USER MOD reduce.3.24.130724 H: found=0, std=0, add=2538, rem=0, adj=83 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSFERASE 02-MAR-06 2G8D TITLE LACTOBACILLUS CASEI THYMIDYLATE SYNTHASE Y261W-DUMP COMPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: THYMIDYLATE SYNTHASE; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: TS, TSASE; COMPND 5 EC: 2.1.1.45; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS CASEI; SOURCE 3 ORGANISM_TAXID: 1582; SOURCE 4 GENE: THYA; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: CHI2913RECA (THY-); SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PSCTS9 KEYWDS BETA SHEET, ALPHA/BETA PROTEIN, METHYLTRANSFERASE, DUMP COMPLEX, KEYWDS 2 ACTIVE SITE MUTATION, TRANSFERASE EXPDTA X-RAY DIFFRACTION AUTHOR J.S.FINER-MOORE,R.M.STROUD REVDAT 3 13-JUL-11 2G8D 1 VERSN REVDAT 2 20-MAY-08 2G8D 1 JRNL VERSN REVDAT 1 14-MAR-06 2G8D 0 JRNL AUTH Z.NEWBY,T.T.LEE,R.J.MORSE,Y.LIU,L.LIU,P.VENKATRAMAN, JRNL AUTH 2 D.V.SANTI,J.S.FINER-MOORE,R.M.STROUD JRNL TITL THE ROLE OF PROTEIN DYNAMICS IN THYMIDYLATE SYNTHASE JRNL TITL 2 CATALYSIS: VARIANTS OF CONSERVED 2'-DEOXYURIDINE JRNL TITL 3 5'-MONOPHOSPHATE (DUMP)-BINDING TYR-261 JRNL REF BIOCHEMISTRY V. 45 7415 2006 JRNL REFN ISSN 0006-2960 JRNL PMID 16768437 JRNL DOI 10.1021/BI060152S REMARK 2 REMARK 2 RESOLUTION. 2.40 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) : 2.40 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 39.47 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 234767.270 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 88.7 REMARK 3 NUMBER OF REFLECTIONS : 16205 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) : 0.186 REMARK 3 FREE R VALUE : 0.251 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.000 REMARK 3 FREE R VALUE TEST SET COUNT : 1617 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.006 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) : 2.40 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.55 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 76.80 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2064 REMARK 3 BIN R VALUE (WORKING SET) : 0.2940 REMARK 3 BIN FREE R VALUE : 0.3800 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 8.70 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 196 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.027 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2595 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 20 REMARK 3 SOLVENT ATOMS : 80 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 39.00 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -1.13000 REMARK 3 B22 (A**2) : -1.13000 REMARK 3 B33 (A**2) : 2.25000 REMARK 3 B12 (A**2) : 0.18000 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) : 0.27 REMARK 3 ESD FROM SIGMAA (A) : 0.42 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) : 0.37 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.61 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.026 REMARK 3 BOND ANGLES (DEGREES) : 2.40 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 26.60 REMARK 3 IMPROPER ANGLES (DEGREES) : 2.06 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) : 1.490 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.580 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 3.150 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 4.320 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.36 REMARK 3 BSOL : 96.64 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 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 3 : PARAMED.LIG REMARK 3 PARAMETER FILE 4 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : WATER.TOP REMARK 3 TOPOLOGY FILE 3 : UMP_PO4.TOPO REMARK 3 TOPOLOGY FILE 4 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: ARG23 IS IN TWO CONFORMATIONS REMARK 4 REMARK 4 2G8D COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 03-MAR-06. REMARK 100 THE RCSB ID CODE IS RCSB036816. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 01-JAN-96 REMARK 200 TEMPERATURE (KELVIN) : 295 REMARK 200 PH : 7.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RU200 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : GRAPHITE REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : RIGAKU RAXIS IIC REMARK 200 INTENSITY-INTEGRATION SOFTWARE : R-AXIS REMARK 200 DATA SCALING SOFTWARE : CCP4 (TRUNCATE) REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 16205 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.400 REMARK 200 RESOLUTION RANGE LOW (A) : 39.500 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 88.7 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : 0.08800 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 11.0000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.40 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.55 REMARK 200 COMPLETENESS FOR SHELL (%) : 76.8 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 : 2.300 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: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 58.32 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.95 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: VAPOR DIFFUSION AGAINST 20MM KPO4 REMARK 280 BUFFER FROM PROTEIN SOLUTIONS IN THE SAME BUFFER, CONTAINING 15- REMARK 280 20MM AMMONIUM SULFATE, DTT AND 38MM DUMP, PH 7.0, VAPOR REMARK 280 DIFFUSION, HANGING DROP, TEMPERATURE 295.K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 61 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+5/6 REMARK 290 6555 X-Y,X,Z+1/6 REMARK 290 7555 Y,X,-Z+1/3 REMARK 290 8555 X-Y,-Y,-Z REMARK 290 9555 -X,-X+Y,-Z+2/3 REMARK 290 10555 -Y,-X,-Z+5/6 REMARK 290 11555 -X+Y,Y,-Z+1/2 REMARK 290 12555 X,X-Y,-Z+1/6 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 80.66667 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 161.33333 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 121.00000 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 201.66667 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 40.33333 REMARK 290 SMTRY1 7 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 7 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 80.66667 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 9 0.000000 0.000000 -1.000000 161.33333 REMARK 290 SMTRY1 10 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 10 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 201.66667 REMARK 290 SMTRY1 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 121.00000 REMARK 290 SMTRY1 12 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 12 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 40.33333 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: BIOLOGICAL DIMER GENERATED BY CRYSTALLOGRAPHIC TWO-FOLD: REMARK 300 REMARK 300 Y-X,Y,-1/2-Z (APPLIED TO FRACTIONAL COORDINATES) OR REMARK 300 REMARK 300 -X,Y,-121-Z (APPLIED TO ORTHOGONAL ANGSTROM COORDINATES) REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA,PQS REMARK 350 TOTAL BURIED SURFACE AREA: 5870 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 25670 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -23.0 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 -1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 2 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 -121.