.954 23.602 119.834 1.00 10.86 H new ATOM 0 HD12 LEU A 388 24.451 23.622 120.349 1.00 10.86 H new ATOM 0 HD13 LEU A 388 23.629 24.972 120.252 1.00 10.86 H new ATOM 0 HD21 LEU A 388 22.393 24.478 117.576 1.00 9.91 H new ATOM 0 HD22 LEU A 388 23.042 25.883 117.915 1.00 9.91 H new ATOM 0 HD23 LEU A 388 23.529 25.071 116.645 1.00 9.91 H new ATOM 3015 N ARG A 389 25.947 26.647 121.084 1.00 10.80 N ATOM 3016 CA ARG A 389 25.534 26.895 122.461 1.00 10.27 C ATOM 3017 C ARG A 389 25.196 28.355 122.729 1.00 10.11 C ATOM 3018 O ARG A 389 24.184 28.674 123.359 1.00 10.15 O ATOM 3019 CB ARG A 389 26.621 26.445 123.448 1.00 10.07 C ATOM 3020 CG ARG A 389 26.175 26.583 124.908 1.00 10.28 C ATOM 3021 CD ARG A 389 27.233 26.070 125.891 1.00 11.31 C ATOM 3022 NE ARG A 389 28.425 26.918 125.964 1.00 11.10 N ATOM 3023 CZ ARG A 389 28.528 28.054 126.655 1.00 11.60 C ATOM 3024 NH1 ARG A 389 29.680 28.719 126.630 1.00 12.37 N ATOM 3025 NH2 ARG A 389 27.514 28.536 127.364 1.00 12.23 N ATOM 0 H ARG A 389 26.735 26.315 120.994 1.00 10.80 H new ATOM 0 HA ARG A 389 24.726 26.374 122.592 1.00 10.27 H new ATOM 0 HB2 ARG A 389 26.854 25.521 123.269 1.00 10.07 H new ATOM 0 HB3 ARG A 389 27.422 26.972 123.306 1.00 10.07 H new ATOM 0 HG2 ARG A 389 25.984 27.515 125.099 1.00 10.28 H new ATOM 0 HG3 ARG A 389 25.349 26.091 125.039 1.00 10.28 H new ATOM 0 HD2 ARG A 389 26.838 26.004 126.774 1.00 11.31 H new ATOM 0 HD3 ARG A 389 27.498 25.174 125.631 1.00 11.31 H new ATOM 0 HE ARG A 389 29.118 26.661 125.524 1.00 11.10 H new ATOM 0 HH11 ARG A 389 30.342 28.415 126.173 1.00 12.37 H new ATOM 0 HH12 ARG A 389 29.762 29.453 127.070 1.00 12.37 H new ATOM 0 HH21 ARG A 389 26.765 28.113 127.386 1.00 12.23 H new ATOM 0 HH22 ARG A 389 27.606 29.271 127.801 1.00 12.23 H new ATOM 3026 N ARG A 390 26.040 29.250 122.224 1.00 10.13 N ATOM 3027 CA ARG A 390 25.841 30.664 122.456 1.00 10.38 C ATOM 3028 C ARG A 390 25.003 31.390 121.416 1.00 10.60 C ATOM 3029 O ARG A 390 24.748 32.587 121.545 1.00 12.27 O ATOM 3030 CB ARG A 390 27.207 31.344 122.647 1.00 12.38 C ATOM 3031 CG ARG A 390 27.887 30.898 123.941 1.00 12.06 C ATOM 3032 CD ARG A 390 29.149 31.690 124.271 1.00 11.80 C ATOM 3033 NE ARG A 390 30.202 31.548 123.272 1.00 12.35 N ATOM 3034 CZ ARG A 390 30.580 32.518 122.440 1.00 12.24 C ATOM 3035 NH1 ARG A 390 31.556 32.295 121.574 1.00 13.16 N ATOM 3036 NH2 ARG A 390 29.976 33.697 122.470 1.00 13.93 N ATOM 0 H ARG A 390 26.729 29.055 121.748 1.00 10.13 H new ATOM 0 HA ARG A 390 25.309 30.729 123.264 1.00 10.38 H new ATOM 0 HB2 ARG A 390 27.780 31.136 121.892 1.00 12.38 H new ATOM 0 HB3 ARG A 390 27.090 32.307 122.658 1.00 12.38 H new ATOM 0 HG2 ARG A 390 27.258 30.985 124.675 1.00 12.06 H new ATOM 0 HG3 ARG A 390 28.113 29.957 123.871 1.00 12.06 H new ATOM 0 HD2 ARG A 390 28.920 32.629 124.358 1.00 11.80 H new ATOM 0 HD3 ARG A 390 29.489 31.400 125.132 1.00 11.80 H new ATOM 0 HE ARG A 390 30.605 30.790 123.216 1.00 12.35 H new ATOM 0 HH11 ARG A 390 31.943 31.527 121.550 1.00 13.16 H new ATOM 0 HH12 ARG A 390 31.803 32.918 121.035 1.00 13.16 H new ATOM 0 HH21 ARG A 390 29.337 33.839 123.028 1.00 13.93 H new ATOM 0 HH22 ARG A 390 30.223 34.320 121.931 1.00 13.93 H new ATOM 3037 N GLN A 391 24.551 30.654 120.403 1.00 10.75 N ATOM 3038 CA GLN A 391 23.714 31.212 119.328 1.00 10.94 C ATOM 3039 C GLN A 391 24.321 32.526 118.838 1.00 11.67 C ATOM 3040 O GLN A 391 23.652 33.570 118.794 1.00 13.60 O ATOM 3041 CB GLN A 391 22.279 31.434 119.841 1.00 11.22 C ATOM 3042 CG GLN A 391 21.520 30.126 120.127 1.00 10.44 C ATOM 3043 CD GLN A 391 21.142 29.399 118.845 1.00 10.80 C ATOM 3044 OE1 GLN A 391 20.211 29.818 118.143 1.00 11.78 O ATOM 3045 NE2 GLN A 391 21.860 28.323 118.523 1.00 9.63 N ATOM 0 H GLN A 391 24.719 29.815 120.315 1.00 10.75 H new ATOM 0 HA GLN A 391 23.680 30.588 118.586 1.00 10.94 H new ATOM 0 HB2 GLN A 391 22.312 31.965 120.652 1.00 11.22 H new ATOM 0 HB3 GLN A 391 21.785 31.950 119.185 1.00 11.22 H new ATOM 0 HG2 GLN A 391 22.070 29.547 120.677 1.00 10.44 H new ATOM 0 HG3 GLN A 391 20.718 30.322 120.636 1.00 10.44 H new ATOM 0 HE21 GLN A 391 22.499 28.063 119.036 1.00 9.63 H new ATOM 0 HE22 GLN A 391 21.684 27.889 117.802 1.00 9.63 H new ATOM 3046 N VAL A 392 25.589 32.451 118.448 1.00 11.64 N ATOM 3047 CA VAL A 392 26.317 33.635 118.017 1.00 12.28 C ATOM 3048 C VAL A 392 25.867 34.186 116.683 1.00 13.15 C ATOM 3049 O VAL A 392 25.372 33.461 115.827 1.00 12.88 O ATOM 3050 CB VAL A 392 27.847 33.358 117.922 1.00 13.00 C ATOM 3051 CG1 VAL A 392 28.379 32.859 119.266 1.00 13.00 C ATOM 3052 CG2 VAL A 392 28.136 32.349 116.808 1.00 13.37 C ATOM 0 H VAL A 392 26.045 31.722 118.426 1.00 11.64 H new ATOM 0 HA VAL A 392 26.123 34.296 118.700 1.00 12.28 H new ATOM 0 HB VAL A 392 28.304 34.186 117.705 1.00 13.00 H new ATOM 0 HG11 VAL A 392 29.332 32.690 119.195 1.00 13.00 H new ATOM 0 HG12 VAL A 392 28.220 33.531 119.947 1.00 13.00 H new ATOM 0 HG13 VAL A 392 27.923 32.038 119.510 1.00 13.00 H new ATOM 0 HG21 VAL A 392 29.091 32.185 116.759 1.00 13.37 H new ATOM 0 HG22 VAL A 392 27.675 31.517 116.997 1.00 13.37 H new ATOM 0 HG23 VAL A 392 27.826 32.705 115.961 1.00 13.37 H new ATOM 3053 N PRO A 393 26.014 35.502 116.496 1.00 12.45 N ATOM 3054 CA PRO A 393 25.626 36.118 115.227 1.00 12.39 C ATOM 3055 C PRO A 393 26.792 35.908 114.262 1.00 12.09 C ATOM 3056 O PRO A 393 27.817 35.318 114.616 1.00 13.42 O ATOM 3057 CB PRO A 393 25.470 37.585 115.597 1.00 13.64 C ATOM 3058 CG PRO A 393 26.546 37.759 116.649 1.00 14.58 C ATOM 3059 CD PRO A 393 26.341 36.528 117.504 1.00 14.73 C ATOM 0 HA PRO A 393 24.823 35.766 114.812 1.00 12.39 H new ATOM 0 HB2 PRO A 393 25.609 38.169 114.835 1.00 13.64 H new ATOM 0 HB3 PRO A 393 24.586 37.780 115.946 1.00 13.64 H new ATOM 0 HG2 PRO A 393 27.434 37.789 116.260 1.00 14.58 H new ATOM 0 HG3 PRO A 393 26.431 38.578 117.156 1.00 14.58 H new ATOM 0 HD2 PRO A 393 27.138 36.300 118.008 1.00 14.73 H new ATOM 0 HD3 PRO A 393 25.624 36.648 118.146 1.00 14.73 H new ATOM 3060 N VAL A 394 26.629 36.366 113.029 1.00 11.90 N ATOM 3061 CA VAL A 394 27.702 36.264 112.055 1.00 12.11 C ATOM 3062 C VAL A 394 28.490 37.575 112.152 1.00 12.63 C ATOM 3063 O VAL A 394 27.960 38.663 111.860 1.00 14.07 O ATOM 3064 CB VAL A 394 27.135 36.080 110.643 1.00 13.28 C ATOM 3065 CG1 VAL A 394 28.238 36.169 109.615 1.00 13.98 C ATOM 3066 CG2 VAL A 394 26.429 34.730 110.558 1.00 13.23 C ATOM 0 H VAL A 394 25.910 36.737 112.738 1.00 11.90 H new ATOM 0 HA VAL A 394 28.268 35.497 112.234 1.00 12.11 H new ATOM 0 HB VAL A 394 26.497 36.787 110.458 1.00 13.28 H new ATOM 0 HG11 VAL A 394 27.864 36.051 108.728 1.00 13.98 H new ATOM 0 HG12 VAL A 394 28.665 37.038 109.672 1.00 13.98 H new ATOM 0 HG13 VAL A 394 28.895 35.475 109.784 1.00 13.98 H new ATOM 0 HG21 VAL A 394 26.068 34.609 109.666 1.00 13.23 H new ATOM 0 HG22 VAL A 394 27.062 34.021 110.749 1.00 13.23 H new ATOM 0 HG23 VAL A 394 25.707 34.701 111.205 1.00 13.23 H new ATOM 3067 N ARG A 395 29.745 37.477 112.591 1.00 12.75 N ATOM 3068 CA ARG A 395 30.573 38.672 112.753 1.00 13.10 C ATOM 3069 C ARG A 395 30.815 39.355 111.409 1.00 13.46 C ATOM 3070 O ARG A 395 30.682 40.581 111.300 1.00 14.37 O ATOM 3071 CB ARG A 395 31.902 38.308 113.425 1.00 13.54 C ATOM 3072 CG ARG A 395 32.773 39.523 113.743 1.00 15.94 C ATOM 3073 CD ARG A 395 32.151 40.381 114.833 1.00 20.85 C ATOM 3074 NE ARG A 395 32.930 41.592 115.094 1.00 24.62 N ATOM 3075 CZ ARG A 395 32.873 42.698 114.357 1.00 26.28 C ATOM 3076 NH1 ARG A 395 32.068 42.767 113.302 1.00 27.27 N ATOM 3077 NH2 ARG A 395 33.628 43.741 114.673 1.00 27.99 N ATOM 0 H ARG A 395 30.132 36.737 112.798 1.00 12.75 H new ATOM 0 HA ARG A 395 30.099 39.298 113.323 1.00 13.10 H new ATOM 0 HB2 ARG A 395 31.720 37.825 114.246 1.00 13.54 H new ATOM 0 HB3 ARG A 395 32.396 37.707 112.846 1.00 13.54 H new ATOM 0 HG2 ARG A 395 33.653 39.228 114.024 1.00 15.94 H new ATOM 0 HG3 ARG A 395 32.895 40.054 112.941 1.00 15.94 H new ATOM 0 HD2 ARG A 395 31.250 40.628 114.573 1.00 20.85 H new ATOM 0 HD3 ARG A 395 32.079 39.862 115.649 1.00 20.85 H new ATOM 0 HE ARG A 