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 TYR A 202 CE2 TYR A 202 CD2 0.106 REMARK 500 TYR A 216 CE2 TYR A 216 CD2 0.091 REMARK 500 TYR A 304 CD1 TYR A 304 CE1 0.097 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 ASP A 68 CB - CG - OD1 ANGL. DEV. = -5.5 DEGREES REMARK 500 ARG A 72 NE - CZ - NH2 ANGL. DEV. = -3.1 DEGREES REMARK 500 ASP A 141 CB - CG - OD2 ANGL. DEV. = 5.7 DEGREES REMARK 500 LEU A 144 CA - CB - CG ANGL. DEV. = -17.9 DEGREES REMARK 500 ASP A 162 CB - CG - OD2 ANGL. DEV. = 6.4 DEGREES REMARK 500 LEU A 260 CB - CG - CD2 ANGL. DEV. = -12.8 DEGREES REMARK 500 ASP A 293 CB - CG - OD1 ANGL. DEV. = -5.8 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ARG A 23 -16.14 58.53 REMARK 500 THR A 26 -62.60 -96.71 REMARK 500 THR A 49 3.36 -65.73 REMARK 500 LYS A 110 -87.45 -104.66 REMARK 500 ALA A 115 25.03 -58.99 REMARK 500 ASP A 133 -38.43 -36.42 REMARK 500 ALA A 152 56.12 -174.59 REMARK 500 LYS A 157 3.31 -47.28 REMARK 500 ASP A 159 -158.54 -80.12 REMARK 500 ASN A 263 13.64 -53.62 REMARK 500 PRO A 276 150.72 -41.41 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CHIRAL CENTERS REMARK 500 REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY REMARK 500 FOR AMINO ACIDS AND C1'--O4'--N1(N9)--C2' FOR REMARK 500 NUCLEIC ACIDS OR EQUIVALENT ANGLE REMARK 500 M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,6X,F5.1,6X,A1,10X,A1,3X,A16) REMARK 500 REMARK 500 M RES CSSEQI IMPROPER EXPECTED FOUND DETAILS REMARK 500 ASP A 22 24.3 L L OUTSIDE RANGE REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE UMP A 317 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2G86 RELATED DB: PDB REMARK 900 L. CASEI THYMIDYLATE SYNTHASE Y261F-DUMP REMARK 900 RELATED ID: 2G89 RELATED DB: PDB REMARK 900 L. CASEI THYMIDYLATE SYNTHASE Y261A-DUMP REMARK 900 RELATED ID: 2G8A RELATED DB: PDB REMARK 900 L. CASEI THYMIDYLATE SYNTHASE Y261M-DUMP REMARK 900 RELATED ID: 2G8M RELATED DB: PDB REMARK 900 RELATED ID: 2G8O RELATED DB: PDB DBREF 2G8D A 1 316 UNP P00469 TYSY_LACCA 1 316 SEQADV 2G8D TRP A 261 UNP P00469 TYR 261 ENGINEERED SEQRES 1 A 316 MET LEU GLU GLN PRO TYR LEU ASP LEU ALA LYS LYS VAL SEQRES 2 A 316 LEU ASP GLU GLY HIS PHE LYS PRO ASP ARG THR HIS THR SEQRES 3 A 316 GLY THR TYR SER ILE PHE GLY HIS GLN MET ARG PHE ASP SEQRES 4 A 316 LEU SER LYS GLY PHE PRO LEU LEU THR THR LYS LYS VAL SEQRES 5 A 316 PRO PHE GLY LEU ILE LYS SER GLU LEU LEU TRP PHE LEU SEQRES 6 A 316 HIS GLY ASP THR ASN ILE ARG PHE LEU LEU GLN HIS ARG SEQRES 7 A 316 ASN HIS ILE TRP ASP GLU TRP ALA PHE GLU LYS TRP VAL SEQRES 8 A 316 LYS SER ASP GLU TYR HIS GLY PRO ASP MET THR ASP PHE SEQRES 9 A 316 GLY HIS ARG SER GLN LYS ASP PRO GLU PHE ALA ALA VAL SEQRES 10 A 316 TYR HIS GLU GLU MET ALA LYS PHE ASP ASP ARG VAL LEU SEQRES 11 A 316 HIS ASP ASP ALA PHE ALA ALA LYS TYR GLY ASP LEU GLY SEQRES 12 A 316 LEU VAL TYR GLY SER GLN TRP ARG ALA TRP HIS THR SER SEQRES 13 A 316 LYS GLY ASP THR ILE ASP GLN LEU GLY ASP VAL ILE GLU SEQRES 14 A 316 GLN ILE LYS THR HIS PRO TYR SER ARG ARG LEU ILE VAL SEQRES 15 A 316 SER ALA TRP ASN PRO GLU ASP VAL PRO THR MET ALA LEU SEQRES 16 A 316 PRO PRO CYS HIS THR LEU TYR GLN PHE TYR VAL ASN ASP SEQRES 17 A 316 GLY LYS LEU SER LEU GLN LEU TYR GLN ARG SER ALA ASP SEQRES 18 A 316 ILE PHE LEU GLY VAL PRO PHE ASN ILE ALA SER TYR ALA SEQRES 19 A 316 LEU LEU THR HIS LEU VAL ALA HIS GLU CYS GLY LEU GLU SEQRES 20 A 316 VAL GLY GLU PHE ILE HIS THR PHE GLY ASP ALA HIS LEU SEQRES 21 A 316 TRP VAL ASN HIS LEU ASP GLN ILE LYS GLU GLN LEU SER SEQRES 22 A 316 ARG THR PRO ARG PRO ALA PRO THR LEU GLN LEU ASN PRO SEQRES 23 A 316 ASP LYS HIS ASP ILE PHE ASP PHE ASP MET LYS ASP ILE SEQRES 24 A 316 LYS LEU LEU ASN TYR ASP PRO TYR PRO ALA ILE LYS ALA SEQRES 25 A 316 PRO VAL ALA VAL HET UMP A 317 20 HETNAM UMP 2'-DEOXYURIDINE 5'-MONOPHOSPHATE HETSYN UMP DUMP FORMUL 2 UMP C9 H13 N2 O8 P FORMUL 3 HOH *80(H2 O) HELIX 1 1 GLU A 3 GLY A 17 1 15 HELIX 2 2 SER A 41 GLY A 43 5 3 HELIX 3 3 PRO A 53 HIS A 66 1 14 HELIX 4 4 ILE A 71 GLN A 76 1 6 HELIX 5 5 TRP A 82 LYS A 92 1 11 HELIX 6 6 ASP A 103 SER A 108 1 6 HELIX 7 7 GLU A 113 ALA A 116 5 4 HELIX 8 8 VAL A 117 ASP A 132 1 16 HELIX 9 9 ASP A 132 GLY A 140 1 9 HELIX 10 10 VAL A 145 ALA A 152 1 8 HELIX 11 11 ASP A 162 HIS A 174 1 13 HELIX 12 12 ASP A 189 MET A 193 5 5 HELIX 13 13 GLY A 225 CYS A 244 1 20 HELIX 14 14 HIS A 264 LEU A 272 1 9 HELIX 15 15 ASP A 290 PHE A 294 5 5 HELIX 16 16 ASP A 295 LYS A 297 5 3 SHEET 1 A 6 HIS A 18 LYS A 20 0 SHEET 2 A 6 THR A 28 ASP A 39 -1 O THR A 28 N LYS A 20 SHEET 3 A 6 GLU A 247 TRP A 261 -1 O HIS A 253 N MET A 36 SHEET 4 A 6 LYS A 210 ASP A 221 1 N ALA A 220 O HIS A 259 SHEET 5 A 6 HIS A 199 ASN A 207 -1 N TYR A 205 O SER A 212 SHEET 6 A 6 ILE A 181 SER A 183 -1 N VAL A 182 O TYR A 202 SHEET 1 B 2 TRP A 153 HIS A 154 0 SHEET 2 B 2 THR A 160 ILE A 161 -1 O ILE A 161 N TRP A 153 SHEET 1 C 2 THR A 281 LEU A 284 0 SHEET 2 C 2 ILE A 299 LEU A 302 -1 O LYS A 300 N GLN A 283 SITE *** AC1 14 ARG A 23 ARG A 178 ARG A 179 LEU A 195 SITE *** AC1 14 CYS A 198 HIS A 199 GLN A 217 ARG A 218 SITE *** AC1 14 SER A 219 ALA A 220 ASP A 221 ASN A 229 SITE *** AC1 14 HIS A 259 TRP A 261 CRYST1 78.720 78.720 242.000 90.00 90.00 120.00 P 61 2 2 12 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 0.012703 0.007334 0.000000 0.00000 SCALE2 0.000000 0.014668 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004132 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 Set 1.1: A 263 ASN :FLIP amide:sc= -3.53! C(o=-6.1!,f=-2.1!) USER MOD Set 1.2: A 264 HIS : +bothHN:sc= 1.45 K(o=-2.1,f=-10!) USER MOD Set 2.1: A 217 GLN : amide:sc= 1.19 K(o=1.3,f=-1.9) USER MOD Set 2.2: A 229 ASN : amide:sc= -0.254! C(o=1.3!,f=-4.8!) USER MOD Set 2.3: A 253 HIS : no HD1:sc= 0.37 K(o=1.3,f=-2.4) USER MOD Set 3.1: A 199 HIS : no HD1:sc= 0.97 K(o=2.3,f=-0.44) USER MOD Set 3.2: A 233 TYR OH : rot 1:sc= 1.33 USER MOD Set 4.1: A 219 SER OG : rot -177:sc= 1.04 USER MOD Set 4.2: A 259 HIS : no HE2:sc= 0.754 K(o=3.1,f=-8.8!) USER MOD Set 4.3: A 317 UMP O3' : rot 77:sc= 1.27 USER MOD Set 5.1: A 170 GLN :FLIP amide:sc= -0.63 F(o=0.95!,f=1.7) USER MOD Set 5.2: A 173 THR OG1 : rot 86:sc= 1.28 USER MOD Set 5.3: A 174 HIS :FLIP no HD1:sc= 1.01 F(o=-5.3!,f=1.7) USER MOD Set 6.1: A 93 SER OG : rot -81:sc= 0.194 USER MOD Set 6.2: A 138 LYS NZ :NH3+ 160:sc= 0.331 (180deg=-0.0417) USER MOD Set 6.3: A 139 TYR OH : rot 15:sc= 0.489 USER MOD Set 7.1: A 118 TYR OH : rot -41:sc= 0.402 USER MOD Set 7.2: A 122 MET CE :methyl 171:sc= -0.0115 (180deg=-0.0815) USER MOD Set 8.1: A 59 SER OG : rot -144:sc= 1.41 USER MOD Set 8.2: A 79 ASN : amide:sc= -0.969! C(o=0.44!,f=-9.7!) USER MOD Set 9.1: A 49 THR OG1 : rot -76:sc= 0.778 USER MOD Set 9.2: A 271 GLN :FLIP amide:sc= 0.936 F(o=0.85,f=1.7) USER MOD Set10.1: A 35 GLN : amide:sc= 0 X(o=1.9,f=1.9) USER MOD Set10.2: A 214 GLN : amide:sc= 0.606 X(o=1.9,f=2) USER MOD Set10.3: A 254 THR OG1 : rot 137:sc= 1.25 USER MOD