395 33.461 41.588 115.770 1.00 24.62 H new ATOM 0 HH11 ARG A 395 31.578 42.093 113.090 1.00 27.27 H new ATOM 0 HH12 ARG A 395 32.037 43.486 112.831 1.00 27.27 H new ATOM 0 HH21 ARG A 395 34.153 43.702 115.353 1.00 27.99 H new ATOM 0 HH22 ARG A 395 33.593 44.457 114.198 1.00 27.99 H new ATOM 3078 N TYR A 396 31.184 38.563 110.407 1.00 12.75 N ATOM 3079 CA TYR A 396 31.393 39.053 109.046 1.00 12.94 C ATOM 3080 C TYR A 396 30.963 38.014 108.024 1.00 12.37 C ATOM 3081 O TYR A 396 31.194 36.813 108.208 1.00 13.34 O ATOM 3082 CB TYR A 396 32.873 39.335 108.738 1.00 14.83 C ATOM 3083 CG TYR A 396 33.528 40.417 109.558 1.00 18.00 C ATOM 3084 CD1 TYR A 396 34.386 40.091 110.606 1.00 19.61 C ATOM 3085 CD2 TYR A 396 33.313 41.768 109.273 1.00 19.52 C ATOM 3086 CE1 TYR A 396 35.022 41.082 111.353 1.00 21.97 C ATOM 3087 CE2 TYR A 396 33.951 42.769 110.019 1.00 21.88 C ATOM 3088 CZ TYR A 396 34.800 42.412 111.051 1.00 22.53 C ATOM 3089 OH TYR A 396 35.446 43.387 111.785 1.00 26.30 O ATOM 0 H TYR A 396 31.322 37.719 110.498 1.00 12.75 H new ATOM 0 HA TYR A 396 30.870 39.868 108.989 1.00 12.94 H new ATOM 0 HB2 TYR A 396 33.373 38.513 108.863 1.00 14.83 H new ATOM 0 HB3 TYR A 396 32.949 39.574 107.801 1.00 14.83 H new ATOM 0 HD1 TYR A 396 34.537 39.197 110.811 1.00 19.61 H new ATOM 0 HD2 TYR A 396 32.740 42.006 108.580 1.00 19.52 H new ATOM 0 HE1 TYR A 396 35.592 40.849 112.050 1.00 21.97 H new ATOM 0 HE2 TYR A 396 33.805 43.666 109.822 1.00 21.88 H new ATOM 0 HH TYR A 396 35.225 44.145 111.500 1.00 26.30 H new ATOM 3090 N SER A 397 30.362 38.490 106.938 1.00 12.60 N ATOM 3091 CA SER A 397 30.011 37.631 105.825 1.00 11.87 C ATOM 3092 C SER A 397 30.773 38.239 104.657 1.00 12.16 C ATOM 3093 O SER A 397 30.652 39.438 104.394 1.00 12.66 O ATOM 3094 CB SER A 397 28.515 37.648 105.539 1.00 11.59 C ATOM 3095 OG SER A 397 28.262 36.873 104.383 1.00 12.20 O ATOM 0 H SER A 397 30.149 39.316 106.830 1.00 12.60 H new ATOM 0 HA SER A 397 30.232 36.703 105.998 1.00 11.87 H new ATOM 0 HB2 SER A 397 28.024 37.292 106.296 1.00 11.59 H new ATOM 0 HB3 SER A 397 28.209 38.559 105.406 1.00 11.59 H new ATOM 0 HG SER A 397 27.442 36.698 104.337 1.00 12.20 H new ATOM 3096 N VAL A 398 31.561 37.407 103.991 1.00 11.48 N ATOM 3097 CA VAL A 398 32.398 37.809 102.864 1.00 13.51 C ATOM 3098 C VAL A 398 31.955 37.073 101.604 1.00 13.79 C ATOM 3099 O VAL A 398 31.760 35.852 101.621 1.00 13.70 O ATOM 3100 CB VAL A 398 33.881 37.471 103.174 1.00 13.41 C ATOM 3101 CG1 VAL A 398 34.755 37.702 101.942 1.00 15.69 C ATOM 3102 CG2 VAL A 398 34.368 38.320 104.343 1.00 15.62 C ATOM 0 H VAL A 398 31.627 36.572 104.185 1.00 11.48 H new ATOM 0 HA VAL A 398 32.308 38.764 102.722 1.00 13.51 H new ATOM 0 HB VAL A 398 33.946 36.534 103.416 1.00 13.41 H new ATOM 0 HG11 VAL A 398 35.677 37.486 102.154 1.00 15.69 H new ATOM 0 HG12 VAL A 398 34.449 37.135 101.217 1.00 15.69 H new ATOM 0 HG13 VAL A 398 34.695 38.632 101.672 1.00 15.69 H new ATOM 0 HG21 VAL A 398 35.295 38.107 104.534 1.00 15.62 H new ATOM 0 HG22 VAL A 398 34.294 39.260 104.114 1.00 15.62 H new ATOM 0 HG23 VAL A 398 33.826 38.135 105.126 1.00 15.62 H new ATOM 3103 N ARG A 399 31.788 37.809 100.509 1.00 13.55 N ATOM 3104 CA ARG A 399 31.380 37.200 99.255 1.00 14.19 C ATOM 3105 C ARG A 399 32.217 37.837 98.156 1.00 15.79 C ATOM 3106 O ARG A 399 32.291 39.067 98.065 1.00 16.36 O ATOM 3107 CB ARG A 399 29.888 37.445 99.018 1.00 15.82 C ATOM 3108 CG ARG A 399 29.329 36.730 97.809 1.00 15.87 C ATOM 3109 CD ARG A 399 27.818 36.893 97.767 1.00 17.48 C ATOM 3110 NE ARG A 399 27.228 36.392 96.525 1.00 19.20 N ATOM 3111 CZ ARG A 399 27.079 35.107 96.215 1.00 20.61 C ATOM 3112 NH1 ARG A 399 27.475 34.153 97.048 1.00 20.62 N ATOM 3113 NH2 ARG A 399 26.510 34.774 95.062 1.00 24.50 N ATOM 0 H ARG A 399 31.906 38.660 100.474 1.00 13.55 H new ATOM 0 HA ARG A 399 31.518 36.240 99.268 1.00 14.19 H new ATOM 0 HB2 ARG A 399 29.395 37.164 99.805 1.00 15.82 H new ATOM 0 HB3 ARG A 399 29.739 38.398 98.916 1.00 15.82 H new ATOM 0 HG2 ARG A 399 29.724 37.089 96.999 1.00 15.87 H new ATOM 0 HG3 ARG A 399 29.560 35.789 97.844 1.00 15.87 H new ATOM 0 HD2 ARG A 399 27.425 36.423 98.519 1.00 17.48 H new ATOM 0 HD3 ARG A 399 27.595 37.831 97.871 1.00 17.48 H new ATOM 0 HE ARG A 399 26.957 36.973 95.952 1.00 19.20 H new ATOM 0 HH11 ARG A 399 27.834 34.362 97.801 1.00 20.62 H new ATOM 0 HH12 ARG A 399 27.373 33.326 96.835 1.00 20.62 H new ATOM 0 HH21 ARG A 399 26.241 35.387 94.522 1.00 24.50 H new ATOM 0 HH22 ARG A 399 26.411 33.945 94.855 1.00 24.50 H new ATOM 3114 N GLY A 400 32.839 37.005 97.330 1.00 16.04 N ATOM 3115 CA GLY A 400 33.687 37.533 96.272 1.00 16.95 C ATOM 3116 C GLY A 400 34.834 38.339 96.864 1.00 18.48 C ATOM 3117 O GLY A 400 35.352 39.266 96.230 1.00 19.96 O ATOM 0 H GLY A 400 32.785 36.147 97.363 1.00 16.04 H new ATOM 0 HA2 GLY A 400 34.038 36.804 95.737 1.00 16.95 H new ATOM 0 HA3 GLY A 400 33.163 38.093 95.679 1.00 16.95 H new ATOM 3118 N GLY A 401 35.230 37.995 98.086 1.00 17.30 N ATOM 3119 CA GLY A 401 36.325 38.691 98.739 1.00 17.57 C ATOM 3120 C GLY A 401 35.962 40.027 99.349 1.00 17.89 C ATOM 3121 O GLY A 401 36.849 40.757 99.804 1.00 19.33 O ATOM 0 H GLY A 401 34.877 37.363 98.550 1.00 17.30 H new ATOM 0 HA2 GLY A 401 36.684 38.119 99.436 1.00 17.57 H new ATOM 0 HA3 GLY A 401 37.034 38.828 98.092 1.00 17.57 H new ATOM 3122 N LYS A 402 34.673 40.359 99.370 1.00 17.91 N ATOM 3123 CA LYS A 402 34.219 41.625 99.950 1.00 18.11 C ATOM 3124 C LYS A 402 33.228 41.419 101.094 1.00 17.67 C ATOM 3125 O LYS A 402 32.415 40.500 101.059 1.00 17.11 O ATOM 3126 CB LYS A 402 33.552 42.493 98.882 1.00 21.35 C ATOM 3127 CG LYS A 402 34.486 42.929 97.771 1.00 25.09 C ATOM 3128 CD LYS A 402 33.768 43.799 96.758 1.00 28.58 C ATOM 3129 CE LYS A 402 34.745 44.307 95.709 1.00 31.07 C ATOM 3130 NZ LYS A 402 35.425 43.179 95.009 1.00 33.18 N ATOM 0 H LYS A 402 34.044 39.866 99.054 1.00 17.91 H new ATOM 0 HA LYS A 402 35.009 42.065 100.302 1.00 18.11 H new ATOM 0 HB2 LYS A 402 32.811 42.001 98.495 1.00 21.35 H new ATOM 0 HB3 LYS A 402 33.178 43.281 99.306 1.00 21.35 H new ATOM 0 HG2 LYS A 402 35.234 43.418 98.148 1.00 25.09 H new ATOM 0 HG3 LYS A 402 34.852 42.148 97.328 1.00 25.09 H new ATOM 0 HD2 LYS A 402 33.060 43.291 96.331 1.00 28.58 H new ATOM 0 HD3 LYS A 402 33.348 44.549 97.207 1.00 28.58 H new ATOM 0 HE2 LYS A 402 34.272 44.854 95.062 1.00 31.07 H new ATOM 0 HE3 LYS A 402 35.408 44.876 96.130 1.00 31.07 H new ATOM 0 HZ1 LYS A 402 35.805 43.479 94.262 1.00 33.18 H new ATOM 0 HZ2 LYS A 402 36.049 42.833 95.540 1.00 33.18 H new ATOM 0 HZ3 LYS A 402 34.827 42.551 94.807 1.00 33.18 H new ATOM 3131 N VAL A 403 33.280 42.278 102.104 1.00 16.06 N ATOM 3132 CA VAL A 403 32.348 42.167 103.223 1.00 16.56 C ATOM 3133 C VAL A 403 30.956 42.622 102.786 1.00 16.26 C ATOM 3134 O VAL A 403 30.785 43.736 102.282 1.00 16.45 O ATOM 3135 CB VAL A 403 32.814 43.022 104.429 1.00 15.99 C ATOM 3136 CG1 VAL A 403 31.743 43.042 105.517 1.00 17.41 C ATOM 3137 CG2 VAL A 403 34.117 42.458 104.981 1.00 17.87 C ATOM 0 H VAL A 403 33.841 42.927 102.163 1.00 16.06 H new ATOM 0 HA VAL A 403 32.320 41.237 103.498 1.00 16.56 H new ATOM 0 HB VAL A 403 32.961 43.933 104.131 1.00 15.99 H new ATOM 0 HG11 VAL A 403 32.050 43.580 106.263 1.00 17.41 H new ATOM 0 HG12 VAL A 403 30.925 43.422 105.159 1.00 17.41 H new ATOM 0 HG13 VAL A 403 31.573 42.137 105.820 1.00 17.41 H new ATOM 0 HG21 VAL A 403 34.408 42.994 105.736 1.00 17.87 H new ATOM 0 HG22 VAL A 403 33.977 41.543 105.270 1.00 17.87 H new ATOM 0 HG23 VAL A 403 34.797 42.478 104.290 1.00 17.87 H new ATOM 3138 N ILE A 404 29.957 41.753 102.956 1.00 14.44 N ATOM 3139 CA ILE A 404 28.589 42.104 102.583 1.00 14.25 C ATOM 3140 C ILE A 404 27.646 42.209 103.779 1.00 13.30 C ATOM 3141 O ILE A 404 26.493 42.616 103.642 1.00 13.77 O ATOM 3142 CB ILE A 404 28.004 41.118 101.543 1.00 14.79 C ATOM 3143 CG1 ILE A 404 28.138 39.678 102.039 1.00 15.34 C ATOM 3144 CG2 ILE A 404 28.688 41.323 100.191 1.00 14.55 C ATOM 3145 CD1 ILE A 404 27.186 39.338 103.145 1.00 23.31 C ATOM 0 H ILE A 404 30.051 40.963 103.283 1.00 14.44 H new ATOM 0 HA ILE A 404 28.653 42.985 102.183 1.00 14.25 H new ATOM 0 HB ILE A 404 27.057 41.295 101.427 1.00 14.79 H new ATOM 0 HG12 ILE A 404 27.990 39.072 101.296 1.00 15.34 H new ATOM 0 HG13 ILE A 404 29.046 39.532 102.347 1.00 15.34 H new ATOM 0 HG21 ILE A 404 28.318 40.703 99.543 1.00 14.55 H new ATOM 0 HG22 ILE A 404 28.540 42.233 99.888 1.00 14.55 H new ATOM 0 HG23 ILE A 404 29.640 41.164 100.283 1.00 14.55 H new ATOM 0 HD11 ILE A 404 27.319 38.416 103.415 1.00 23.31 H new ATOM 0 HD12 ILE A 404 27.347 39.923 103.902 1.00 23.31 H new ATOM 0 HD13 ILE A 404 26.274 39.455 102.835 1.00 23.31 H new ATOM 3146 N ALA A 405 28.139 41.829 104.955 1.00 14.52 N ATOM 3147 CA ALA A 405 27.362 41.937 106.180 1.00 13.33 C ATOM 3148 C ALA A 405 28.295 41.854 107.371 1.00 13.87 C ATOM 3149 O ALA A 405 29.346 41.221 107.305 1.00 13.31 O ATOM 3150 CB ALA A 405 26.312 40.824 106.259 1.00 13.89 C ATOM 0 H ALA A 405 28.928 41.504 105.062 1.00 14.52 H new ATOM 0 HA ALA A 405 26.899 42.789 106.185 1.00 13.33 H new ATOM 0 HB1 ALA A 405 25.806 40.914 107.082 1.00 13.89 H new ATOM 0 HB2 ALA A 405 25.711 40.892 105.501 1.00 13.89 H new ATOM 0 HB3 ALA A 405 26.754 39.961 106.245 1.00 13.89 H new ATOM 3151 N SER A 406 27.915 42.516 108.454 1.00 14.95 N ATOM 3152 CA SER A 406 28.708 42.470 109.672 1.00 16.13 C ATOM 3153 C SER A 406 27.826 42.752 110.877 1.00 15.86 C ATOM 3154 O SER A 406 26.843 43.486 110.792 1.00 15.92 O ATOM 3155 CB SER A 406 29.859 43.477 109.607 1.00 17.89 C ATOM 3156 OG SER A 406 29.383 44.810 109.588 1.00 21.60 O ATOM 0 H SER A 406 27.203 42.996 108.505 1.00 14.95 H new ATOM 0 HA SER A 406 29.087 41.582 109.760 1.00 16.13 H new ATOM 0 HB2 SER A 406 30.443 43.352 110.371 1.00 17.89 H new ATOM 0 HB3 SER A 406 30.391 43.311 108.813 1.00 17.89 H new ATOM 0 HG SER A 406 30.034 45.340 109.554 1.00 21.60 H new ATOM 3157 N THR A 407 28.166 42.130 111.997 1.00 16.31 N ATOM 3158 CA THR A 407 27.424 42.336 113.225 1.00 17.55 C ATOM 3159 C THR A 407 28.371 42.705 114.347 1.00 18.96 C ATOM 3160 O THR A 407 29.293 41.953 114.659 1.00 19.98 O ATOM 3161 CB THR A 407 26.646 41.063 113.669 1.00 16.68 C ATOM 3162 OG1 THR A 407 25.548 40.823 112.780 1.00 17.41 O ATOM 3163 CG2 THR A 407 26.096 41.240 115.082 1.00 17.49 C ATOM 0 H THR A 407 28.826 41.583 112.065 1.00 16.31 H new ATOM 0 HA THR A 407 26.790 43.048 113.047 1.00 17.55 H new ATOM 0 HB THR A 407 27.260 40.312 113.649 1.00 16.68 H new ATOM 0 HG1 THR A 407 25.840 40.557 112.039 1.00 17.41 H new ATOM 0 HG21 THR A 407 25.614 40.440 115.345 1.00 17.49 H new ATOM 0 HG22 THR A 407 26.829 41.392 115.698 1.00 17.49 H new ATOM 0 HG23 THR A 407 25.494 42.000 115.102 1.00 17.49 H new ATOM 3164 N GLN A 408 28.153 43.875 114.930 1.00 18.99 N ATOM 3165 CA GLN A 408 28.941 44.307 116.071 1.00 22.20 C ATOM 3166 C GLN A 408 28.207 43.611 117.214 1.00 22.32 C ATOM 3167 O GLN A 408 27.038 43.888 117.464 1.00 19.60 O ATOM 3168 CB GLN A 408 28.854 45.819 116.232 1.00 24.29 C ATOM 3169 CG GLN A 408 29.482 46.339 117.513 1.00 29.77 C ATOM 3170 CD GLN A 408 29.393 47.845 117.620 1.00 32.70 C ATOM 3171 OE1 GLN A 408 30.064 48.572 116.882 1.00 35.58 O ATOM 3172 NE2 GLN A 408 28.553 48.325 118.531 1.00 33.90 N ATOM 0 H GLN A 408 27.551 44.435 114.678 1.00 18.99 H new ATOM 0 HA GLN A 408 29.886 44.098 116.011 1.00 22.20 H new ATOM 0 HB2 GLN A 408 29.289 46.241 115.475 1.00 24.29 H new ATOM 0 HB3 GLN A 408 27.921 46.085 116.208 1.00 24.29 H new ATOM 0 HG2 GLN A 408 29.039 45.935 118.276 1.00 29.77 H new ATOM 0 HG3 GLN A 408 30.413 46.068 117.549 1.00 29.77 H new ATOM 0 HE21 GLN A 408 28.102 47.786 119.027 1.00 33.90 H new ATOM 0 HE22 GLN A 408 28.460 49.175 118.625 1.00 33.90 H new ATOM 3173 N PRO A 409 28.874 42.678 117.907 1.00 23.98 N ATOM 3174 CA PRO A 409 28.225 41.966 119.010 1.00 25.06 C ATOM 3175 C PRO A 409 27.651 42.823 120.127 1.00 23.72 C ATOM 3176 O PRO A 409 28.117 43.932 120.394 1.00 24.26 O ATOM 3177 CB PRO A 409 29.327 41.041 119.514 1.00 26.79 C ATOM 3178 CG PRO A 409 30.087 40.729 118.260 1.00 26.33 C ATOM 3179 CD PRO A 409 30.199 42.099 117.623 1.00 26.30 C ATOM 0 HA PRO A 409 27.426 41.517 118.694 1.00 25.06 H new ATOM 0 HB2 PRO A 409 29.887 41.474 120.177 1.00 26.79 H new ATOM 0 HB3 PRO A 409 28.966 40.241 119.926 1.00 26.79 H new ATOM 0 HG2 PRO A 409 30.956 40.342 118.447 1.00 26.33 H new ATOM 0 HG3 PRO A 409 29.613 40.101 117.693 1.00 26.33 H new ATOM 0 HD2 PRO A 409 30.916 42.623 118.013 1.00 26.30 H new ATOM 0 HD3 PRO A 409 30.374 42.043 116.671 1.00 26.30 H new ATOM 3180 N ALA A 410 26.616 42.292 120.764 1.00 23.98 N ATOM 3181 CA ALA A 410 25.984 42.967 121.883 1.00 23.37 C ATOM 3182 C ALA A 410 26.996 42.970 123.022 1.00 23.53 C ATOM 3183 O ALA A 410 27.901 42.134 123.063 1.00 25.35 O ATOM 3184 CB ALA A 410 24.729 42.221 122.304 1.00 23.73 C ATOM 0 H ALA A 410 26.263 41.535 120.560 1.00 23.98 H new ATOM 0 HA ALA A 410 25.725 43.870 121.643 1.00 23.37 H new ATOM 0 HB1 ALA A 410 24.315 42.680 123.052 1.00 23.73 H new ATOM 0 HB2 ALA A 410 24.107 42.188 121.560 1.00 23.73 H new ATOM 0 HB3 ALA A 410 24.963 41.318 122.569 1.00 23.73 H new ATOM 3185 N GLN A 411 26.849 43.916 123.937 1.00 21.82 N ATOM 3186 CA GLN A 411 27.752 44.012 125.073 1.00 21.89 C ATOM 3187 C GLN A 411 26.924 44.009 126.342 1.00 18.99 C ATOM 3188 O GLN A 411 26.138 44.922 126.592 1.00 17.54 O ATOM 3189 CB GLN A 411 28.588 45.283 124.963 1.00 25.11 C ATOM 3190 CG GLN A 411 29.527 45.259 123.766 1.00 29.78 C ATOM 3191 CD GLN A 411 30.258 46.567 123.551 1.00 32.43 C ATOM 3192 OE1 GLN A 411 30.009 47.539 124.421 1.00 35.08 O flip ATOM 3193 NE2 GLN A 411 31.038 46.703 122.607 1.00 34.09 N flip ATOM 0 H GLN A 411 26.231 44.514 123.919 1.00 21.82 H new ATOM 0 HA GLN A 411 28.362 43.258 125.089 1.00 21.89 H new ATOM 0 HB2 GLN A 411 27.998 46.050 124.893 1.00 25.11 H new ATOM 0 HB3 GLN A 411 29.106 45.397 125.775 1.00 25.11 H new ATOM 0 HG2 GLN A 411 30.177 44.549 123.887 1.00 29.78 H new ATOM 0 HG3 GLN A 411 29.018 45.045 122.968 1.00 29.78 H new ATOM 0 HE21 GLN A 411 31.174 46.050 122.064 1.00 34.09 H new ATOM 0 HE22 GLN A 411 31.447 47.451 122.491 1.00 34.09 H new ATOM 3194 N THR A 412 27.103 42.956 127.134 1.00 18.01 N ATOM 3195 CA THR A 412 26.365 42.794 128.374 1.00 16.87 C ATOM 3196 C THR A 412 27.266 43.013 129.585 1.00 16.09 C ATOM 3197 O THR A 412 28.386 42.505 129.647 1.00 16.72 O ATOM 3198 CB THR A 412 25.749 41.387 128.450 1.00 17.50 C ATOM 3199 OG1 THR A 412 24.891 41.186 127.318 1.00 18.72 O ATOM 3200 CG2 THR A 412 24.952 41.218 129.728 1.00 18.15 C ATOM 0 H THR A 412 27.655 42.319 126.965 1.00 18.01 H new ATOM 0 HA THR A 412 25.660 43.460 128.385 1.00 16.87 H new ATOM 0 HB THR A 412 26.464 40.731 128.445 1.00 17.50 H new ATOM 0 HG1 THR A 412 25.313 40.783 126.714 1.00 18.72 H new ATOM 0 HG21 THR A 412 24.572 40.326 129.757 1.00 18.15 H new ATOM 0 HG22 THR A 412 25.535 41.346 130.493 1.00 18.15 H new ATOM 0 HG23 THR A 412 24.238 41.874 129.753 1.00 18.15 H new ATOM 3201 N THR A 413 26.766 43.778 130.548 1.00 14.69 N ATOM 3202 CA THR A 413 27.512 44.083 131.760 1.00 16.85 C ATOM 3203 C THR A 413 26.639 43.862 132.984 1.00 14.48 C ATOM 3204 O THR A 413 25.452 44.184 132.959 1.00 15.81 O ATOM 3205 CB THR A 413 27.960 45.563 131.751 1.00 17.02 C ATOM 3206 OG1 THR A 413 28.726 45.820 130.568 1.00 21.03 O ATOM 3207 CG2 THR A 413 28.802 45.891 132.982 1.00 18.37 C ATOM 0 H THR A 413 25.984 44.135 130.516 1.00 14.69 H new ATOM 0 HA THR A 413 28.286 43.499 131.792 1.00 16.85 H new ATOM 0 HB THR A 413 27.168 46.123 131.765 1.00 17.02 H new ATOM 0 HG1 THR A 413 29.542 45.704 130.731 1.00 21.03 H new ATOM 0 HG21 THR A 413 29.070 46.823 132.952 1.00 18.37 H new ATOM 0 HG22 THR A 413 28.280 45.730 133.784 1.00 18.37 H new ATOM 0 HG23 THR A 413 29.592 45.328 132.993 1.00 18.37 H new ATOM 3208 N VAL A 414 27.209 43.275 134.035 1.00 14.82 N ATOM 3209 CA VAL A 414 26.480 43.112 135.285 1.00 13.64 C ATOM 3210 C VAL A 414 27.207 44.004 136.284 1.00 14.69 C ATOM 3211 O VAL A 414 28.441 44.074 136.292 1.00 16.20 O ATOM 3212 CB VAL A 414 26.416 41.639 135.802 