Set11.1: A 25 HIS :FLIP no HE2:sc= -0.0285 F(o=-2.3,f=-1.7) USER MOD Set11.2: A 106 HIS : no HD1:sc= -1.7! C(o=-1.7!,f=-6.1!) USER MOD Set12.1: A 24 THR OG1 : rot -160:sc= 0.0193 USER MOD Set12.2: A 26 THR OG1 : rot 130:sc= 0.337 USER MOD Set13.1: A 4 GLN : amide:sc= 0.781 K(o=0.082,f=-1.3) USER MOD Set13.2: A 11 LYS NZ :NH3+ 145:sc= -0.699 (180deg=-0.428) USER MOD Single : A 1 MET CE :methyl -151:sc= -0.32 (180deg=-1.45!) USER MOD Single : A 1 MET N :NH3+ -133:sc= -0.123 (180deg=-1.13) USER MOD Single : A 6 TYR OH : rot -1:sc= 2.43 USER MOD Single : A 12 LYS NZ :NH3+ -121:sc= 0.247 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= 0.00319 X(o=0.0032,f=-0.28) USER MOD Single : A 20 LYS NZ :NH3+ -169:sc= 0.747 (180deg=0.676) USER MOD Single : A 28 THR OG1 : rot -42:sc= 0.348 USER MOD Single : A 29 TYR OH : rot 180:sc= 0.488 USER MOD Single : A 30 SER OG : rot 142:sc= 0.0274 USER MOD Single : A 34 HIS : no HD1:sc= 1.62 K(o=1.6,f=-5.6!) USER MOD Single : A 36 MET CE :methyl -162:sc= 0 (180deg=-0.598) USER MOD Single : A 41 SER OG : rot -79:sc= 1.04 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot -56:sc= 2.26 USER MOD Single : A 50 LYS NZ :NH3+ -131:sc= 1.22 (180deg=-1.12) USER MOD Single : A 51 LYS NZ :NH3+ 174:sc= -0.0156 (180deg=-0.0687) USER MOD Single : A 58 LYS NZ :NH3+ -176:sc= 0.615 (180deg=0.606) USER MOD Single : A 66 HIS : no HD1:sc= 0.305 X(o=0.31,f=-0.057) USER MOD Single : A 69 THR OG1 : rot 112:sc= 1.15 USER MOD Single : A 70 ASN : amide:sc= 0.0626 K(o=0.063,f=-4.8!) USER MOD Single : A 76 GLN :FLIP amide:sc= -2.16 F(o=-5.4!,f=-2.2) USER MOD Single : A 77 HIS : no HE2:sc= 0.647 K(o=0.65,f=-2.2!) USER MOD Single : A 80 HIS : no HE2:sc= 0.861 K(o=0.86,f=-6.9!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -106:sc= -0.439 (180deg=-1.61) USER MOD Single : A 96 TYR OH : rot 17:sc= 0.946 USER MOD Single : A 97 HIS : no HD1:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 101 MET CE :methyl -136:sc= -0.894 (180deg=-5.68!) USER MOD Single : A 102 THR OG1 : rot 105:sc= 0.0376 USER MOD Single : A 108 SER OG : rot -73:sc= 1.22 USER MOD Single : A 109 GLN : amide:sc=-0.00881 X(o=-0.0088,f=-0.015) USER MOD Single : A 110 LYS NZ :NH3+ -141:sc= -0.0642 (180deg=-1.06) USER MOD Single : A 119 HIS :FLIP no HD1:sc= -0.995 F(o=-3.6!,f=-0.99) USER MOD Single : A 124 LYS NZ :NH3+ -159:sc= 1.31 (180deg=0.417) USER MOD Single : A 131 HIS : no HD1:sc= -0.429 X(o=-0.43,f=-0.32) USER MOD Single : A 146 TYR OH : rot 145:sc= 1.38 USER MOD Single : A 148 SER OG : rot -141:sc= 0.256 USER MOD Single : A 149 GLN :FLIP amide:sc= -0.834 F(o=-5.9!,f=-0.83) USER MOD Single : A 154 HIS : no HD1:sc= 0.608 K(o=0.61,f=-0.07) USER MOD Single : A 155 THR OG1 : rot 150:sc= -0.318 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ -163:sc= -0.549 (180deg=-1.75!) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 163 GLN : amide:sc= 1.59 K(o=1.6,f=-1.8!) USER MOD Single : A 172 LYS NZ :NH3+ 167:sc= 0.115 (180deg=0.0822) USER MOD Single : A 176 TYR OH : rot 180:sc= 0 USER MOD Single : A 177 SER OG : rot 180:sc= 0.132 USER MOD Single : A 183 SER OG : rot 180:sc= 0.282 USER MOD Single : A 186 ASN : amide:sc= 0.692 K(o=0.69,f=-4.4!) USER MOD Single : A 192 THR OG1 : rot 63:sc= 1.27 USER MOD Single : A 193 MET CE :methyl -117:sc= -0.0778 (180deg=-0.456) USER MOD Single : A 198 CYS SG : rot -150:sc= 0 USER MOD Single : A 200 THR OG1 : rot -160:sc= 0 USER MOD Single : A 202 TYR OH : rot 159:sc= 0.478 USER MOD Single : A 203 GLN : amide:sc= 0.316 K(o=0.32,f=-0.3) USER MOD Single : A 205 TYR OH : rot 180:sc= 0 USER MOD Single : A 207 ASN :FLIP amide:sc= -0.178 F(o=-1.1,f=-0.18) USER MOD Single : A 210 LYS NZ :NH3+ 152:sc= -0.42 (180deg=-1.64!) USER MOD Single : A 212 SER OG : rot 83:sc= 0.329 USER MOD Single : A 216 TYR OH : rot 180:sc= 0 USER MOD Single : A 232 SER OG : rot -47:sc= 1.43 USER MOD Single : A 237 THR OG1 : rot 69:sc= 0.172 USER MOD Single : A 238 HIS : no HD1:sc= -0.111 X(o=-0.11,f=0.019) USER MOD Single : A 242 HIS : no HD1:sc= 1.13 K(o=1.1,f=-3.5!) USER MOD Single : A 244 CYS SG : rot 180:sc= 0 USER MOD Single : A 267 GLN : amide:sc= 0.998 K(o=1,f=-7.4!) USER MOD Single : A 269 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 273 SER OG : rot -87:sc= 1.18 USER MOD Single : A 275 THR OG1 : rot 83:sc= 1.24 USER MOD Single : A 281 THR OG1 : rot 180:sc= 0 USER MOD Single : A 283 GLN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 285 ASN :FLIP amide:sc= -1.16! C(o=-13!,f=-1.2!) USER MOD Single : A 288 LYS NZ :NH3+ -133:sc= 0.36 (180deg=0.00197) USER MOD Single : A 289 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 296 MET CE :methyl 140:sc= -0.595 (180deg=-1.36) USER MOD Single : A 297 LYS NZ :NH3+ -130:sc= 0.105 (180deg=-0.164) USER MOD Single : A 300 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.208) USER MOD Single : A 303 ASN : amide:sc= -0.0839 X(o=-0.084,f=0) USER MOD Single : A 304 TYR OH : rot -8:sc= 1.21 USER MOD Single : A 307 TYR OH : rot 180:sc= 0.00156 USER MOD Single : A 311 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0358) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.122 27.220 -45.879 1.00 34.33 N ATOM 2 CA MET A 1 4.253 28.174 -44.704 1.00 32.04 C ATOM 3 C MET A 1 4.105 29.594 -45.204 1.00 30.55 C ATOM 4 O MET A 1 4.217 29.823 -46.380 1.00 30.94 O ATOM 5 CB MET A 1 5.599 27.954 -43.995 1.00 33.25 C ATOM 6 CG MET A 1 5.752 26.514 -43.539 1.00 32.20 C ATOM 7 SD MET A 1 4.959 26.332 -41.932 1.00 44.06 S ATOM 8 CE MET A 1 5.993 27.355 -40.922 1.00 34.53 C ATOM 0 H1 MET A 1 3.567 26.559 -45.664 1.00 34.33 H new ATOM 0 H2 MET A 1 3.801 27.659 -46.584 1.00 34.33 H new ATOM 0 H3 MET A 1 4.921 26.883 -46.078 1.00 34.33 H new ATOM 0 HA MET A 1 3.553 28.004 -44.054 1.00 32.04 H new ATOM 0 HB2 MET A 1 6.325 28.184 -44.596 1.00 33.25 H new ATOM 0 HB3 MET A 1 5.665 28.547 -43.230 1.00 33.25 H new ATOM 0 HG2 MET A 1 5.348 25.912 -44.184 1.00 32.20 H new ATOM 0 HG3 MET A 1 6.691 26.278 -43.480 1.00 32.20 H new ATOM 0 HE1 MET A 1 5.990 27.020 -40.012 1.00 34.53 H new ATOM 0 HE2 MET A 1 6.899 27.342 -41.268 1.00 34.53 H new ATOM 0 HE3 MET A 1 5.657 28.265 -40.932 1.00 34.53 H new ATOM 9 N LEU A 2 3.876 30.553 -44.314 1.00 29.27 N ATOM 10 CA LEU A 2 3.511 31.883 -44.710 1.00 25.65 C ATOM 11 C LEU A 2 4.496 32.490 -45.634 1.00 24.90 C ATOM 12 O LEU A 2 4.092 33.100 -46.611 1.00 24.18 O ATOM 13 CB LEU A 2 3.446 32.761 -43.532 1.00 26.15 C ATOM 14 CG LEU A 2 2.271 33.715 -43.407 1.00 27.94 C ATOM 15 CD1 LEU A 2 2.846 34.849 -42.614 1.00 27.12 C ATOM 16 CD2 LEU A 2 1.769 34.261 -44.729 1.00 28.24 C ATOM 0 H LEU A 2 3.931 30.440 -43.463 1.00 29.27 H new ATOM 0 HA LEU A 2 2.652 31.804 -45.154 1.00 25.65 H new ATOM 0 HB2 LEU A 2 3.454 32.197 -42.743 1.00 26.15 H new ATOM 0 HB3 LEU A 2 4.259 33.289 -43.512 1.00 26.15 H new ATOM 0 HG LEU A 2 1.508 33.263 -43.014 1.00 27.94 H new ATOM 0 HD11 LEU A 2 2.165 35.526 -42.476 1.00 27.12 H new ATOM 0 HD12 LEU A 2 3.154 34.520 -41.755 1.00 27.12 H new ATOM 0 HD13 LEU A 2 3.592 35.236 -43.097 1.00 27.12 H new ATOM 0 HD21 LEU A 2 1.022 34.859 -44.570 1.00 28.24 H new ATOM 0 