1.00 13.84 C ATOM 3213 CG1 VAL A 414 25.572 40.803 134.838 1.00 14.59 C ATOM 3214 CG2 VAL A 414 27.811 41.051 135.983 1.00 14.16 C ATOM 0 H VAL A 414 28.012 42.967 134.043 1.00 14.82 H new ATOM 0 HA VAL A 414 25.550 43.356 135.158 1.00 13.64 H new ATOM 0 HB VAL A 414 25.996 41.628 136.676 1.00 13.84 H new ATOM 0 HG11 VAL A 414 25.530 39.887 135.155 1.00 14.59 H new ATOM 0 HG12 VAL A 414 24.675 41.170 134.791 1.00 14.59 H new ATOM 0 HG13 VAL A 414 25.975 40.821 133.956 1.00 14.59 H new ATOM 0 HG21 VAL A 414 27.739 40.138 136.304 1.00 14.16 H new ATOM 0 HG22 VAL A 414 28.278 41.058 135.133 1.00 14.16 H new ATOM 0 HG23 VAL A 414 28.305 41.582 136.627 1.00 14.16 H new ATOM 3215 N TYR A 415 26.433 44.705 137.096 1.00 14.79 N ATOM 3216 CA TYR A 415 27.000 45.631 138.070 1.00 16.05 C ATOM 3217 C TYR A 415 26.990 45.044 139.468 1.00 16.37 C ATOM 3218 O TYR A 415 26.028 45.206 140.220 1.00 17.91 O ATOM 3219 CB TYR A 415 26.228 46.952 138.017 1.00 17.51 C ATOM 3220 CG TYR A 415 26.258 47.570 136.636 1.00 19.68 C ATOM 3221 CD1 TYR A 415 25.253 47.301 135.702 1.00 20.42 C ATOM 3222 CD2 TYR A 415 27.339 48.355 136.229 1.00 21.59 C ATOM 3223 CE1 TYR A 415 25.329 47.793 134.401 1.00 22.16 C ATOM 3224 CE2 TYR A 415 27.423 48.851 134.929 1.00 23.24 C ATOM 3225 CZ TYR A 415 26.414 48.564 134.021 1.00 23.70 C ATOM 3226 OH TYR A 415 26.500 49.044 132.733 1.00 25.23 O ATOM 0 H TYR A 415 25.574 44.661 137.102 1.00 14.79 H new ATOM 0 HA TYR A 415 27.929 45.795 137.843 1.00 16.05 H new ATOM 0 HB2 TYR A 415 25.308 46.799 138.282 1.00 17.51 H new ATOM 0 HB3 TYR A 415 26.608 47.574 138.657 1.00 17.51 H new ATOM 0 HD1 TYR A 415 24.521 46.785 135.954 1.00 20.42 H new ATOM 0 HD2 TYR A 415 28.015 48.550 136.837 1.00 21.59 H new ATOM 0 HE1 TYR A 415 24.654 47.604 133.790 1.00 22.16 H new ATOM 0 HE2 TYR A 415 28.150 49.371 134.672 1.00 23.24 H new ATOM 0 HH TYR A 415 27.205 49.492 132.647 1.00 25.23 H new ATOM 3227 N LEU A 416 28.073 44.347 139.790 1.00 18.45 N ATOM 3228 CA LEU A 416 28.229 43.712 141.091 1.00 20.56 C ATOM 3229 C LEU A 416 29.034 44.680 141.949 1.00 22.50 C ATOM 3230 O LEU A 416 28.805 45.881 141.884 1.00 23.24 O ATOM 3231 CB LEU A 416 28.948 42.371 140.923 1.00 20.91 C ATOM 3232 CG LEU A 416 28.327 41.459 139.848 1.00 21.71 C ATOM 3233 CD1 LEU A 416 29.068 40.132 139.808 1.00 22.50 C ATOM 3234 CD2 LEU A 416 26.849 41.234 140.132 1.00 23.07 C ATOM 0 H LEU A 416 28.739 44.229 139.259 1.00 18.45 H new ATOM 0 HA LEU A 416 27.376 43.525 141.513 1.00 20.56 H new ATOM 0 HB2 LEU A 416 29.876 42.538 140.696 1.00 20.91 H new ATOM 0 HB3 LEU A 416 28.944 41.903 141.773 1.00 20.91 H new ATOM 0 HG LEU A 416 28.408 41.891 138.983 1.00 21.71 H new ATOM 0 HD11 LEU A 416 28.674 39.561 139.130 1.00 22.50 H new ATOM 0 HD12 LEU A 416 30.001 40.289 139.595 1.00 22.50 H new ATOM 0 HD13 LEU A 416 29.002 39.698 140.673 1.00 22.50 H new ATOM 0 HD21 LEU A 416 26.472 40.659 139.448 1.00 23.07 H new ATOM 0 HD22 LEU A 416 26.746 40.814 141.000 1.00 23.07 H new ATOM 0 HD23 LEU A 416 26.385 42.086 140.129 1.00 23.07 H new ATOM 3235 N GLU A 417 29.961 44.184 142.756 1.00 24.53 N ATOM 3236 CA GLU A 417 30.747 45.109 143.563 1.00 26.65 C ATOM 3237 C GLU A 417 31.551 45.971 142.598 1.00 26.97 C ATOM 3238 O GLU A 417 31.982 47.078 142.928 1.00 27.71 O ATOM 3239 CB GLU A 417 31.653 44.344 144.528 1.00 28.54 C ATOM 3240 CG GLU A 417 30.861 43.667 145.643 1.00 32.47 C ATOM 3241 CD GLU A 417 31.728 43.149 146.774 1.00 35.07 C ATOM 3242 OE1 GLU A 417 31.156 42.700 147.792 1.00 37.13 O ATOM 3243 OE2 GLU A 417 32.972 43.186 146.651 1.00 37.74 O ATOM 0 H GLU A 417 30.147 43.350 142.851 1.00 24.53 H new ATOM 0 HA GLU A 417 30.175 45.669 144.110 1.00 26.65 H new ATOM 0 HB2 GLU A 417 32.155 43.675 144.037 1.00 28.54 H new ATOM 0 HB3 GLU A 417 32.299 44.955 144.916 1.00 28.54 H new ATOM 0 HG2 GLU A 417 30.217 44.298 146.002 1.00 32.47 H new ATOM 0 HG3 GLU A 417 30.356 42.929 145.268 1.00 32.47 H new ATOM 3244 N GLN A 418 31.714 45.455 141.386 1.00 26.73 N ATOM 3245 CA GLN A 418 32.433 46.135 140.316 1.00 26.77 C ATOM 3246 C GLN A 418 31.750 45.713 139.011 1.00 24.88 C ATOM 3247 O GLN A 418 31.143 44.641 138.949 1.00 24.56 O ATOM 3248 CB GLN A 418 33.901 45.692 140.300 1.00 29.14 C ATOM 3249 CG GLN A 418 34.163 44.353 139.598 1.00 33.98 C ATOM 3250 CD GLN A 418 33.413 43.170 140.212 1.00 37.39 C ATOM 3251 OE1 GLN A 418 32.940 43.331 141.445 1.00 39.07 O flip ATOM 3252 NE2 GLN A 418 33.275 42.119 139.580 1.00 39.04 N flip ATOM 0 H GLN A 418 31.404 44.686 141.158 1.00 26.73 H new ATOM 0 HA GLN A 418 32.416 47.097 140.436 1.00 26.77 H new ATOM 0 HB2 GLN A 418 34.428 46.380 139.864 1.00 29.14 H new ATOM 0 HB3 GLN A 418 34.217 45.630 141.215 1.00 29.14 H new ATOM 0 HG2 GLN A 418 33.912 44.434 138.664 1.00 33.98 H new ATOM 0 HG3 GLN A 418 35.115 44.167 139.621 1.00 33.98 H new ATOM 0 HE21 GLN A 418 33.594 42.051 138.784 1.00 39.04 H new ATOM 0 HE22 GLN A 418 32.860 41.455 139.935 1.00 39.04 H new ATOM 3253 N PRO A 419 31.810 46.552 137.966 1.00 23.69 N ATOM 3254 CA PRO A 419 31.165 46.150 136.709 1.00 22.78 C ATOM 3255 C PRO A 419 31.920 44.972 136.111 1.00 21.80 C ATOM 3256 O PRO A 419 33.143 44.900 136.202 1.00 22.11 O ATOM 3257 CB PRO A 419 31.282 47.399 135.841 1.00 22.76 C ATOM 3258 CG PRO A 419 31.295 48.520 136.855 1.00 23.45 C ATOM 3259 CD PRO A 419 32.212 47.968 137.919 1.00 23.12 C ATOM 0 HA PRO A 419 30.244 45.860 136.806 1.00 22.78 H new ATOM 0 HB2 PRO A 419 32.091 47.390 135.306 1.00 22.76 H new ATOM 0 HB3 PRO A 419 30.536 47.480 135.226 1.00 22.76 H new ATOM 0 HG2 PRO A 419 31.633 49.347 136.478 1.00 23.45 H new ATOM 0 HG3 PRO A 419 30.408 48.707 137.201 1.00 23.45 H new ATOM 0 HD2 PRO A 419 33.147 48.072 137.682 1.00 23.12 H new ATOM 0 HD3 PRO A 419 32.085 48.410 138.773 1.00 23.12 H new ATOM 3260 N GLU A 420 31.199 44.040 135.500 1.00 20.48 N ATOM 3261 CA GLU A 420 31.842 42.882 134.901 1.00 20.03 C ATOM 3262 C GLU A 420 31.184 42.561 133.565 1.00 19.13 C ATOM 3263 O GLU A 420 29.961 42.542 133.467 1.00 18.48 O ATOM 3264 CB GLU A 420 31.738 41.683 135.853 1.00 22.34 C ATOM 3265 CG GLU A 420 32.416 40.417 135.354 1.00 24.97 C ATOM 3266 CD GLU A 420 32.418 39.300 136.387 1.00 26.47 C ATOM 3267 OE1 GLU A 420 32.727 38.147 136.007 1.00 28.60 O ATOM 3268 OE2 GLU A 420 32.117 39.576 137.569 1.00 25.90 O ATOM 0 H GLU A 420 30.343 44.060 135.422 1.00 20.48 H new ATOM 0 HA GLU A 420 32.780 43.077 134.746 1.00 20.03 H new ATOM 0 HB2 GLU A 420 32.127 41.929 136.707 1.00 22.34 H new ATOM 0 HB3 GLU A 420 30.800 41.492 136.012 1.00 22.34 H new ATOM 0 HG2 GLU A 420 31.966 40.109 134.552 1.00 24.97 H new ATOM 0 HG3 GLU A 420 33.331 40.622 135.104 1.00 24.97 H new ATOM 3269 N ALA A 421 32.002 42.344 132.539 1.00 18.13 N ATOM 3270 CA ALA A 421 31.511 42.005 131.210 1.00 17.71 C ATOM 3271 C ALA A 421 31.151 40.523 131.185 1.00 17.95 C ATOM 3272 O ALA A 421 31.915 39.688 131.661 1.00 18.99 O ATOM 3273 CB ALA A 421 32.581 42.289 130.171 1.00 18.85 C ATOM 0 H ALA A 421 32.859 42.390 132.596 1.00 18.13 H new ATOM 0 HA ALA A 421 30.729 42.541 131.005 1.00 17.71 H new ATOM 0 HB1 ALA A 421 32.246 42.060 129.290 1.00 18.85 H new ATOM 0 HB2 ALA A 421 32.813 43.231 130.194 1.00 18.85 H new ATOM 0 HB3 ALA A 421 33.369 41.758 130.364 1.00 18.85 H new ATOM 3274 N ILE A 422 29.994 40.198 130.620 1.00 17.67 N ATOM 3275 CA ILE A 422 29.559 38.806 130.546 1.00 18.25 C ATOM 3276 C ILE A 422 29.471 38.361 129.095 1.00 18.36 C ATOM 3277 O ILE A 422 28.758 38.975 128.298 1.00 20.17 O ATOM 3278 CB ILE A 422 28.167 38.614 131.200 1.00 17.74 C ATOM 3279 CG1 ILE A 422 28.231 38.927 132.695 1.00 19.74 C ATOM 3280 CG2 ILE A 422 27.686 37.187 131.000 1.00 18.73 C ATOM 3281 CD1 ILE A 422 28.375 40.389 132.994 1.00 25.18 C ATOM 0 H ILE A 422 29.447 40.765 130.274 1.00 17.67 H new ATOM 0 HA ILE A 422 30.213 38.273 131.025 1.00 18.25 H new ATOM 0 HB ILE A 422 27.544 39.225 130.776 1.00 17.74 H new ATOM 0 HG12 ILE A 422 27.426 38.594 133.123 1.00 19.74 H new ATOM 0 HG13 ILE A 422 28.979 38.449 133.087 1.00 19.74 H new ATOM 0 HG21 ILE A 422 26.815 37.078 131.413 1.00 18.73 H new ATOM 0 HG22 ILE A 422 27.620 36.998 130.051 1.00 18.73 H new ATOM 0 HG23 ILE A 422 28.316 36.573 131.408 1.00 18.73 H new ATOM 0 HD11 ILE A 422 28.410 40.521 133.954 1.00 25.18 H new ATOM 0 HD12 ILE A 422 29.192 40.723 132.592 1.00 25.18 H new ATOM 0 HD13 ILE A 422 27.616 40.870 132.629 1.00 25.18 H new ATOM 3282 N ASP A 423 30.193 37.300 128.746 1.00 18.65 N ATOM 3283 CA ASP A 423 30.153 36.798 127.379 1.00 18.46 C ATOM 3284 C ASP A 423 29.638 35.364 127.288 1.00 17.32 C ATOM 3285 O ASP A 423 29.632 34.772 126.207 1.00 18.30 O ATOM 3286 CB ASP A 423 31.533 36.902 126.723 1.00 20.94 C ATOM 3287 CG ASP A 423 32.590 36.099 127.444 1.00 22.52 C ATOM 3288 OD1 ASP A 423 33.766 36.171 127.024 1.00 26.99 O ATOM 3289 OD2 ASP A 423 32.269 35.396 128.422 1.00 22.43 O ATOM 0 H ASP A 423 30.706 36.862 129.279 1.00 18.65 H new ATOM 0 HA ASP A 423 29.524 37.359 126.899 1.00 18.46 H new ATOM 0 HB2 ASP A 423 31.473 36.597 125.804 1.00 20.94 H new ATOM 0 HB3 ASP A 423 31.804 37.833 126.696 1.00 20.94 H new ATOM 3290 N TYR A 424 29.200 34.822 128.423 1.00 15.39 N ATOM 3291 CA TYR A 424 28.647 33.466 128.508 1.00 15.04 C ATOM 3292 C TYR A 424 29.607 32.350 128.089 1.00 16.13 C ATOM 3293 O TYR A 424 29.182 31.246 127.763 1.00 14.38 O ATOM 3294 CB TYR A 424 27.354 33.386 127.679 1.00 15.05 C ATOM 3295 CG TYR A 424 26.341 34.458 128.032 1.00 14.20 C ATOM 3296 CD1 TYR A 424 25.472 34.312 129.118 1.00 13.01 C ATOM 3297 CD2 TYR A 424 26.262 35.632 127.284 1.00 15.43 C ATOM 3298 CE1 TYR A 424 24.551 35.313 129.447 1.00 13.66 C ATOM 3299 CE2 TYR A 424 25.349 36.636 127.598 1.00 15.55 C ATOM 3300 CZ TYR A 424 24.497 36.473 128.678 1.00 13.50 C ATOM 3301 OH TYR A 424 23.592 37.466 128.962 1.00 14.93 O ATOM 0 H TYR A 424 29.215 35.236 129.177 1.00 15.39 H new ATOM 0 HA TYR A 424 28.470 33.311 129.449 1.00 15.04 H new ATOM 0 HB2 TYR A 424 27.577 33.459 126.738 1.00 15.05 H new ATOM 0 HB3 TYR A 424 26.949 32.514 127.808 1.00 15.05 H new ATOM 0 HD1 TYR A 424 25.507 33.537 129.630 1.00 13.01 H new ATOM 0 HD2 TYR A 424 26.832 35.747 126.558 1.00 15.43 H new ATOM 0 HE1 TYR A 424 23.980 35.205 130.173 1.00 13.66 H new ATOM 0 HE2 TYR A 424 25.312 37.411 127.086 1.00 15.55 H new ATOM 0 HH TYR A 424 23.431 37.471 129.786 1.00 14.93 H new ATOM 3302 N LYS A 425 30.909 32.629 128.122 1.00 18.20 N ATOM 3303 CA LYS A 425 31.903 31.624 127.752 1.00 22.43 C ATOM 3304 C LYS A 425 32.450 30.926 128.990 1.00 26.05 C ATOM 3305 O LYS A 425 32.247 31.376 130.110 1.00 25.72 O ATOM 3306 CB LYS A 425 33.078 32.266 127.003 1.00 22.60 C ATOM 3307 CG LYS A 425 32.734 32.901 125.665 1.00 23.57 C ATOM 3308 CD LYS A 425 33.972 33.545 125.046 1.00 25.80 C ATOM 3309 CE LYS A 425 33.635 34.315 123.780 1.00 27.01 C ATOM 3310 NZ LYS A 425 34.844 34.958 123.186 1.00 29.97 N ATOM 0 H LYS A 425 31.236 33.390 128.354 1.00 18.20 H new ATOM 0 HA LYS A 425 31.461 30.980 127.177 1.00 22.43 H new ATOM 0 HB2 LYS A 425 33.473 32.944 127.573 1.00 22.60 H new ATOM 0 HB3 LYS A 425 33.757 31.589 126.857 1.00 22.60 H new ATOM 0 HG2 LYS A 425 32.377 32.229 125.064 1.00 23.57 H new ATOM 0 HG3 LYS A 425 32.041 33.569 125.786 1.00 23.57 H new ATOM 0 HD2 LYS A 425 34.381 34.144 125.690 1.00 25.80 H new ATOM 0 HD3 LYS A 425 34.626 32.858 124.842 1.00 25.80 H new ATOM 0 HE2 LYS A 425 33.237 33.714 123.132 1.00 27.01 H new ATOM 0 HE3 LYS A 425 32.973 34.995 123.981 1.00 27.01 H new ATOM 0 HZ1 LYS A 425 34.651 35.795 122.953 1.00 29.97 H new ATOM 0 HZ2 LYS A 425 35.503 34.961 123.784 1.00 29.97 H new ATOM 0 HZ3 LYS A 425 35.100 34.502 122.466 1.00 29.97 H new ATOM 3311 N ARG A 426 33.144 29.817 128.775 1.00 30.44 N ATOM 3312 CA ARG A 426 33.766 29.075 129.866 1.00 33.93 C ATOM 3313 C ARG A 426 35.182 28.712 129.429 1.00 34.70 C ATOM 3314 O ARG A 426 35.537 29.031 128.271 1.00 35.86 O ATOM 3315 CB ARG A 426 32.982 27.798 130.189 1.00 35.93 C ATOM 3316 CG ARG A 426 33.486 27.076 131.441 1.00 38.31 C ATOM 3317 CD ARG A 426 32.654 25.837 131.791 1.00 40.60 C ATOM 3318 NE ARG A 426 33.203 24.597 131.241 1.00 42.94 N ATOM 3319 CZ ARG A 426 33.298 24.320 129.944 1.00 43.68 C ATOM 3320 NH1 ARG A 426 32.879 25.195 129.041 1.00 45.09 N ATOM 3321 NH2 ARG A 426 33.815 23.164 129.545 1.00 43.57 N ATOM 3322 OXT ARG A 426 35.918 28.112 130.240 1.00 36.59 O ATOM 0 H ARG A 426 33.268 29.473 127.997 1.00 30.44 H new ATOM 0 HA ARG A 426 33.776 29.622 130.667 1.00 33.93 H new ATOM 0 HB2 ARG A 426 32.046 28.023 130.308 1.00 35.93 H new ATOM 0 HB3 ARG A 426 33.035 27.194 129.432 1.00 35.93 H new ATOM 0 HG2 ARG A 426 34.410 26.812 131.307 1.00 38.31 H new ATOM 0 HG3 ARG A 426 33.473 27.691 132.191 1.00 38.31 H new ATOM 0 HD2 ARG A 426 32.595 25.757 132.756 1.00 40.60 H new ATOM 0 HD3 ARG A 426 31.750 25.958 131.460 1.00 40.60 H new ATOM 0 HE ARG A 426 33.485 24.004 131.797 1.00 42.94 H new ATOM 0 HH11 ARG A 426 32.544 25.946 129.293 1.00 45.09 H new ATOM 0 HH12 ARG A 426 32.942 25.012 128.203 1.00 45.09 H new ATOM 0 HH21 ARG A 426 34.089 22.592 130.126 1.00 43.57 H new ATOM 0 HH22 ARG A 426 33.875 22.987 128.706 1.00 43.57 H new TER 3323 ARG A 426 HETATM 3324 FE FE A 500 8.210 23.382 102.441 1.00 14.44 FE HETATM 3325 N1 FPY A 501 4.000 23.794 102.068 1.00 15.88 N HETATM 3326 C2 FPY A 501 4.112 22.404 102.262 1.00 15.20 C HETATM 3327 O2 FPY A 501 3.589 21.531 101.559 1.00 15.58 O HETATM 3328 N3 FPY A 501 4.887 22.044 103.353 1.00 13.91 N HETATM 3329 C4 FPY A 501 5.537 22.948 104.238 1.00 15.17 C HETATM 3330 O4 FPY A 501 6.977 22.779 103.867 1.00 15.63 O HETATM 3331 C5 FPY A 501 5.375 24.369 103.999 1.00 15.76 C HETATM 3332 F5 FPY A 501 5.937 25.255 104.799 1.00 15.82 F HETATM 3333 C6 FPY A 501 4.638 24.770 102.946 1.00 15.41 C HETATM 0 HN3 FPY A 501 4.983 21.204 103.508 1.00 13.91 H new HETATM 0 HN1 FPY A 501 3.536 24.080 101.403 1.00 15.88 H new HETATM 0 H6 FPY A 501 4.530 25.718 102.769 1.00 15.41 H new HETATM 0 H4 FPY A 501 5.200 22.750 105.126 1.00 15.17 H new HETATM 3334 C1 GOL A 502 1.148 33.746 82.638 1.00 27.87 C HETATM 3335 O1 GOL A 502 -0.432 33.853 82.908 1.00 27.55 O HETATM 3336 C2 GOL A 502 2.040 34.806 82.707 1.00 25.25 C HETATM 3337 O2 GOL A 502 1.435 35.933 83.045 1.00 28.93 O HETATM 3338 C3 GOL A 502 3.140 34.432 82.433 1.00 28.98 C HETATM 3339 O3 GOL A 502 4.319 33.533 82.030 1.00 20.83 O HETATM 0 HO3 GOL A 502 5.024 33.989 82.006 1.00 20.83 H new HETATM 0 HO1 GOL A 502 -0.630 34.645 83.104 1.00 27.55 H new HETATM 0 H12 GOL A 502 1.480 33.078 83.258 1.00 27.87 H new HETATM 0 H11 GOL A 502 1.242 33.377 81.746 1.00 27.87 H new HETATM 3340 O HOH A 601 15.006 31.846 112.899 1.00 10.92 O HETATM 3341 O HOH A 602 0.777 14.820 109.636 1.00 10.57 O HETATM 3342 O HOH A 603 17.940 18.695 94.621 1.00 9.37 O HETATM 3343 O HOH A 604 6.353 5.007 96.543 1.00 9.67 O HETATM 3344 O HOH A 605 12.092 15.851 108.858 1.00 9.99 O HETATM 3345 O HOH A 606 1.551 20.263 126.248 1.00 12.30 O HETATM 3346 O HOH A 607 34.059 23.175 114.673 1.00 13.77 O HETATM 3347 O HOH A 608 9.395 9.231 104.012 1.00 10.09 O HETATM 3348 O HOH A 609 15.942 26.437 118.498 1.00 11.08 O HETATM 3349 O HOH A 610 5.813 2.340 96.399 1.00 9.92 O HETATM 3350 O HOH A 611 7.781 31.384 104.661 1.00 12.52 O HETATM 3351 O HOH A 612 12.609 24.383 110.216 1.00 10.66 O HETATM 3352 O HOH A 613 11.031 34.072 82.860 1.00 12.49 O HETATM 3353 O HOH A 614 -6.149 7.203 91.223 1.00 11.88 O HETATM 3354 O HOH A 615 16.613 30.881 106.305 1.00 11.97 O HETATM 3355 O HOH A 616 3.404 31.324 91.023 1.00 11.97 O HETATM 3356 O HOH A 617 21.187 24.358 105.997 1.00 10.04 O HETATM 3357 O HOH A 618 14.052 22.119 99.823 1.00 11.50 O HETATM 3358 O HOH A 619 22.011 31.750 109.730 1.00 13.50 O HETATM 3359 O HOH A 620 11.639 32.906 116.240 1.00 14.06 O HETATM 3360 O HOH A 621 6.326 3.047 89.770 1.00 12.54 O HETATM 3361 O HOH A 622 12.176 30.159 115.860 1.00 10.59 O HETATM 3362 O HOH A 623 25.650 36.930 103.963 1.00 12.71 O HETATM 3363 O HOH A 624 2.978 15.259 93.466 1.00 10.03 O HETATM 3364 O HOH A 625 13.827 14.390 104.250 1.00 10.12 O HETATM 3365 O HOH A 626 1.528 23.118 88.950 1.00 12.79 O HETATM 3366 O HOH A 627 0.577 16.017 112.276 1.00 