HD22 LEU A 2 2.483 34.746 -45.171 1.00 28.24 H new ATOM 0 HD23 LEU A 2 1.480 33.527 -45.294 1.00 28.24 H new ATOM 17 N GLU A 3 5.792 32.283 -45.384 1.00 22.46 N ATOM 18 CA GLU A 3 6.777 33.013 -46.171 1.00 19.91 C ATOM 19 C GLU A 3 7.120 32.300 -47.468 1.00 20.02 C ATOM 20 O GLU A 3 7.887 32.831 -48.260 1.00 22.14 O ATOM 21 CB GLU A 3 8.044 33.407 -45.329 1.00 19.30 C ATOM 22 CG GLU A 3 9.029 32.316 -45.084 1.00 13.98 C ATOM 23 CD GLU A 3 10.105 32.678 -44.014 1.00 19.90 C ATOM 24 OE1 GLU A 3 11.289 33.032 -44.419 1.00 15.85 O ATOM 25 OE2 GLU A 3 9.779 32.629 -42.778 1.00 14.34 O ATOM 0 H GLU A 3 6.108 31.748 -44.789 1.00 22.46 H new ATOM 0 HA GLU A 3 6.363 33.851 -46.430 1.00 19.91 H new ATOM 0 HB2 GLU A 3 8.499 34.134 -45.783 1.00 19.30 H new ATOM 0 HB3 GLU A 3 7.747 33.749 -44.471 1.00 19.30 H new ATOM 0 HG2 GLU A 3 8.554 31.520 -44.799 1.00 13.98 H new ATOM 0 HG3 GLU A 3 9.473 32.098 -45.918 1.00 13.98 H new ATOM 26 N GLN A 4 6.551 31.141 -47.746 1.00 18.73 N ATOM 27 CA GLN A 4 7.030 30.405 -48.908 1.00 19.20 C ATOM 28 C GLN A 4 6.995 31.207 -50.238 1.00 18.86 C ATOM 29 O GLN A 4 7.765 30.914 -51.140 1.00 21.27 O ATOM 30 CB GLN A 4 6.197 29.126 -49.092 1.00 18.71 C ATOM 31 CG GLN A 4 6.746 28.091 -50.151 1.00 17.65 C ATOM 32 CD GLN A 4 8.199 27.653 -49.902 1.00 24.89 C ATOM 33 OE1 GLN A 4 8.689 27.552 -48.731 1.00 21.61 O ATOM 34 NE2 GLN A 4 8.925 27.380 -51.021 1.00 26.67 N ATOM 0 H GLN A 4 5.915 30.773 -47.300 1.00 18.73 H new ATOM 0 HA GLN A 4 7.961 30.207 -48.722 1.00 19.20 H new ATOM 0 HB2 GLN A 4 6.129 28.679 -48.234 1.00 18.71 H new ATOM 0 HB3 GLN A 4 5.298 29.381 -49.351 1.00 18.71 H new ATOM 0 HG2 GLN A 4 6.176 27.306 -50.148 1.00 17.65 H new ATOM 0 HG3 GLN A 4 6.683 28.484 -51.036 1.00 17.65 H new ATOM 0 HE21 GLN A 4 8.564 27.458 -51.798 1.00 26.67 H new ATOM 0 HE22 GLN A 4 9.745 27.129 -50.951 1.00 26.67 H new ATOM 35 N PRO A 5 5.999 32.084 -50.442 1.00 17.84 N ATOM 36 CA PRO A 5 5.990 32.711 -51.782 1.00 17.38 C ATOM 37 C PRO A 5 7.244 33.495 -51.975 1.00 18.14 C ATOM 38 O PRO A 5 7.730 33.646 -53.137 1.00 18.27 O ATOM 39 CB PRO A 5 4.796 33.606 -51.772 1.00 13.94 C ATOM 40 CG PRO A 5 3.903 33.035 -50.769 1.00 16.64 C ATOM 41 CD PRO A 5 4.794 32.424 -49.671 1.00 18.09 C ATOM 0 HA PRO A 5 5.947 32.064 -52.504 1.00 17.38 H new ATOM 0 HB2 PRO A 5 5.042 34.517 -51.546 1.00 13.94 H new ATOM 0 HB3 PRO A 5 4.372 33.635 -52.644 1.00 13.94 H new ATOM 0 HG2 PRO A 5 3.321 33.717 -50.399 1.00 16.64 H new ATOM 0 HG3 PRO A 5 3.331 32.358 -51.164 1.00 16.64 H new ATOM 0 HD2 PRO A 5 4.981 33.054 -48.958 1.00 18.09 H new ATOM 0 HD3 PRO A 5 4.388 31.644 -49.261 1.00 18.09 H new ATOM 42 N TYR A 6 7.853 33.864 -50.833 1.00 19.12 N ATOM 43 CA TYR A 6 9.091 34.667 -50.892 1.00 19.42 C ATOM 44 C TYR A 6 10.184 33.744 -51.372 1.00 21.28 C ATOM 45 O TYR A 6 10.898 34.104 -52.354 1.00 22.56 O ATOM 46 CB TYR A 6 9.487 35.390 -49.613 1.00 18.07 C ATOM 47 CG TYR A 6 10.869 35.945 -49.766 1.00 17.33 C ATOM 48 CD1 TYR A 6 11.068 37.174 -50.369 1.00 19.52 C ATOM 49 CD2 TYR A 6 11.985 35.213 -49.391 1.00 14.78 C ATOM 50 CE1 TYR A 6 12.312 37.705 -50.546 1.00 17.78 C ATOM 51 CE2 TYR A 6 13.239 35.720 -49.538 1.00 18.70 C ATOM 52 CZ TYR A 6 13.409 37.005 -50.107 1.00 20.70 C ATOM 53 OH TYR A 6 14.683 37.550 -50.314 1.00 19.93 O ATOM 0 H TYR A 6 7.578 33.668 -50.042 1.00 19.12 H new ATOM 0 HA TYR A 6 8.932 35.405 -51.502 1.00 19.42 H new ATOM 0 HB2 TYR A 6 8.859 36.105 -49.426 1.00 18.07 H new ATOM 0 HB3 TYR A 6 9.454 34.779 -48.860 1.00 18.07 H new ATOM 0 HD1 TYR A 6 10.328 37.655 -50.664 1.00 19.52 H new ATOM 0 HD2 TYR A 6 11.875 34.362 -49.033 1.00 14.78 H new ATOM 0 HE1 TYR A 6 12.416 38.532 -50.959 1.00 17.78 H new ATOM 0 HE2 TYR A 6 13.979 35.226 -49.267 1.00 18.70 H new ATOM 0 HH TYR A 6 14.612 38.281 -50.721 1.00 19.93 H new ATOM 54 N LEU A 7 10.263 32.544 -50.793 1.00 19.73 N ATOM 55 CA LEU A 7 11.271 31.615 -51.249 1.00 19.94 C ATOM 56 C LEU A 7 10.934 31.122 -52.667 1.00 20.11 C ATOM 57 O LEU A 7 11.857 31.030 -53.506 1.00 20.38 O ATOM 58 CB LEU A 7 11.522 30.494 -50.289 1.00 18.46 C ATOM 59 CG LEU A 7 11.547 30.978 -48.890 1.00 18.69 C ATOM 60 CD1 LEU A 7 11.030 29.910 -47.976 1.00 23.64 C ATOM 61 CD2 LEU A 7 12.903 31.346 -48.501 1.00 25.44 C ATOM 0 H LEU A 7 9.757 32.264 -50.157 1.00 19.73 H new ATOM 0 HA LEU A 7 12.113 32.094 -51.289 1.00 19.94 H new ATOM 0 HB2 LEU A 7 10.831 29.820 -50.388 1.00 18.46 H new ATOM 0 HB3 LEU A 7 12.367 30.067 -50.501 1.00 18.46 H new ATOM 0 HG LEU A 7 10.981 31.763 -48.822 1.00 18.69 H new ATOM 0 HD11 LEU A 7 11.048 30.231 -47.061 1.00 23.64 H new ATOM 0 HD12 LEU A 7 10.119 29.686 -48.222 1.00 23.64 H new ATOM 0 HD13 LEU A 7 11.588 29.120 -48.052 1.00 23.64 H new ATOM 0 HD21 LEU A 7 12.903 31.661 -47.583 1.00 25.44 H new ATOM 0 HD22 LEU A 7 13.483 30.572 -48.577 1.00 25.44 H new ATOM 0 HD23 LEU A 7 13.227 32.051 -49.084 1.00 25.44 H new ATOM 62 N ASP A 8 9.666 30.973 -53.007 1.00 19.54 N ATOM 63 CA ASP A 8 9.393 30.713 -54.441 1.00 20.85 C ATOM 64 C ASP A 8 9.794 31.848 -55.396 1.00 21.83 C ATOM 65 O ASP A 8 10.274 31.611 -56.509 1.00 21.77 O ATOM 66 CB ASP A 8 7.969 30.344 -54.636 1.00 21.13 C ATOM 67 CG ASP A 8 7.530 29.216 -53.691 1.00 26.63 C ATOM 68 OD1 ASP A 8 6.314 29.105 -53.426 1.00 28.91 O ATOM 69 OD2 ASP A 8 8.384 28.414 -53.216 1.00 28.87 O ATOM 0 H ASP A 8 8.986 31.012 -52.482 1.00 19.54 H new ATOM 0 HA ASP A 8 9.968 29.969 -54.680 1.00 20.85 H new ATOM 0 HB2 ASP A 8 7.411 31.124 -54.488 1.00 21.13 H new ATOM 0 HB3 ASP A 8 7.831 30.066 -55.555 1.00 21.13 H new ATOM 70 N LEU A 9 9.652 33.117 -54.998 1.00 23.49 N ATOM 71 CA LEU A 9 10.170 34.148 -55.916 1.00 23.02 C ATOM 72 C LEU A 9 11.705 34.026 -56.130 1.00 23.96 C ATOM 73 O LEU A 9 12.210 34.206 -57.285 1.00 25.27 O ATOM 74 CB LEU A 9 9.886 35.501 -55.358 1.00 23.09 C ATOM 75 CG LEU A 9 9.608 36.708 -56.261 1.00 26.32 C ATOM 76 CD1 LEU A 9 9.831 37.948 -55.451 1.00 28.22 C ATOM 77 CD2 LEU A 9 10.322 36.807 -57.583 1.00 22.68 C ATOM 0 H LEU A 9 9.292 33.390 -54.266 1.00 23.49 H new ATOM 0 HA LEU A 9 9.727 34.019 -56.769 1.00 23.02 H new ATOM 0 HB2 LEU A 9 9.119 35.407 -54.772 1.00 23.09 H new ATOM 0 HB3 LEU A 9 10.642 35.738 -54.799 1.00 23.09 H new ATOM 0 HG LEU A 9 8.690 36.587 -56.549 1.00 26.32 H new ATOM 0 HD11 LEU A 9 9.661 38.729 -56.001 1.00 28.22 H new ATOM 0 HD12 LEU A 9 9.228 37.951 -54.691 1.00 28.22 H new ATOM 0 HD13 LEU A 9 10.748 37.968 -55.136 1.00 28.22 H new ATOM 0 HD21 LEU A 9 10.047 37.617 -58.040 1.00 22.68 H new ATOM 0 HD22 LEU A 9 11.280 36.830 -57.433 1.00 22.68 H new ATOM 0 HD23 LEU A 9 10.100 36.037 -58.130 1.00 22.68 H new ATOM 78 N ALA A 10 12.456 33.759 -55.050 1.00 22.30 N ATOM 79 CA ALA A 10 13.916 33.685 -55.116 1.00 23.38 C ATOM 80 C ALA A 10 14.371 32.574 -56.095 1.00 24.90 C ATOM 81 O ALA A 10 15.268 32.786 -56.966 1.00 21.34 O ATOM 82 CB ALA A 10 14.494 33.400 -53.741 1.00 22.56 C ATOM 0 H ALA A 10 12.131 33.617 -54.266 1.00 22.30 H new ATOM 0 HA ALA A 10 14.240 34.542 -55.435 1.00 23.38 H new ATOM 0 HB1 ALA A 10 15.461 33.354 -53.800 1.00 22.56 H new ATOM 0 HB2 ALA A 10 14.241 34.110 -53.130 1.00 22.56 H new ATOM 0 