14.26 O HETATM 3367 O HOH A 628 20.236 34.863 92.937 1.00 12.22 O HETATM 3368 O HOH A 629 35.545 25.935 107.233 1.00 13.87 O HETATM 3369 O HOH A 630 -6.307 4.726 92.412 1.00 11.39 O HETATM 3370 O HOH A 631 32.317 28.893 99.797 1.00 14.93 O HETATM 3371 O HOH A 632 24.230 36.751 101.642 1.00 12.05 O HETATM 3372 O HOH A 633 8.747 20.822 96.218 1.00 13.85 O HETATM 3373 O HOH A 634 6.479 14.741 82.591 1.00 13.87 O HETATM 3374 O HOH A 635 31.554 21.988 110.385 1.00 16.87 O HETATM 3375 O HOH A 636 5.950 1.832 107.861 1.00 11.83 O HETATM 3376 O HOH A 637 -5.421 16.639 98.840 1.00 14.69 O HETATM 3377 O HOH A 638 25.599 15.897 114.104 1.00 17.08 O HETATM 3378 O HOH A 639 -2.866 3.681 109.904 1.00 12.91 O HETATM 3379 O HOH A 640 22.464 13.130 86.057 1.00 14.92 O HETATM 3380 O HOH A 641 5.646 10.709 111.444 1.00 10.72 O HETATM 3381 O HOH A 642 15.382 34.563 116.501 1.00 12.71 O HETATM 3382 O HOH A 643 -9.252 12.503 90.269 1.00 13.72 O HETATM 3383 O HOH A 644 23.552 10.681 100.345 1.00 17.23 O HETATM 3384 O HOH A 645 -1.400 10.550 98.004 1.00 12.50 O HETATM 3385 O HOH A 646 -1.765 19.481 82.692 1.00 17.55 O HETATM 3386 O HOH A 647 3.825 38.480 88.987 1.00 16.00 O HETATM 3387 O HOH A 648 5.533 27.850 98.299 1.00 16.02 O HETATM 3388 O HOH A 649 3.121 5.757 99.491 1.00 12.81 O HETATM 3389 O HOH A 650 20.367 19.296 86.523 1.00 15.40 O HETATM 3390 O HOH A 651 -1.373 2.103 101.803 1.00 16.03 O HETATM 3391 O HOH A 652 1.463 32.598 92.526 1.00 14.06 O HETATM 3392 O HOH A 653 -5.727 19.600 94.661 1.00 14.07 O HETATM 3393 O HOH A 654 20.640 18.529 94.070 1.00 12.33 O HETATM 3394 O HOH A 655 22.666 28.573 95.779 1.00 14.94 O HETATM 3395 O HOH A 656 32.032 21.666 113.107 1.00 15.95 O HETATM 3396 O HOH A 657 2.192 44.578 91.784 1.00 18.93 O HETATM 3397 O HOH A 658 22.627 31.528 112.444 1.00 14.70 O HETATM 3398 O HOH A 659 17.524 -3.551 101.502 1.00 15.56 O HETATM 3399 O HOH A 660 24.173 37.722 112.242 1.00 16.52 O HETATM 3400 O HOH A 661 8.659 28.041 76.346 1.00 13.14 O HETATM 3401 O HOH A 662 -2.195 25.444 81.982 1.00 30.92 O HETATM 3402 O HOH A 663 0.065 13.159 114.381 1.00 13.52 O HETATM 3403 O HOH A 664 -0.523 22.245 90.490 1.00 13.26 O HETATM 3404 O HOH A 665 4.129 18.759 101.950 1.00 14.42 O HETATM 3405 O HOH A 666 26.276 16.862 111.584 1.00 17.39 O HETATM 3406 O HOH A 667 27.413 23.095 115.549 1.00 11.94 O HETATM 3407 O HOH A 668 22.750 39.191 127.036 1.00 21.79 O HETATM 3408 O HOH A 669 30.885 26.823 124.556 1.00 15.09 O HETATM 3409 O HOH A 670 18.995 23.819 87.985 1.00 15.17 O HETATM 3410 O HOH A 671 22.608 27.713 93.060 1.00 18.48 O HETATM 3411 O HOH A 672 33.244 29.448 97.313 1.00 17.98 O HETATM 3412 O HOH A 673 29.918 29.708 98.146 1.00 16.96 O HETATM 3413 O HOH A 674 -0.021 0.003 100.880 0.50 27.02 O HETATM 3414 O HOH A 675 26.091 39.943 110.276 1.00 15.91 O HETATM 3415 O HOH A 676 31.091 23.961 108.489 1.00 15.54 O HETATM 3416 O HOH A 677 0.623 5.042 89.612 1.00 18.57 O HETATM 3417 O HOH A 678 2.896 27.173 98.998 1.00 16.69 O HETATM 3418 O HOH A 679 35.363 24.197 103.847 1.00 15.22 O HETATM 3419 O HOH A 680 9.479 37.197 85.766 1.00 15.61 O HETATM 3420 O HOH A 681 7.002 -0.578 100.265 1.00 14.51 O HETATM 3421 O HOH A 682 1.150 27.763 111.870 1.00 18.79 O HETATM 3422 O HOH A 683 2.752 2.643 100.739 1.00 15.87 O HETATM 3423 O HOH A 684 41.378 25.344 113.570 1.00 22.48 O HETATM 3424 O HOH A 685 -0.062 2.811 94.181 1.00 19.40 O HETATM 3425 O HOH A 686 28.999 13.899 124.913 1.00 19.18 O HETATM 3426 O HOH A 687 24.697 33.110 113.109 1.00 18.38 O HETATM 3427 O HOH A 688 25.195 33.731 124.054 1.00 20.94 O HETATM 3428 O HOH A 689 11.300 44.568 101.127 1.00 23.70 O HETATM 3429 O HOH A 690 22.909 35.430 112.919 1.00 22.94 O HETATM 3430 O HOH A 691 21.641 9.130 99.778 1.00 17.43 O HETATM 3431 O HOH A 692 -1.763 10.877 101.722 1.00 17.60 O HETATM 3432 O HOH A 693 -5.337 25.737 86.801 1.00 20.17 O HETATM 3433 O HOH A 694 27.613 34.844 123.773 1.00 19.46 O HETATM 3434 O HOH A 695 12.185 13.166 79.889 1.00 17.26 O HETATM 3435 O HOH A 696 3.057 23.985 79.758 1.00 18.23 O HETATM 3436 O HOH A 697 16.103 -1.092 99.315 1.00 13.46 O HETATM 3437 O HOH A 698 7.923 43.413 86.198 1.00 18.61 O HETATM 3438 O HOH A 699 24.276 11.511 90.652 1.00 22.73 O HETATM 3439 O HOH A 700 13.814 27.186 80.697 1.00 23.11 O HETATM 3440 O HOH A 701 -0.619 25.588 118.153 1.00 16.98 O HETATM 3441 O HOH A 702 2.515 31.080 94.638 1.00 17.86 O HETATM 3442 O HOH A 703 55.815 30.039 111.586 1.00 25.87 O HETATM 3443 O HOH A 704 12.604 13.027 116.217 1.00 21.14 O HETATM 3444 O HOH A 705 35.287 44.463 101.928 1.00 26.05 O HETATM 3445 O HOH A 706 21.950 7.941 91.611 1.00 17.95 O HETATM 3446 O HOH A 707 12.534 44.682 94.059 1.00 22.37 O HETATM 3447 O HOH A 708 17.786 9.195 119.749 1.00 21.11 O HETATM 3448 O HOH A 709 0.137 9.096 102.515 1.00 19.45 O HETATM 3449 O HOH A 710 -2.036 17.748 85.126 1.00 22.56 O HETATM 3450 O HOH A 711 2.144 16.901 108.194 1.00 16.37 O HETATM 3451 O HOH A 712 23.019 21.948 89.307 1.00 18.15 O HETATM 3452 O HOH A 713 18.313 31.439 118.979 1.00 22.96 O HETATM 3453 O HOH A 714 48.285 27.368 115.160 1.00 25.35 O HETATM 3454 O HOH A 715 -0.959 10.547 114.606 1.00 20.90 O HETATM 3455 O HOH A 716 23.600 12.909 98.383 1.00 18.23 O HETATM 3456 O HOH A 717 35.543 36.625 115.393 1.00 24.27 O HETATM 3457 O HOH A 718 15.719 0.309 111.359 1.00 20.91 O HETATM 3458 O HOH A 719 0.323 41.314 90.206 1.00 22.97 O HETATM 3459 O HOH A 720 5.030 22.843 77.777 1.00 25.53 O HETATM 3460 O HOH A 721 25.575 12.386 106.180 1.00 22.50 O HETATM 3461 O HOH A 722 -2.719 26.453 98.571 1.00 24.34 O HETATM 3462 O HOH A 723 0.408 8.588 112.983 1.00 22.78 O HETATM 3463 O HOH A 724 24.023 16.269 95.543 1.00 19.69 O HETATM 3464 O HOH A 725 18.525 26.332 86.467 1.00 28.55 O HETATM 3465 O HOH A 726 44.122 39.190 116.716 1.00 30.05 O HETATM 3466 O HOH A 727 2.785 5.404 87.992 1.00 20.20 O HETATM 3467 O HOH A 728 -2.338 34.462 92.389 1.00 23.33 O HETATM 3468 O HOH A 729 -5.727 32.641 105.419 1.00 23.68 O HETATM 3469 O HOH A 730 12.335 1.861 114.131 1.00 20.81 O HETATM 3470 O HOH A 731 52.278 27.188 106.827 1.00 28.91 O HETATM 3471 O HOH A 732 19.117 23.453 83.097 1.00 21.72 O HETATM 3472 O HOH A 733 31.276 35.777 120.886 1.00 24.38 O HETATM 3473 O HOH A 734 39.746 42.824 110.996 1.00 26.17 O HETATM 3474 O HOH A 735 15.848 34.747 87.192 1.00 21.07 O HETATM 3475 O HOH A 736 43.270 36.933 118.313 1.00 26.08 O HETATM 3476 O HOH A 737 -4.668 30.467 117.511 1.00 33.19 O HETATM 3477 O HOH A 738 22.796 23.781 91.363 1.00 19.71 O HETATM 3478 O HOH A 739 9.779 -1.429 114.502 1.00 18.55 O HETATM 3479 O HOH A 740 -0.709 29.713 82.674 1.00 18.15 O HETATM 3480 O HOH A 741 20.826 11.368 84.424 1.00 22.16 O HETATM 3481 O HOH A 742 0.343 18.416 109.818 1.00 17.32 O HETATM 3482 O HOH A 743 39.666 24.694 104.594 1.00 28.32 O HETATM 3483 O HOH A 744 6.419 17.186 78.906 1.00 21.65 O HETATM 3484 O HOH A 745 46.726 39.985 116.259 1.00 27.91 O HETATM 3485 O HOH A 746 46.845 26.398 99.785 1.00 33.51 O HETATM 3486 O HOH A 747 10.186 9.290 84.512 1.00 22.82 O HETATM 3487 O HOH A 748 48.028 40.259 108.733 1.00 29.01 O HETATM 3488 O HOH A 749 46.591 37.538 98.749 1.00 26.67 O HETATM 3489 O HOH A 750 35.401 22.847 97.076 1.00 25.25 O HETATM 3490 O HOH A 751 26.264 15.200 125.815 1.00 26.60 O HETATM 3491 O HOH A 752 31.386 13.261 121.680 1.00 27.14 O HETATM 3492 O HOH A 753 38.402 24.336 115.082 1.00 31.56 O HETATM 3493 O HOH A 754 33.626 17.151 116.392 1.00 29.96 O HETATM 3494 O HOH A 755 -5.040 27.961 88.582 1.00 23.72 O HETATM 3495 O HOH A 756 14.923 17.772 76.190 1.00 26.25 O HETATM 3496 O HOH A 757 27.161 26.021 91.892 1.00 28.83 O HETATM 3497 O HOH A 758 42.682 24.030 99.212 1.00 25.23 O HETATM 3498 O HOH A 759 18.479 35.821 113.456 1.00 20.99 O HETATM 3499 O HOH A 760 38.710 24.782 94.087 1.00 36.31 O HETATM 3500 O HOH A 761 27.393 11.135 107.774 1.00 23.23 O HETATM 3501 O HOH A 762 20.752 29.625 91.511 1.00 22.05 O HETATM 3502 O HOH A 763 -6.154 27.433 95.393 1.00 23.75 O HETATM 3503 O HOH A 764 33.499 19.282 113.082 1.00 23.89 O HETATM 3504 O HOH A 765 28.314 27.269 94.340 1.00 24.45 O HETATM 3505 O HOH A 766 16.148 31.499 86.700 1.00 25.23 O HETATM 3506 O HOH A 767 29.771 15.041 106.950 1.00 31.12 O HETATM 3507 O HOH A 768 -8.451 8.320 89.702 1.00 20.57 O HETATM 3508 O HOH A 769 14.308 43.488 88.434 1.00 30.01 O HETATM 3509 O HOH A 770 -1.605 41.290 98.187 1.00 38.11 O HETATM 3510 O HOH A 771 47.405 27.644 96.838 1.00 37.72 O HETATM 3511 O HOH A 772 10.804 40.584 84.424 1.00 22.19 O HETATM 3512 O HOH A 773 21.970 3.917 110.437 1.00 30.39 O HETATM 3513 O HOH A 774 44.426 19.794 111.691 1.00 28.55 O HETATM 3514 O HOH A 775 33.169 23.579 95.262 1.00 29.03 O HETATM 3515 O HOH A 776 27.739 19.764 95.641 1.00 25.56 O HETATM 3516 O HOH A 777 39.285 40.345 98.424 1.00 29.70 O HETATM 3517 O HOH A 778 30.194 33.127 93.938 1.00 35.79 O HETATM 3518 O HOH A 779 26.037 39.586 119.930 1.00 28.83 O HETATM 3519 O HOH A 780 -6.152 30.162 95.727 1.00 24.54 O HETATM 3520 O HOH A 781 -0.787 17.220 119.214 1.00 22.06 O HETATM 3521 O HOH A 782 1.112 30.777 111.293 1.00 22.46 O HETATM 3522 O HOH A 783 29.128 47.715 139.811 1.00 28.12 O HETATM 3523 O HOH A 784 39.377 20.567 106.827 1.00 37.04 O HETATM 3524 O HOH A 785 20.404 27.625 89.764 1.00 27.60 O HETATM 3525 O HOH A 786 20.967 43.886 91.939 1.00 25.57 O HETATM 3526 O HOH A 787 -3.369 27.572 117.081 1.00 34.66 O HETATM 3527 O HOH A 788 32.868 28.491 126.916 1.00 23.85 O HETATM 3528 O HOH A 789 -1.758 8.345 118.011 1.00 33.90 O HETATM 3529 O HOH A 790 39.624 28.957 90.249 1.00 37.71 O HETATM 3530 O HOH A 791 24.417 34.757 92.380 1.00 25.58 O HETATM 3531 O HOH A 792 3.505 4.771 113.833 1.00 32.33 O HETATM 3532 O HOH A 793 20.536 5.252 116.291 1.00 29.86 O HETATM 3533 O HOH A 794 47.673 37.363 101.439 1.00 31.17 O HETATM 3534 O HOH A 795 27.061 46.771 128.495 1.00 28.41 O HETATM 3535 O HOH A 796 6.178 19.354 108.977 1.00 12.61 O HETATM 3536 O HOH A 797 19.940 -2.109 105.089 1.00 24.73 O HETATM 3537 O HOH A 798 -5.974 19.075 109.689 1.00 30.58 O HETATM 3538 O HOH A 799 -3.397 18.501 118.263 1.00 32.71 O HETATM 3539 O HOH A 800 36.013 29.490 91.446 1.00 36.58 O HETATM 3540 O HOH A 801 -6.425 37.538 111.029 1.00 34.38 O HETATM 3541 O HOH A 802 -8.970 34.953 99.285 1.00 32.09 O HETATM 3542 O HOH A 803 34.423 23.336 123.275 1.00 28.86 O HETATM 3543 O HOH A 804 0.157 37.590 87.363 1.00 21.67 O HETATM 3544 O HOH A 805 31.780 35.252 94.807 1.00 31.40 O HETATM 3545 O HOH A 806 12.566 10.207 83.705 1.00 28.86 O HETATM 3546 O HOH A 807 29.508 13.527 115.241 1.00 28.44 O HETATM 3547 O HOH A 808 34.342 35.598 93.084 1.00 31.81 O HETATM 3548 O HOH A 809 20.533 30.076 87.706 1.00 29.59 O HETATM 3549 O HOH A 810 31.783 32.506 132.234 1.00 37.52 O HETATM 3550 O HOH A 811 18.987 16.249 81.015 1.00 32.95 O HETATM 3551 O HOH A 812 22.693 1.403 106.781 1.00 44.90 O HETATM 3552 O HOH A 813 27.866 31.637 95.128 1.00 30.84 O HETATM 3553 O HOH A 814 0.660 6.316 100.552 1.00 26.71 O HETATM 3554 O HOH A 815 22.583 2.472 104.223 1.00 40.82 O HETATM 3555 O HOH A 816 37.484 22.186 107.795 1.00 24.55 O HETATM 3556 O HOH A 817 41.697 42.498 115.366 1.00 32.18 O HETATM 3557 O HOH A 818 34.901 32.926 121.167 1.00 35.37 O HETATM 3558 O HOH A 819 40.721 25.528 116.655 1.00 42.82 O HETATM 3559 O HOH A 820 29.233 47.977 126.927 1.00 44.12 O HETATM 3560 O HOH A 821 7.573 39.458 85.662 1.00 25.06 O HETATM 3561 O HOH A 822 -4.779 26.531 84.035 1.00 33.32 O HETATM 3562 O HOH A 823 3.800 18.936 81.567 1.00 28.62 O HETATM 3563 O HOH A 824 1.399 41.488 102.895 1.00 30.38 O HETATM 3564 O HOH A 825 50.764 33.504 119.152 1.00 39.97 O HETATM 3565 O HOH A 826 -4.677 41.836 97.360 1.00 43.10 O HETATM 3566 O HOH A 827 30.856 40.783 96.337 1.00 31.26 O HETATM 3567 O HOH A 828 0.174 26.350 81.578 1.00 34.91 O HETATM 3568 O HOH A 829 -0.812 15.277 84.045 1.00 38.19 O HETATM 3569 O HOH A 830 17.145 23.695 80.078 1.00 28.16 O HETATM 3570 O HOH A 831 -1.327 9.977 120.906 1.00 27.40 O HETATM 3571 O HOH A 832 0.872 45.311 95.954 1.00 41.37 O HETATM 3572 O HOH A 833 33.429 39.692 117.827 1.00 41.43 O HETATM 3573 O HOH A 834 16.984 7.623 117.028 1.00 38.83 O HETATM 3574 O HOH A 835 15.557 9.982 80.987 1.00 28.19 O HETATM 3575 O HOH A 836 26.085 9.235 100.115 1.00 42.99 O HETATM 3576 O HOH A 837 2.692 39.462 84.375 1.00 30.92 O HETATM 3577 O HOH A 838 30.640 35.231 131.275 1.00 22.21 O HETATM 3578 O HOH A 839 42.973 33.320 93.257 1.00 38.00 O HETATM 3579 O HOH A 840 14.071 43.053 106.042 1.00 26.10 O HETATM 3580 O HOH A 841 3.395 11.330 81.408 1.00 34.04 O HETATM 3581 O HOH A 842 26.113 39.844 125.174 1.00 35.57 O HETATM 3582 O HOH A 843 -7.166 27.151 92.646 1.00 36.63 O HETATM 3583 O HOH A 844 35.222 46.635 136.265 1.00 43.47 O HETATM 3584 O HOH A 845 36.275 34.466 127.663 1.00 40.74 O HETATM 3585 O HOH A 846 -1.626 10.400 112.048 1.00 19.02 O HETATM 3586 O HOH A 847 2.795 21.339 78.933 1.00 30.49 O HETATM 3587 O HOH A 848 7.984 15.833 76.180 1.00 34.55 O HETATM 3588 O HOH A 849 25.926 14.379 95.903 1.00 21.20 O HETATM 3589 O HOH A 850 4.452 1.844 112.265 1.00 29.56 O HETATM 3590 O HOH A 851 14.892 34.350 84.604 1.00 44.69 O HETATM 3591 O HOH A 852 16.868 10.429 117.071 1.00 23.46 O HETATM 3592 O HOH A 853 37.512 43.713 99.986 1.00 36.00 O HETATM 3593 O HOH A 854 -3.359 20.988 117.894 1.00 33.58 O HETATM 3594 O HOH A 855 11.650 45.614 98.582 1.00 28.00 O HETATM 3595 O HOH A 856 21.557 39.950 88.474 1.00 29.99 O HETATM 3596 O HOH A 857 54.661 31.569 118.296 0.50 53.53 O HETATM 3597 O HOH A 858 -4.544 9.558 117.248 1.00 38.91 O HETATM 3598 O HOH A 859 22.565 4.142 89.185 1.00 42.78 O HETATM 3599 O HOH A 860 30.627 44.885 99.838 1.00 45.89 O HETATM 3600 O HOH A 861 -1.465 33.303 105.146 1.00 25.40 O HETATM 3601 O HOH A 862 -6.346 11.827 115.184 1.00 28.94 O HETATM 3602 O HOH A 863 31.644 45.367 112.485 1.00 43.28 O HETATM 3603 O HOH A 864 13.018 42.124 84.662 1.00 34.73 O HETATM 3604 O HOH A 865 5.121 42.039 105.667 1.00 31.92 O HETATM 3605 O HOH A 866 12.732 10.691 80.933 1.00 27.86 O HETATM 3606 O HOH A 867 34.898 42.580 132.778 1.00 29.67 O HETATM 3607 O HOH A 868 -3.354 20.688 80.791 1.00 33.36 O HETATM 3608 O HOH A 869 4.381 5.597 84.669 1.00 44.99 O HETATM 3609 O HOH A 870 27.094 36.945 93.595 1.00 31.62 O HETATM 3610 O HOH A 871 15.343 23.664 77.836 1.00 36.66 O HETATM 3611 O HOH A 872 21.798 34.465 117.172 1.00 42.35 O HETATM 3612 O HOH A 873 34.235 37.504 124.624 1.00 50.25 O HETATM 3613 O HOH A 874 26.556 13.806 103.966 1.00 31.23 O HETATM 3614 O HOH A 875 -5.388 18.141 114.786 1.00 34.67 O HETATM 3615 O HOH A 876 34.966 24.399 93.439 1.00 42.78 O HETATM 3616 O HOH A 877 18.898 8.178 81.886 1.00 38.00 O HETATM 3617 O HOH A 878 -8.757 19.437 91.493 1.00 29.03 O HETATM 3618 O HOH A 879 4.624 44.009 101.106 1.00 33.97 O HETATM 3619 O HOH A 880 10.846 45.973 92.450 1.00 41.04 O HETATM 3620 O HOH A 881 19.432 2.211 85.072 1.00 41.82 O HETATM 3621 O HOH A 882 35.739 41.051 115.272 1.00 37.42 O HETATM 3622 O HOH A 883 25.546 39.453 90.876 1.00 29.77 O HETATM 3623 O HOH A 884 19.433 -4.359 103.293 1.00 20.60 O HETATM 3624 O HOH A 885 3.237 18.329 126.274 1.00 25.35 O HETATM 3625 O HOH A 886 -4.727 39.918 107.081 1.00 41.28 O HETATM 3626 O HOH A 887 26.657 16.740 90.786 1.00 30.90 O HETATM 3627 O HOH A 888 25.328 3.150 104.295 1.00 45.52 O HETATM 3628 O HOH A 889 -7.458 7.316 87.193 1.00 30.77 O HETATM 3629 O HOH A 890 14.240 13.629 78.066 1.00 30.16 O HETATM 3630 O HOH A 891 -5.070 31.452 90.239 1.00 37.03 O HETATM 3631 O HOH A 892 31.542 20.681 100.640 1.00 29.69 O HETATM 3632 O HOH A 893 8.251 8.615 82.371 1.00 33.02 O HETATM 3633 O HOH A 894 25.237 15.754 88.785 1.00 33.82 O HETATM 3634 O HOH A 895 12.367 7.174 84.915 1.00 41.43 O HETATM 3635 O HOH A 896 -6.201 18.941 84.507 1.00 30.82 O HETATM 3636 O HOH A 897 -2.145 32.397 107.824 1.00 27.62 O HETATM 3637 O HOH A 898 49.305 26.243 101.030 1.00 42.00 O HETATM 3638 O HOH A 899 28.873 40.753 126.353 1.00 34.62 O HETATM 3639 O HOH A 900 22.876 17.427 84.676 1.00 37.32 O HETATM 3640 O HOH A 901 24.352 9.757 84.920 1.00 46.66 O HETATM 3641 O HOH A 902 42.501 30.622 92.640 1.00 33.92 O HETATM 3642 O HOH A 903 29.122 12.669 