HB3 ALA A 10 14.149 32.554 -53.414 1.00 22.56 H new ATOM 83 N LYS A 11 13.792 31.376 -55.849 1.00 27.32 N ATOM 84 CA LYS A 11 14.051 30.176 -56.618 1.00 29.71 C ATOM 85 C LYS A 11 13.663 30.528 -58.008 1.00 27.82 C ATOM 86 O LYS A 11 14.435 30.414 -58.872 1.00 27.55 O ATOM 87 CB LYS A 11 13.091 29.071 -56.236 1.00 30.01 C ATOM 88 CG LYS A 11 13.228 28.411 -54.906 1.00 34.08 C ATOM 89 CD LYS A 11 12.532 26.975 -54.966 1.00 36.06 C ATOM 90 CE LYS A 11 12.021 26.478 -53.577 1.00 45.24 C ATOM 91 NZ LYS A 11 10.551 26.845 -53.476 1.00 50.23 N ATOM 0 H LYS A 11 13.227 31.255 -55.212 1.00 27.32 H new ATOM 0 HA LYS A 11 14.969 29.890 -56.488 1.00 29.71 H new ATOM 0 HB2 LYS A 11 12.193 29.434 -56.290 1.00 30.01 H new ATOM 0 HB3 LYS A 11 13.159 28.379 -56.913 1.00 30.01 H new ATOM 0 HG2 LYS A 11 14.165 28.320 -54.672 1.00 34.08 H new ATOM 0 HG3 LYS A 11 12.815 28.955 -54.217 1.00 34.08 H new ATOM 0 HD2 LYS A 11 11.786 27.010 -55.585 1.00 36.06 H new ATOM 0 HD3 LYS A 11 13.164 26.331 -55.320 1.00 36.06 H new ATOM 0 HE2 LYS A 11 12.140 25.519 -53.492 1.00 45.24 H new ATOM 0 HE3 LYS A 11 12.526 26.891 -52.859 1.00 45.24 H new ATOM 0 HZ1 LYS A 11 10.117 26.212 -53.025 1.00 50.23 H new ATOM 0 HZ2 LYS A 11 10.467 27.622 -53.050 1.00 50.23 H new ATOM 0 HZ3 LYS A 11 10.206 26.916 -54.293 1.00 50.23 H new ATOM 92 N LYS A 12 12.454 31.023 -58.216 1.00 27.73 N ATOM 93 CA LYS A 12 12.073 31.383 -59.585 1.00 28.33 C ATOM 94 C LYS A 12 13.079 32.269 -60.339 1.00 28.09 C ATOM 95 O LYS A 12 13.325 32.023 -61.498 1.00 27.68 O ATOM 96 CB LYS A 12 10.727 32.056 -59.589 1.00 29.29 C ATOM 97 CG LYS A 12 10.299 32.594 -60.954 1.00 31.26 C ATOM 98 CD LYS A 12 9.211 31.683 -61.321 1.00 36.65 C ATOM 99 CE LYS A 12 8.206 32.410 -62.075 1.00 42.57 C ATOM 100 NZ LYS A 12 8.521 32.326 -63.544 1.00 47.36 N ATOM 0 H LYS A 12 11.857 31.157 -57.612 1.00 27.73 H new ATOM 0 HA LYS A 12 12.052 30.539 -60.063 1.00 28.33 H new ATOM 0 HB2 LYS A 12 10.060 31.424 -59.278 1.00 29.29 H new ATOM 0 HB3 LYS A 12 10.741 32.789 -58.954 1.00 29.29 H new ATOM 0 HG2 LYS A 12 9.998 33.515 -60.902 1.00 31.26 H new ATOM 0 HG3 LYS A 12 11.025 32.569 -61.597 1.00 31.26 H new ATOM 0 HD2 LYS A 12 9.557 30.947 -61.850 1.00 36.65 H new ATOM 0 HD3 LYS A 12 8.815 31.298 -60.523 1.00 36.65 H new ATOM 0 HE2 LYS A 12 7.327 32.039 -61.901 1.00 42.57 H new ATOM 0 HE3 LYS A 12 8.184 33.337 -61.792 1.00 42.57 H new ATOM 0 HZ1 LYS A 12 8.629 33.146 -63.872 1.00 47.36 H new ATOM 0 HZ2 LYS A 12 9.270 31.859 -63.661 1.00 47.36 H new ATOM 0 HZ3 LYS A 12 7.851 31.923 -63.969 1.00 47.36 H new ATOM 101 N VAL A 13 13.641 33.302 -59.689 1.00 28.54 N ATOM 102 CA VAL A 13 14.622 34.177 -60.327 1.00 30.27 C ATOM 103 C VAL A 13 15.964 33.472 -60.507 1.00 32.05 C ATOM 104 O VAL A 13 16.747 33.806 -61.408 1.00 31.15 O ATOM 105 CB VAL A 13 14.867 35.426 -59.427 1.00 31.09 C ATOM 106 CG1 VAL A 13 16.109 36.191 -59.770 1.00 28.45 C ATOM 107 CG2 VAL A 13 13.774 36.331 -59.581 1.00 34.00 C ATOM 0 H VAL A 13 13.462 33.508 -58.874 1.00 28.54 H new ATOM 0 HA VAL A 13 14.269 34.428 -61.195 1.00 30.27 H new ATOM 0 HB VAL A 13 14.960 35.087 -58.523 1.00 31.09 H new ATOM 0 HG11 VAL A 13 16.197 36.950 -59.173 1.00 28.45 H new ATOM 0 HG12 VAL A 13 16.882 35.613 -59.674 1.00 28.45 H new ATOM 0 HG13 VAL A 13 16.053 36.505 -60.686 1.00 28.45 H new ATOM 0 HG21 VAL A 13 13.919 37.112 -59.024 1.00 34.00 H new ATOM 0 HG22 VAL A 13 13.709 36.605 -60.509 1.00 34.00 H new ATOM 0 HG23 VAL A 13 12.951 35.893 -59.315 1.00 34.00 H new ATOM 108 N LEU A 14 16.229 32.504 -59.620 1.00 34.20 N ATOM 109 CA LEU A 14 17.482 31.775 -59.651 1.00 37.37 C ATOM 110 C LEU A 14 17.527 30.921 -60.875 1.00 39.39 C ATOM 111 O LEU A 14 18.543 30.885 -61.578 1.00 40.93 O ATOM 112 CB LEU A 14 17.672 30.900 -58.423 1.00 36.56 C ATOM 113 CG LEU A 14 18.573 31.648 -57.481 1.00 37.52 C ATOM 114 CD1 LEU A 14 18.749 30.879 -56.197 1.00 37.64 C ATOM 115 CD2 LEU A 14 19.862 31.885 -58.170 1.00 37.53 C ATOM 0 H LEU A 14 15.690 32.261 -58.996 1.00 34.20 H new ATOM 0 HA LEU A 14 18.200 32.428 -59.661 1.00 37.37 H new ATOM 0 HB2 LEU A 14 16.819 30.710 -58.003 1.00 36.56 H new ATOM 0 HB3 LEU A 14 18.064 30.047 -58.667 1.00 36.56 H new ATOM 0 HG LEU A 14 18.182 32.502 -57.239 1.00 37.52 H new ATOM 0 HD11 LEU A 14 19.332 31.374 -55.600 1.00 37.64 H new ATOM 0 HD12 LEU A 14 17.885 30.754 -55.774 1.00 37.64 H new ATOM 0 HD13 LEU A 14 19.143 30.014 -56.389 1.00 37.64 H new ATOM 0 HD21 LEU A 14 20.461 32.368 -57.579 1.00 37.53 H new ATOM 0 HD22 LEU A 14 20.262 31.035 -58.411 1.00 37.53 H new ATOM 0 HD23 LEU A 14 19.709 32.408 -58.972 1.00 37.53 H new ATOM 116 N ASP A 15 16.448 30.238 -61.184 1.00 40.91 N ATOM 117 CA ASP A 15 16.658 29.413 -62.302 1.00 44.33 C ATOM 118 C ASP A 15 15.924 29.860 -63.504 1.00 45.32 C ATOM 119 O ASP A 15 16.051 29.213 -64.544 1.00 45.87 O ATOM 120 CB ASP A 15 16.434 27.971 -61.952 1.00 45.10 C ATOM 121 CG ASP A 15 15.192 27.782 -61.245 1.00 48.68 C ATOM 122 OD1 ASP A 15 14.181 28.322 -61.793 1.00 47.09 O ATOM 123 OD2 ASP A 15 15.268 27.129 -60.153 1.00 50.44 O ATOM 0 H ASP A 15 15.677 30.240 -60.803 1.00 40.91 H new ATOM 0 HA ASP A 15 17.591 29.497 -62.555 1.00 44.33 H new ATOM 0 HB2 ASP A 15 16.430 27.438 -62.762 1.00 45.10 H new ATOM 0 HB3 ASP A 15 17.170 27.652 -61.406 1.00 45.10 H new ATOM 124 N GLU A 16 15.212 30.990 -63.407 1.00 46.86 N ATOM 125 CA GLU A 16 14.655 31.619 -64.638 1.00 47.23 C ATOM 126 C GLU A 16 14.938 33.064 -65.047 1.00 47.32 C ATOM 127 O GLU A 16 14.552 33.426 -66.129 1.00 48.10 O ATOM 128 CB GLU A 16 13.189 31.450 -64.657 1.00 47.35 C ATOM 129 CG GLU A 16 12.753 30.048 -64.450 1.00 51.85 C ATOM 130 CD GLU A 16 11.274 29.918 -64.721 1.00 59.36 C ATOM 131 OE1 GLU A 16 10.725 28.786 -64.600 1.00 65.58 O ATOM 132 OE2 GLU A 16 10.669 30.965 -65.065 1.00 58.13 O ATOM 0 H GLU A 16 15.040 31.402 -62.672 1.00 46.86 H new ATOM 0 HA GLU A 16 15.176 31.128 -65.292 1.00 47.23 H new ATOM 0 HB2 GLU A 16 12.797 32.008 -63.967 1.00 47.35 H new ATOM 0 HB3 GLU A 16 12.845 31.766 -65.507 1.00 47.35 H new ATOM 0 HG2 GLU A 16 13.250 29.457 -65.038 1.00 51.85 H new ATOM 0 HG3 GLU A 16 12.948 29.772 -63.541 1.00 51.85 H new ATOM 133 N GLY A 17 15.575 33.900 -64.234 1.00 47.06 N ATOM 134 CA GLY A 17 15.755 35.272 -64.627 1.00 47.66 C ATOM 135 C GLY A 17 16.801 35.412 -65.699 1.00 49.13 C ATOM 136 O GLY A 17 17.626 34.567 -65.833 1.00 48.05 O ATOM 0 H GLY A 17 15.902 33.690 -63.467 1.00 47.06 H new ATOM 0 HA2 GLY A 17 14.913 35.630 -64.948 1.00 47.66 H new ATOM 0 HA3 GLY A 17 16.011 35.799 -63.854 1.00 47.66 H new ATOM 137 N HIS A 18 16.821 36.504 -66.436 1.00 51.45 N ATOM 138 CA HIS A 18 17.904 36.662 -67.376 1.00 55.19 C ATOM 139 C HIS A 18 18.853 37.635 -66.871 1.00 55.81 C ATOM 140 O HIS A 18 18.490 38.506 -66.093 1.00 55.32 O ATOM 141 CB HIS A 18 17.415 37.181 -68.684 1.00 56.64 C ATOM 142 CG HIS A 18 16.007 36.813 -68.947 1.00 61.84 C ATOM 143 ND1 HIS A 18 14.949 37.626 -68.573 1.00 64.08 N ATOM 144 CD2 HIS A 18 15.471 35.691 -69.496 1.00 66.29 C ATOM 145 CE1 HIS A 18 13.820 37.028 -68.913 1.00 67.34 C ATOM 146 NE2 HIS A 18 14.107 35.859 -69.480 1.00 69.11 N ATOM 0 H HIS A 18 16.243 37.141 -66.411 1.00 51.45 H new ATOM 0 HA HIS A 18 18.311 35.789 -67.493 1.00 55.19 H new ATOM 0 HB2 HIS A 18 17.502 38.147 -68.699 1.00 56.64 H new ATOM 0 HB3 HIS A 18 17.975 36.835 -69.396 1.00 56.64 H new ATOM 0 HD2 HIS A 18 15.936 34.954 -69.819 1.00 66.29 H new ATOM 0 HE1 HIS A 18 12.965 37.369 -68.778 1.00 67.34 H new ATOM 0 HE2 HIS A 18 13.531 35.299 -69.787 1.00 69.11 H new ATOM 147 N PHE A 19 20.076 37.472 -67.334 1.00 58.07 N ATOM 148 CA PHE A 19 21.105 38.402 -67.001 1.00 61.78 C ATOM 149 C PHE A 19 20.810 39.728 -67.686 1.00 64.49 C ATOM 150 O PHE A 19 20.593 39.776 -68.885 1.00 64.42 O ATOM 151 CB PHE A 19 22.479 37.929 -67.417 1.00 61.12 C ATOM 152 CG PHE A 19 23.541 38.812 -66.900 1.00 61.61 C ATOM 153 CD1 PHE A 19 23.922 39.936 -67.610 1.00 61.97 C ATOM 154 CD2 PHE A 19 24.083 38.593 -65.641 1.00 61.45 C ATOM 155 CE1 PHE A 19 24.859 40.804 -67.123 1.00 61.20 C ATOM 156 CE2 PHE A 19 25.017 39.442 -65.141 1.00 60.70 C ATOM 157 CZ PHE A 19 25.421 40.559 -65.897 1.00 62.31 C ATOM 0 H PHE A 19 20.323 36.825 -67.843 1.00 58.07 H new ATOM 0 HA PHE A 19 21.111 38.496 -66.036 1.00 61.78 H new ATOM 0 HB2 PHE A 19 22.622 37.026 -67.093 1.00 61.12 H new ATOM 0 HB3 PHE A 19 22.530 37.894 -68.385 1.00 61.12 H new ATOM 0 HD1 PHE A 19 23.532 40.105 -68.437 1.00 61.97 H new ATOM 0 HD2 PHE A 19 23.805 37.862 -65.138 1.00 61.45 H new ATOM 0 HE1 PHE A 19 25.112 41.551 -67.617 1.00 61.20 H new ATOM 0 HE2 PHE A 19 25.388 39.286 -64.303 1.00 60.70 H new ATOM 0 HZ PHE A 19 26.072 41.133 -65.563 1.00 62.31 H new ATOM 158 N LYS A 20 20.796 40.806 -66.915 1.00 68.11 N ATOM 159 CA LYS A 20 20.434 42.114 -67.435 1.00 71.65 C ATOM 160 C LYS A 20 21.419 43.023 -66.741 1.00 75.26 C ATOM 161 O LYS A 20 21.415 43.094 -65.498 1.00 75.34 O ATOM 162 CB LYS A 20 18.997 42.441 -67.005 1.00 71.41 C ATOM 163 CG LYS A 20 18.186 43.303 -67.959 1.00 71.62 C ATOM 164 CD LYS A 20 16.824 43.680 -67.371 1.00 70.53 C ATOM 165 CE LYS A 20 16.192 44.841 -68.145 1.00 66.70 C ATOM 166 NZ LYS A 20 15.180 45.632 -67.365 1.00 64.50 N ATOM 0 H LYS A 20 20.995 40.800 -66.078 1.00 68.11 H new ATOM 0 HA LYS A 20 20.464 42.189 -68.402 1.00 71.65 H new ATOM 0 HB2 LYS A 20 18.522 41.606 -66.871 1.00 71.41 H new ATOM 0 HB3 LYS A 20 19.031 42.889 -66.145 1.00 71.41 H new ATOM 0 HG2 LYS A 20 18.683 44.110 -68.167 1.00 71.62 H new ATOM 0 HG3 LYS A 20 18.057 42.827 -68.794 1.00 71.62 H new ATOM 0 HD2 LYS A 20 16.233 42.911 -67.396 1.00 70.53 H new ATOM 0 HD3 LYS A 20 16.928 43.927 -66.439 1.00 70.53 H new ATOM 0 HE2 LYS A 20 16.896 45.440 -68.440 1.00 66.70 H new ATOM 0 HE3 LYS A 20 15.766 44.489 -68.942 1.00 66.70 H new ATOM 0 HZ1 LYS A 20 14.743 46.179 -67.914 1.00 64.50 H new ATOM 0 HZ2 LYS A 20 14.602 45.076 -66.979 1.00 64.50 H new ATOM 0 HZ3 LYS A 20 15.595 46.110 -66.739 1.00 64.50 H new ATOM 167 N PRO A 21 22.317 43.684 -67.500 1.00 78.53 N ATOM 168 CA PRO A 21 23.334 44.418 -66.723 1.00 81.58 C ATOM 169 C PRO A 21 22.944 45.898 -66.545 1.00 83.10 C ATOM 170 O PRO A 21 23.607 46.776 -67.130 1.00 84.07 O ATOM 171 CB PRO A 21 24.608 44.247 -67.565 1.00 80.78 C ATOM 172 CG PRO A 21 24.074 43.880 -68.993 1.00 80.02 C ATOM 173 CD PRO A 21 22.544 43.835 -68.941 1.00 78.56 C ATOM 0 HA PRO A 21 23.441 44.086 -65.818 1.00 81.58 H new ATOM 0 HB2 PRO A 21 25.135 45.061 -67.581 1.00 80.78 H new ATOM 0 HB3 PRO A 21 25.178 43.548 -67.209 1.00 80.78 H new ATOM 0 HG2 PRO A 21 24.370 44.536 -69.643 1.00 80.02 H new ATOM 0 HG3 PRO A 21 24.427 43.022 -69.275 1.00 80.02 H new ATOM 0 HD2 PRO A 21 22.141 44.644 -69.293 1.00 78.56 H new ATOM 0 HD3 PRO A 21 22.181 43.093 -69.449 1.00 78.56 H new ATOM 174 N ASP A 22 21.887 46.157 -65.739 1.00 84.68 N ATOM 175 CA ASP A 22 21.266 47.527 -65.566 1.00 85.49 C ATOM 176 C ASP A 22 21.663 48.440 -64.335 1.00 85.80 C ATOM 177 O ASP A 22 22.008 47.951 -63.224 1.00 85.14 O ATOM 178 CB ASP A 22 19.710 47.495 -65.784 1.00 86.91 C ATOM 179 CG ASP A 22 18.956 46.514 -64.821 1.00 90.67 C ATOM 180 OD1 ASP A 22 19.522 46.146 -63.755 1.00 95.87 O ATOM 181 OD2 ASP A 22 17.786 46.110 -65.114 1.00 93.56 O ATOM 0 H ASP A 22 21.500 45.548 -65.271 1.00 84.68 H new ATOM 0 HA ASP A 22 21.715 48.003 -66.282 1.00 85.49 H new ATOM 0 HB2 ASP A 22 19.356 48.390 -65.662 1.00 86.91 H new ATOM 0 HB3 ASP A 22 19.526 47.240 -66.701 1.00 86.91 H new ATOM 182 N ARG A 23 21.591 49.760 -64.590 0.50 85.84 N ATOM 183 CA ARG A 23 21.975 50.862 -63.670 0.50 86.01 C ATOM 184 C AARG A 23 23.434 50.832 -63.197 0.50 86.49 C ATOM 185 O AARG A 23 23.960 51.825 -62.687 0.50 86.26 O ATOM 186 CB ARG A 23 21.025 50.969 -62.471 0.50 85.67 C ATOM 187 CG ARG A 23 20.821 52.386 -62.005 0.50 84.54 C ATOM 188 CD AARG A 23 19.354 52.737 -61.828 0.50 82.72 C ATOM 189 CD BARG A 23 20.468 53.280 -63.172 0.50 84.92 C ATOM 190 NE AARG A 23 18.896 52.493 -60.465 0.50 82.20 N ATOM 191 NE BARG A 23 19.763 54.469 -62.699 0.50 85.34 N ATOM 192 CZ AARG A 23 19.649 52.731 -59.370 0.50 82.26 C ATOM 193 CZ BARG A 23 20.265 55.704 -62.683 0.50 85.43 C ATOM 194 NH1AARG A 23 20.884 53.340 -59.475 0.50 82.46 N ATOM 195 NH1BARG A 23 19.527 56.699 -62.208 0.50 84.90 N ATOM 196 NH2AARG A 23 19.188 52.388 -58.163 0.50 80.64 N ATOM 197 NH2BARG A 23 21.488 55.951 -63.140 0.50 85.46 N ATOM 0 H ARG A 23 21.302 50.055 -65.344 0.50 85.84 H new ATOM 0 HA ARG A 23 21.890 51.661 -64.214 0.50 86.01 H new ATOM 0 HB2 ARG A 23 20.167 50.586 -62.710 0.50 85.67 H new ATOM 0 HB3 ARG A 23 21.377 50.440 -61.738 0.50 85.67 H new ATOM 0 HG2AARG A 23 21.285 52.516 -61.163 0.50 84.54 H new ATOM 0 HG2BARG A 23 20.114 52.416 -61.342 0.50 84.54 H new ATOM 0 HG3AARG A 23 21.221 52.994 -62.646 0.50 84.54 H new ATOM 0 HG3BARG A 23 21.627 52.710 -61.574 0.50 84.54 H new ATOM 0 HD2AARG A 23 19.216 53.670 -62.053 0.50 84.92 H new ATOM 0 HD2BARG A 23 21.274 53.540 -63.645 0.50 84.92 H new ATOM 0 HD3AARG A 23 18.820 52.214 -62.447 0.50 84.92 H new ATOM 0 HD3BARG A 23 19.913 52.796 -63.803 0.50 84.92 H new ATOM 0 HE AARG A 23 18.103 52.180 -60.353 0.50 85.34 H new ATOM 0 HE BARG A 23 18.961 54.364 -62.408 0.50 85.34 H new ATOM 0 HH11AARG A 23 21.184 53.574 -60.246 0.50 84.90 H new ATOM 0 HH11BARG A 23 18.734 56.544 -61.915 0.50 84.90 H new ATOM 0 HH12AARG A 23 21.353 53.486 -58.769 0.50 84.90 H new ATOM 0 HH12BARG A 23 19.842 57.499 -62.193 0.50 84.90 H new ATOM 0 HH21AARG A 23 18.415 52.018 -58.087 0.50 85.46 H new ATOM 0 HH21BARG A 23 21.968 55.309 -63.452 0.50 85.46 H new ATOM 0 HH22AARG A 23 19.664 52.538 -57.462 0.50 85.46 H new ATOM 0 HH22BARG A 23 21.799 56.752 -63.124 0.50 85.46 H new ATOM 198 N THR A 24 24.074 49.680 -63.380 1.00 87.34 N ATOM 199 CA THR A 24 25.436 49.427 -62.891 1.00 87.84 C ATOM 200 C THR A 24 26.337 48.455 -63.740 1.00 88.02 C ATOM 201 O THR A 24 26.037 48.054 -64.901 1.00 88.11 O ATOM 202 CB THR A 24 25.458 48.941 -61.380 1.00 87.80 C ATOM 203 OG1 THR A 24 25.015 47.574 -61.289 1.00 87.82 O ATOM 204 CG2 THR A 24 24.629 49.849 -60.463 1.00 87.69 C ATOM 0 H ATHR A 24 23.728 49.012 -63.797 0.50 87.34 H new ATOM 0 HA THR A 24 25.835 50.306 -62.984 1.00 87.84 H new ATOM 0 HB THR A 24 26.376 48.996 -61.070 1.00 87.80 H new ATOM 0 HG1 THR