120.173 1.00 17.20 O HETATM 3643 O HOH A 904 -1.229 44.065 105.755 1.00 43.83 O HETATM 3644 O HOH A 905 6.102 10.200 83.192 1.00 22.56 O HETATM 3645 O HOH A 906 14.407 45.781 98.701 1.00 42.58 O HETATM 3646 O HOH A 907 7.659 11.765 79.213 1.00 28.28 O HETATM 3647 O HOH A 908 1.394 18.776 79.677 1.00 44.10 O HETATM 3648 O HOH A 909 13.170 45.147 102.954 1.00 33.72 O HETATM 3649 O HOH A 910 1.047 5.594 112.399 1.00 29.28 O HETATM 3650 O HOH A 911 33.620 23.877 107.229 1.00 14.44 O HETATM 3651 O HOH A 912 46.791 41.279 104.216 1.00 41.45 O HETATM 3652 O HOH A 913 36.158 21.692 115.686 1.00 19.38 O HETATM 3653 O HOH A 914 31.239 18.013 105.885 1.00 38.64 O HETATM 3654 O HOH A 915 37.373 24.350 106.001 1.00 18.67 O HETATM 3655 O HOH A 916 -4.904 6.430 88.802 1.00 16.00 O HETATM 3656 O HOH A 917 16.493 28.555 120.319 0.50 16.83 O HETATM 3657 O HOH A 918 17.872 1.236 89.286 1.00 16.42 O HETATM 3658 O HOH A 919 -3.896 33.081 83.883 1.00 34.55 O HETATM 3659 O HOH A 920 8.917 45.482 90.443 1.00 39.32 O HETATM 3660 O HOH A 921 20.931 21.865 87.384 1.00 16.47 O HETATM 3661 O HOH A 922 0.003 -0.015 108.963 0.50 17.79 O HETATM 3662 O HOH A 923 8.298 15.632 80.511 1.00 18.79 O HETATM 3663 O HOH A 924 5.989 12.261 81.485 1.00 18.75 O HETATM 3664 O HOH A 925 14.242 12.060 117.967 1.00 44.76 O HETATM 3665 O HOH A 926 23.789 13.477 88.660 1.00 19.16 O HETATM 3666 O HOH A 927 0.608 31.562 80.217 0.50 17.87 O HETATM 3667 O HOH A 928 -1.331 8.539 99.821 1.00 24.60 O HETATM 3668 O HOH A 929 21.733 33.965 90.784 1.00 25.58 O HETATM 3669 O HOH A 930 10.778 44.596 96.146 1.00 23.10 O HETATM 3670 O HOH A 931 26.949 13.493 114.039 1.00 24.37 O HETATM 3671 O HOH A 932 -0.968 38.775 111.210 1.00 29.10 O HETATM 3672 O HOH A 933 1.330 2.438 91.962 1.00 27.53 O HETATM 3673 O HOH A 934 17.711 35.733 117.260 1.00 26.83 O HETATM 3674 O HOH A 935 26.776 46.383 120.324 0.50 35.79 O HETATM 3675 O HOH A 936 9.499 13.731 78.805 1.00 24.60 O HETATM 3676 O HOH A 937 -0.758 6.550 114.219 1.00 30.60 O HETATM 3677 O HOH A 938 4.028 2.903 88.379 1.00 25.86 O HETATM 3678 O HOH A 939 11.871 38.124 84.917 1.00 25.93 O HETATM 3679 O HOH A 940 28.972 17.124 102.491 1.00 31.48 O HETATM 3680 O HOH A 941 19.066 44.337 90.046 1.00 40.20 O HETATM 3681 O HOH A 942 36.155 19.096 119.097 1.00 41.35 O HETATM 3682 O HOH A 943 14.785 46.410 95.084 1.00 37.75 O HETATM 3683 O HOH A 944 30.141 12.022 117.398 1.00 30.32 O HETATM 3684 O HOH A 945 34.876 21.492 107.287 1.00 24.12 O HETATM 3685 O HOH A 946 33.248 25.355 124.645 1.00 31.54 O HETATM 3686 O HOH A 947 20.368 24.984 90.241 1.00 21.36 O HETATM 3687 O HOH A 948 1.502 39.714 88.144 1.00 25.15 O HETATM 3688 O HOH A 949 28.206 15.443 110.290 1.00 24.94 O HETATM 3689 O HOH A 950 23.178 34.990 125.014 1.00 36.22 O HETATM 3690 O HOH A 951 4.385 31.558 80.224 0.50 13.94 O HETATM 3691 O HOH A 952 13.429 31.557 80.212 0.50 52.03 O HETATM 3692 O HOH A 953 22.321 22.583 85.125 1.00 38.13 O HETATM 3693 O HOH A 954 -3.062 27.812 82.438 1.00 33.83 O HETATM 3694 O HOH A 955 17.808 2.138 109.570 1.00 34.49 O HETATM 3695 O HOH A 956 9.489 6.921 84.537 1.00 26.86 O HETATM 3696 O HOH A 957 18.473 35.007 86.939 1.00 32.11 O HETATM 3697 O HOH A 958 20.507 35.583 88.530 1.00 32.84 O HETATM 3698 O HOH A 959 35.854 22.143 101.997 1.00 34.34 O HETATM 3699 O HOH A 960 17.275 45.648 93.941 1.00 41.30 O HETATM 3700 O HOH A 961 42.084 23.159 105.312 1.00 37.06 O HETATM 3701 O HOH A 962 23.172 38.859 118.545 1.00 38.74 O HETATM 3702 O HOH A 963 21.896 39.665 116.110 1.00 39.91 O HETATM 3703 O HOH A 964 36.685 32.748 119.529 1.00 37.05 O HETATM 3704 O HOH A 965 36.159 35.196 118.495 1.00 40.27 O HETATM 3705 O HOH A 966 33.170 29.571 124.801 1.00 43.75 O HETATM 3706 O HOH A 967 34.588 30.999 123.086 1.00 43.98 O HETATM 3707 O HOH A 968 -2.318 6.955 88.301 1.00 21.24 O HETATM 3708 O HOH A 969 -1.077 4.766 87.611 1.00 36.91 O HETATM 3709 O HOH A 970 -3.764 9.028 85.844 1.00 33.65 O HETATM 3710 O HOH A 971 34.677 19.877 104.937 1.00 43.85 O HETATM 3711 O HOH A 972 -5.618 21.562 102.557 1.00 25.35 O HETATM 3712 O HOH A 973 23.543 14.956 84.270 1.00 34.14 O HETATM 3713 O HOH A 974 24.959 11.743 95.638 1.00 23.85 O HETATM 3714 O HOH A 975 -2.855 23.884 79.846 1.00 34.57 O HETATM 3715 O HOH A 976 0.850 25.680 79.268 1.00 29.32 O HETATM 3716 O HOH A 977 -1.228 4.444 100.475 1.00 28.62 O HETATM 3717 O HOH A 978 -7.945 23.079 94.443 1.00 40.64 O HETATM 3718 O HOH A 979 24.488 25.967 91.406 1.00 29.10 O HETATM 3719 O HOH A 980 -1.746 31.658 81.494 1.00 32.80 O HETATM 3720 O HOH A 981 16.953 27.464 84.881 1.00 38.47 O HETATM 3721 O HOH A 982 23.735 10.771 120.866 1.00 39.24 O HETATM 3722 O HOH A 983 23.912 8.617 118.901 1.00 35.84 O HETATM 3723 O HOH A 984 27.666 10.274 116.053 1.00 34.58 O HETATM 3724 O HOH A 985 24.403 9.885 114.219 1.00 29.46 O HETATM 3725 O HOH A 986 54.667 31.561 115.677 0.50 29.27 O HETATM 3726 O HOH A 987 2.882 8.795 119.322 1.00 35.06 O HETATM 3727 O HOH A 988 5.260 9.141 120.336 0.50 24.10 O HETATM 3728 O HOH A 989 2.385 6.373 119.680 1.00 42.66 O HETATM 3729 O HOH A 990 5.057 19.074 76.742 1.00 33.27 O HETATM 3730 O HOH A 991 9.843 1.866 114.340 1.00 20.60 O HETATM 3731 O HOH A 992 37.578 42.696 113.196 1.00 41.25 O HETATM 3732 O HOH A 993 47.792 42.437 115.959 1.00 35.63 O HETATM 3733 O HOH A 994 48.966 38.611 106.566 1.00 40.36 O HETATM 3734 O HOH A 995 50.179 25.178 105.619 1.00 42.71 O HETATM 3735 O HOH A 996 17.564 20.173 78.284 1.00 39.11 O HETATM 3736 O HOH A 997 18.300 17.592 78.742 1.00 41.03 O HETATM 3737 O HOH A 998 25.566 22.715 87.857 1.00 38.17 O HETATM 3738 O HOH A 999 10.606 45.171 87.354 1.00 43.13 O HETATM 3739 O HOH A1000 -5.294 40.109 109.646 1.00 39.74 O HETATM 3740 O HOH A1001 -9.004 36.092 110.588 1.00 38.79 O HETATM 3741 O HOH A1002 -8.055 33.468 111.899 1.00 30.83 O HETATM 3742 O HOH A1003 28.959 39.801 94.864 1.00 31.25 O HETATM 3743 O HOH A1004 30.666 37.769 94.138 1.00 37.93 O HETATM 3744 O HOH A1005 34.174 17.030 118.795 1.00 37.20 O HETATM 3745 O HOH A1006 20.241 14.143 81.696 1.00 47.67 O HETATM 3746 O HOH A1007 3.343 43.017 103.718 1.00 34.75 O HETATM 3747 O HOH A1008 -4.234 17.594 86.385 1.00 31.86 O HETATM 3748 O HOH A1009 8.150 45.420 95.726 1.00 32.91 O HETATM 3749 O HOH A1010 24.045 40.845 89.329 1.00 34.16 O HETATM 3750 O HOH A1011 24.286 1.132 92.710 1.00 30.09 O HETATM 3751 O HOH A1012 12.678 44.141 86.245 1.00 38.10 O HETATM 3752 O HOH A1013 31.198 45.430 130.047 1.00 39.71 O HETATM 3753 O HOH A1014 1.668 9.057 83.084 1.00 42.47 O HETATM 3754 O HOH A1015 19.538 34.287 118.699 1.00 32.74 O HETATM 3755 O HOH A1016 -4.569 20.460 115.678 1.00 33.23 O HETATM 3756 O HOH A1017 -8.157 18.611 88.485 1.00 36.56 O HETATM 3757 O HOH A1018 24.917 18.095 87.959 1.00 36.89 O HETATM 3758 O HOH A1019 31.530 21.986 97.984 1.00 37.89 O HETATM 3759 O HOH A1020 22.032 36.633 115.674 1.00 39.38 O HETATM 3760 O HOH A1021 23.760 19.938 83.849 1.00 40.14 O HETATM 3761 O HOH A1022 21.622 21.388 79.880 1.00 39.30 O HETATM 3762 O HOH A1023 16.765 46.505 98.212 1.00 42.06 O HETATM 3763 O HOH A1024 30.680 41.180 143.463 1.00 33.02 O HETATM 3764 O HOH A1025 -0.731 17.859 80.662 1.00 43.29 O HETATM 3765 O HOH A1026 5.450 3.270 85.557 1.00 40.59 O HETATM 3766 O HOH A1027 12.815 35.846 83.955 1.00 30.18 O HETATM 3767 O HOH A1028 17.538 46.121 91.412 1.00 45.18 O HETATM 3768 O HOH A1029 19.954 0.472 108.596 1.00 41.92 O HETATM 3769 O HOH A1030 -10.343 21.311 91.421 1.00 31.75 O HETATM 3770 O HOH A1031 5.373 21.309 75.228 1.00 43.95 O HETATM 3771 O HOH A1032 33.657 46.744 100.202 1.00 42.51 O HETATM 3772 O HOH A1033 -1.403 31.194 110.199 1.00 28.98 O CONECT 440 3324 CONECT 458 3324 CONECT 1667 3324 CONECT 2445 3324 CONECT 3324 440 458 1667 2445 CONECT 3324 3330 CONECT 3325 3326 3333 CONECT 3326 3325 3327 3328 CONECT 3327 3326 CONECT 3328 3326 3329 CONECT 3329 3328 3330 3331 CONECT 3330 3324 3329 CONECT 3331 3329 3332 3333 CONECT 3332 3331 CONECT 3333 3325 3331 CONECT 3334 3335 3336 CONECT 3335 3334 CONECT 3336 3334 3337 3338 CONECT 3337 3336 CONECT 3338 3336 3339 CONECT 3339 3338 END