A 24 24.770 47.410 -60.502 1.00 87.82 H new ATOM 0 HG21 THR A 24 24.671 49.515 -59.553 1.00 87.69 H new ATOM 0 HG22 THR A 24 24.985 50.751 -60.493 1.00 87.69 H new ATOM 0 HG23 THR A 24 23.706 49.856 -60.762 1.00 87.69 H new ATOM 205 N HIS A 25 27.416 48.057 -63.062 1.00 87.44 N ATOM 206 CA HIS A 25 28.658 47.521 -63.620 1.00 86.52 C ATOM 207 C HIS A 25 28.755 46.145 -62.975 1.00 84.31 C ATOM 208 O HIS A 25 29.774 45.423 -63.078 1.00 84.75 O ATOM 209 CB HIS A 25 29.787 48.456 -63.147 1.00 87.47 C ATOM 210 CG HIS A 25 29.265 49.772 -62.629 1.00 90.94 C ATOM 211 ND1 HIS A 25 28.790 50.866 -63.284 1.00 93.54 N flip ATOM 212 CD2 HIS A 25 29.080 50.027 -61.282 1.00 93.66 C flip ATOM 213 CE1 HIS A 25 28.367 51.764 -62.328 1.00 93.89 C flip ATOM 214 NE2 HIS A 25 28.563 51.237 -61.130 1.00 94.06 N flip ATOM 0 H HIS A 25 27.442 48.097 -62.203 1.00 87.44 H new ATOM 0 HA HIS A 25 28.703 47.460 -64.587 1.00 86.52 H new ATOM 0 HB2 HIS A 25 30.297 48.016 -62.449 1.00 87.47 H new ATOM 0 HB3 HIS A 25 30.397 48.620 -63.883 1.00 87.47 H new ATOM 0 HD1 HIS A 25 28.759 50.977 -64.136 1.00 93.54 H new ATOM 0 HD2 HIS A 25 29.286 49.440 -60.591 1.00 93.66 H new ATOM 0 HE1 HIS A 25 28.003 52.603 -62.497 1.00 93.89 H new ATOM 215 N THR A 26 27.648 45.813 -62.309 1.00 80.81 N ATOM 216 CA THR A 26 27.510 44.620 -61.501 1.00 77.26 C ATOM 217 C THR A 26 26.825 43.507 -62.323 1.00 73.87 C ATOM 218 O THR A 26 27.450 42.466 -62.589 1.00 73.55 O ATOM 219 CB THR A 26 26.714 44.949 -60.188 1.00 77.69 C ATOM 220 OG1 THR A 26 27.343 46.045 -59.492 1.00 78.55 O ATOM 221 CG2 THR A 26 26.624 43.738 -59.283 1.00 77.04 C ATOM 0 H THR A 26 26.938 46.297 -62.321 1.00 80.81 H new ATOM 0 HA THR A 26 28.387 44.299 -61.240 1.00 77.26 H new ATOM 0 HB THR A 26 25.812 45.204 -60.437 1.00 77.69 H new ATOM 0 HG1 THR A 26 26.765 46.622 -59.296 1.00 78.55 H new ATOM 0 HG21 THR A 26 26.129 43.969 -58.482 1.00 77.04 H new ATOM 0 HG22 THR A 26 26.168 43.019 -59.748 1.00 77.04 H new ATOM 0 HG23 THR A 26 27.517 43.449 -59.039 1.00 77.04 H new ATOM 222 N GLY A 27 25.569 43.761 -62.738 1.00 69.25 N ATOM 223 CA GLY A 27 24.661 42.727 -63.252 1.00 62.24 C ATOM 224 C GLY A 27 23.554 42.274 -62.303 1.00 56.99 C ATOM 225 O GLY A 27 23.678 42.383 -61.080 1.00 56.10 O ATOM 0 H GLY A 27 25.222 44.548 -62.727 1.00 69.25 H new ATOM 0 HA2 GLY A 27 24.249 43.059 -64.065 1.00 62.24 H new ATOM 0 HA3 GLY A 27 25.189 41.951 -63.498 1.00 62.24 H new ATOM 226 N THR A 28 22.477 41.745 -62.899 1.00 52.90 N ATOM 227 CA THR A 28 21.324 41.128 -62.205 1.00 47.85 C ATOM 228 C THR A 28 20.690 39.977 -62.975 1.00 44.66 C ATOM 229 O THR A 28 20.818 39.859 -64.171 1.00 43.43 O ATOM 230 CB THR A 28 20.154 42.144 -61.977 1.00 48.65 C ATOM 231 OG1 THR A 28 19.575 42.520 -63.248 1.00 49.01 O ATOM 232 CG2 THR A 28 20.597 43.395 -61.219 1.00 45.64 C ATOM 0 H THR A 28 22.391 41.733 -63.755 1.00 52.90 H new ATOM 0 HA THR A 28 21.711 40.817 -61.372 1.00 47.85 H new ATOM 0 HB THR A 28 19.492 41.697 -61.427 1.00 48.65 H new ATOM 0 HG1 THR A 28 20.187 42.645 -63.809 1.00 49.01 H new ATOM 0 HG21 THR A 28 19.839 43.989 -61.104 1.00 45.64 H new ATOM 0 HG22 THR A 28 20.943 43.141 -60.349 1.00 45.64 H new ATOM 0 HG23 THR A 28 21.291 43.850 -61.722 1.00 45.64 H new ATOM 233 N TYR A 29 19.985 39.135 -62.250 1.00 42.20 N ATOM 234 CA TYR A 29 18.974 38.251 -62.821 1.00 40.75 C ATOM 235 C TYR A 29 17.637 38.870 -62.600 1.00 37.18 C ATOM 236 O TYR A 29 17.379 39.504 -61.578 1.00 36.21 O ATOM 237 CB TYR A 29 19.009 36.841 -62.217 1.00 42.94 C ATOM 238 CG TYR A 29 20.327 36.249 -62.535 1.00 46.47 C ATOM 239 CD1 TYR A 29 20.680 36.042 -63.852 1.00 52.66 C ATOM 240 CD2 TYR A 29 21.261 36.007 -61.559 1.00 49.08 C ATOM 241 CE1 TYR A 29 21.925 35.561 -64.211 1.00 52.79 C ATOM 242 CE2 TYR A 29 22.501 35.533 -61.890 1.00 52.86 C ATOM 243 CZ TYR A 29 22.822 35.309 -63.236 1.00 51.39 C ATOM 244 OH TYR A 29 24.042 34.832 -63.625 1.00 50.28 O ATOM 0 H TYR A 29 20.076 39.054 -61.399 1.00 42.20 H new ATOM 0 HA TYR A 29 19.158 38.147 -63.768 1.00 40.75 H new ATOM 0 HB2 TYR A 29 18.875 36.878 -61.257 1.00 42.94 H new ATOM 0 HB3 TYR A 29 18.294 36.296 -62.582 1.00 42.94 H new ATOM 0 HD1 TYR A 29 20.061 36.232 -64.519 1.00 52.66 H new ATOM 0 HD2 TYR A 29 21.050 36.166 -60.667 1.00 49.08 H new ATOM 0 HE1 TYR A 29 22.139 35.415 -65.104 1.00 52.79 H new ATOM 0 HE2 TYR A 29 23.128 35.360 -61.225 1.00 52.86 H new ATOM 0 HH TYR A 29 24.524 34.710 -62.948 1.00 50.28 H new ATOM 245 N SER A 30 16.784 38.680 -63.579 1.00 33.61 N ATOM 246 CA SER A 30 15.597 39.501 -63.649 1.00 30.98 C ATOM 247 C SER A 30 14.409 38.771 -64.208 1.00 28.80 C ATOM 248 O SER A 30 14.538 38.038 -65.158 1.00 30.68 O ATOM 249 CB SER A 30 15.875 40.690 -64.517 1.00 29.49 C ATOM 250 OG SER A 30 14.787 41.517 -64.333 1.00 33.72 O ATOM 0 H SER A 30 16.868 38.094 -64.203 1.00 33.61 H new ATOM 0 HA SER A 30 15.380 39.763 -62.741 1.00 30.98 H new ATOM 0 HB2 SER A 30 16.700 41.130 -64.259 1.00 29.49 H new ATOM 0 HB3 SER A 30 15.969 40.433 -65.448 1.00 29.49 H new ATOM 0 HG SER A 30 15.042 42.317 -64.319 1.00 33.72 H new ATOM 251 N ILE A 31 13.250 38.930 -63.598 1.00 26.03 N ATOM 252 CA ILE A 31 12.008 38.542 -64.212 1.00 22.76 C ATOM 253 C ILE A 31 11.106 39.769 -64.258 1.00 21.45 C ATOM 254 O ILE A 31 11.257 40.715 -63.487 1.00 18.22 O ATOM 255 CB ILE A 31 11.298 37.456 -63.392 1.00 22.67 C ATOM 256 CG1 ILE A 31 10.854 38.033 -62.048 1.00 24.38 C ATOM 257 CG2 ILE A 31 12.165 36.152 -63.269 1.00 19.73 C ATOM 258 CD1 ILE A 31 9.818 37.110 -61.249 1.00 25.53 C ATOM 0 H ILE A 31 13.165 39.268 -62.812 1.00 26.03 H new ATOM 0 HA ILE A 31 12.190 38.192 -65.098 1.00 22.76 H new ATOM 0 HB ILE A 31 10.497 37.174 -63.860 1.00 22.67 H new ATOM 0 HG12 ILE A 31 11.637 38.177 -61.494 1.00 24.38 H new ATOM 0 HG13 ILE A 31 10.449 38.902 -62.198 1.00 24.38 H new ATOM 0 HG21 ILE A 31 11.684 35.492 -62.746 1.00 19.73 H new ATOM 0 HG22 ILE A 31 12.342 35.796 -64.154 1.00 19.73 H new ATOM 0 HG23 ILE A 31 13.005 36.362 -62.831 1.00 19.73 H new ATOM 0 HD11 ILE A 31 9.583 37.538 -60.411 1.00 25.53 H new ATOM 0 HD12 ILE A 31 9.018 36.984 -61.783 1.00 25.53 H new ATOM 0 HD13 ILE A 31 10.225 36.248 -61.068 1.00 25.53 H new ATOM 259 N PHE A 32 10.117 39.745 -65.154 1.00 20.95 N ATOM 260 CA PHE A 32 9.152 40.845 -65.210 1.00 18.63 C ATOM 261 C PHE A 32 7.723 40.343 -64.918 1.00 18.48 C ATOM 262 O PHE A 32 7.207 39.440 -65.630 1.00 16.44 O ATOM 263 CB PHE A 32 9.211 41.512 -66.591 1.00 18.34 C ATOM 264 CG PHE A 32 8.349 42.753 -66.702 1.00 21.25 C ATOM 265 CD1 PHE A 32 7.407 42.870 -67.727 1.00 19.12 C ATOM 266 CD2 PHE A 32 8.484 43.828 -65.760 1.00 20.73 C ATOM 267 CE1 PHE A 32 6.623 44.003 -67.819 1.00 22.31 C ATOM 268 CE2 PHE A 32 7.662 44.981 -65.835 1.00 18.47 C ATOM 269 CZ PHE A 32 6.706 45.066 -66.821 1.00 19.79 C ATOM 0 H PHE A 32 9.989 39.116 -65.726 1.00 20.95 H new ATOM 0 HA PHE A 32 9.384 41.495 -64.529 1.00 18.63 H new ATOM 0 HB2 PHE A 32 10.131 41.747 -66.789 1.00 18.34 H new ATOM 0 HB3 PHE A 32 8.931 40.872 -67.264 1.00 18.34 H new ATOM 0 HD1 PHE A 32 7.308 42.185 -68.348 1.00 19.12 H new ATOM 0 HD2 PHE A 32 9.123 43.767 -65.087 1.00 20.73 H new ATOM 0 HE1 PHE A 32 6.031 44.091 -68.530 1.00 22.31 H new ATOM 0 HE2 PHE A 32 7.768 45.673 -65.223 1.00 18.47 H new ATOM 0 HZ PHE A 32 6.122 45.789 -66.851 1.00 19.79 H new ATOM 270 N GLY A 33 7.049 40.920 -63.911 1.00 17.07 N ATOM 271 CA GLY A 33 5.665 40.569 -63.717 1.00 14.56 C ATOM 272 C GLY A 33 5.550 39.336 -62.865 1.00 15.63 C ATOM 273 O GLY A 33 5.832 38.253 -63.328 1.00 15.08 O ATOM 0 H GLY A 33 7.372 41.493 -63.357 1.00 17.07 H new ATOM 0 HA2 GLY A 33 5.195 41.305 -63.295 1.00 14.56 H new ATOM 0 HA3 GLY A 33 5.241 40.416 -64.576 1.00 14.56 H new ATOM 274 N HIS A 34 5.217 39.511 -61.572 1.00 16.15 N ATOM 275 CA HIS A 34 5.079 38.429 -60.672 1.00 16.49 C ATOM 276 C HIS A 34 4.026 38.876 -59.667 1.00 17.06 C ATOM 277 O HIS A 34 3.865 40.078 -59.470 1.00 18.71 O ATOM 278 CB HIS A 34 6.442 38.109 -60.017 1.00 15.71 C ATOM 279 CG HIS A 34 6.421 36.866 -59.164 1.00 17.11 C ATOM 280 ND1 HIS A 34 6.473 35.595 -59.689 1.00 16.82 N ATOM 281 CD2 HIS A 34 6.356 36.701 -57.820 1.00 20.67 C ATOM 282 CE1 HIS A 34 6.416 34.705 -58.721 1.00 19.42 C ATOM 283 NE2 HIS A 34 6.314 35.346 -57.571 1.00 22.21 N ATOM 0 H HIS A 34 5.070 40.281 -61.219 1.00 16.15 H new ATOM 0 HA HIS A 34 4.801 37.606 -61.104 1.00 16.49 H new ATOM 0 HB2 HIS A 34 7.110 38.005 -60.712 1.00 15.71 H new ATOM 0 HB3 HIS A 34 6.716 38.863 -59.471 1.00 15.71 H new ATOM 0 HD2 HIS A 34 6.342 37.378 -57.183 1.00 20.67 H new ATOM 0 HE1 HIS A 34 6.443 33.782 -58.829 1.00 19.42 H new ATOM 0 HE2 HIS A 34 6.235 34.980 -56.797 1.00 22.21 H new ATOM 284 N GLN A 35 3.403 37.963 -58.942 1.00 16.73 N ATOM 285 CA GLN A 35 2.410 38.372 -57.945 1.00 17.83 C ATOM 286 C GLN A 35 2.361 37.353 -56.817 1.00 18.99 C ATOM 287 O GLN A 35 2.433 36.156 -57.087 1.00 20.52 O ATOM 288 CB GLN A 35 1.028 38.482 -58.627 1.00 17.25 C ATOM 289 CG GLN A 35 -0.085 38.899 -57.715 1.00 16.04 C ATOM 290 CD GLN A 35 -1.404 39.127 -58.472 1.00 21.06 C ATOM 291 OE1 GLN A 35 -1.763 40.271 -58.886 1.00 23.70 O ATOM 292 NE2 GLN A 35 -2.161 38.040 -58.639 1.00 18.26 N ATOM 0 H GLN A 35 3.532 37.115 -59.004 1.00 16.73 H new ATOM 0 HA GLN A 35 2.654 39.233 -57.572 1.00 17.83 H new ATOM 0 HB2 GLN A 35 1.090 39.119 -59.356 1.00 17.25 H new ATOM 0 HB3 GLN A 35 0.805 37.623 -59.019 1.00 17.25 H new ATOM 0 HG2 GLN A 35 -0.217 38.218 -57.037 1.00 16.04 H new ATOM 0 HG3 GLN A 35 0.166 39.714 -57.253 1.00 16.04 H new ATOM 0 HE21 GLN A 35 -1.890 37.278 -58.347 1.00 18.26 H new ATOM 0 HE22 GLN A 35 -2.920 38.102 -59.039 1.00 18.26 H new ATOM 293 N MET A 36 2.236 37.759 -55.567 1.00 20.28 N ATOM 294 CA MET A 36 2.113 36.745 -54.521 1.00 22.42 C ATOM 295 C MET A 36 1.288 37.251 -53.412 1.00 24.42 C ATOM 296 O MET A 36 1.411 38.444 -53.052 1.00 26.77 O ATOM 297 CB MET A 36 3.461 36.317 -53.967 1.00 22.50 C ATOM 298 CG MET A 36 4.406 37.437 -53.446 1.00 24.16 C ATOM 299 SD MET A 36 6.205 37.026 -53.441 1.00 21.17 S ATOM 300 CE MET A 36 6.881 38.426 -52.479 1.00 15.54 C ATOM 0 H MET A 36 2.220 38.578 -55.304 1.00 20.28 H new ATOM 0 HA MET A 36 1.693 35.973 -54.932 1.00 22.42 H new ATOM 0 HB2 MET A 36 3.303 35.695 -53.240 1.00 22.50 H new ATOM 0 HB3 MET A 36 3.929 35.828 -54.661 1.00 22.50 H new ATOM 0 HG2 MET A 36 4.273 38.229 -53.990 1.00 24.16 H new ATOM 0 HG3 MET A 36 4.141 37.667 -52.542 1.00 24.16 H new ATOM 0 HE1 MET A 36 7.836 38.494 -52.634 1.00 15.54 H new ATOM 0 HE2 MET A 36 6.449 39.249 -52.757 1.00 15.54 H new ATOM 0 HE3 MET A 36 6.717 38.279 -51.534 1.00 15.54 H new ATOM 301 N ARG A 37 0.437 36.386 -52.855 1.00 24.04 N ATOM 302 CA ARG A 37 -0.341 36.808 -51.677 1.00 22.79 C ATOM 303 C ARG A 37 0.115 36.304 -50.357 1.00 20.85 C ATOM 304 O ARG A 37 0.779 35.285 -50.303 1.00 21.67 O ATOM 305 CB ARG A 37 -1.775 36.366 -51.801 1.00 23.80 C ATOM 306 CG ARG A 37 -2.033 35.365 -52.837 1.00 21.77 C ATOM 307 CD ARG A 37 -3.503 35.380 -52.971 1.00 18.58 C ATOM 308 NE ARG A 37 -3.982 36.133 -54.098 1.00 21.09 N ATOM 309 CZ ARG A 37 -5.065 36.930 -54.115 1.00 21.77 C ATOM 310 NH1 ARG A 37 -5.417 37.534 -55.256 1.00 18.38 N ATOM 311 NH2 ARG A 37 -5.803 37.101 -53.025 1.00 14.08 N ATOM 0 H ARG A 37 0.296 35.582 -53.127 1.00 24.04 H new ATOM 0 HA ARG A 37 -0.218 37.770 -51.685 1.00 22.79 H new ATOM 0 HB2 ARG A 37 -2.063 36.008 -50.947 1.00 23.80 H new ATOM 0 HB3 ARG A 37 -2.324 37.145 -51.981 1.00 23.80 H new ATOM 0 HG2 ARG A 37 -1.596 35.594 -53.672 1.00 21.77 H new ATOM 0 HG3 ARG A 37 -1.707 34.489 -52.577 1.00 21.77 H new ATOM 0 HD2 ARG A 37 -3.821 34.467 -53.046 1.00 18.58 H new ATOM 0 HD3 ARG A 37 -3.888 35.749 -52.161 1.00 18.58 H new ATOM 0 HE ARG A 37 -3.534 36.068 -54.829 1.00 21.09 H new ATOM 0 HH11 ARG A 37 -4.952 37.411 -55.969 1.00 18.38 H new ATOM 0 HH12 ARG A 37 -6.108 38.045 -55.276 1.00 18.38 H new ATOM 0 HH21 ARG A 37 -5.591 36.699 -52.295 1.00 14.08 H new ATOM 0 HH22 ARG A 37 -6.493 37.613 -53.049 1.00 14.08 H new ATOM 312 N PHE A 38 -0.314 36.954 -49.283 1.00 18.43 N ATOM 313 CA PHE A 38 -0.110 36.411 -47.931 1.00 16.59 C ATOM 314 C PHE A 38 -1.438 36.501 -47.154 1.00 18.45 C ATOM 315 O PHE A 38 -2.039 37.587 -47.038 1.00 19.53 O ATOM 316 CB PHE A 38 0.937 37.236 -47.208 1.00 15.17 C ATOM 317 CG PHE A 38 2.309 37.218 -47.885 1.00 16.13 C ATOM 318 CD1 PHE A 38 3.328 36.394 -47.395 1.00 13.09 C ATOM 319 CD2 PHE A 38 2.595 38.014 -48.986 1.00 8.27 C ATOM 320 CE1 PHE A 38 4.593 36.293 -48.004 1.00 11.02 C ATOM 321 CE2 PHE A 38 3.898 37.925 -49.619 1.00 15.60 C ATOM 322 CZ PHE A 38 4.883 37.094 -49.124 1.00 17.02 C ATOM 0 H PHE A 38 -0.725 37.709 -49.308 1.00 18.43 H new ATOM 0 HA PHE A 38 0.184 35.489 -47.990 1.00 16.59 H new ATOM 0 HB2 PHE A 38 0.628 38.153 -47.145 1.00 15.17 H new ATOM 0 HB3 PHE A 38 1.028 36.905 -46.301 1.00 15.17 H new ATOM 0 HD1 PHE A 38 3.162 35.890 -46.632 1.00 13.09 H new ATOM 0 HD2 PHE A 38 1.954 38.602 -49.316 1.00 8.27 H new ATOM 0 HE1 PHE A 38 5.230 35.703 -47.670 1.00 11.02 H new ATOM 0 HE2 PHE A 38 4.073 38.439 -50.374 1.00 15.60 H new ATOM 0 HZ PHE A 38 5.722 37.064 -49.523 1.00 17.02 H new ATOM 323 N ASP A 39 -1.911 35.419 -46.558 1.00 19.44 N ATOM 324 CA ASP A 39 -3.182 35.514 -45.854 1.00 20.32 C ATOM 325 C ASP A 39 -2.822 36.013 -44.467 1.00 22.21 C ATOM 326 O ASP A 39 -2.194 35.298 -43.677 1.00 24.47 O ATOM 327 CB ASP A 39 -3.958 34.204 -45.893 1.00 17.86 C ATOM 328 CG ASP A 39 -5.175 34.221 -44.972 1.00 22.46 C ATOM 329 OD1 ASP A 39 -5.921 33.198 -44.861 1.00 25.64 O ATOM 330 OD2 ASP A 39 -5.358 35.235 -44.282 1.00 19.66 O ATOM 0 H ASP A 39 -1.531 34.647 -46.546 1.00 19.44 H new ATOM 0 HA ASP A 39 -3.803 36.131 -46.273 1.00 20.32 H new ATOM 0 HB2 ASP A 39 -4.246 34.029 -46.802 1.00 17.86 H new ATOM 0 HB3 ASP A 39 -3.371 33.476 -45.636 1.00 17.86 H new ATOM 331 N LEU A 40 -3.144 37.272 -44.185 1.00 23.17 N ATOM 332 CA LEU A 40 -2.651 37.894 -42.987 1.00 24.01 C ATOM 333 C LEU A 40 -3.323 37.358 -41.739 1.00 25.72 C ATOM 334 O LEU A 40 -2.993 37.717 -40.623 1.00 25.26 O ATOM 335 CB LEU A 40 -2.844 39.386 -43.066 1.00 23.74 C ATOM 336 CG LEU A 40 -1.947 40.070 -44.071 1.00 25.48 C ATOM 337 CD1 LEU A 40 -2.357 41.475 -44.005 1.00 27.75 C ATOM 338 CD2 LEU A 40 -0.504 39.937 -43.694 1.00 24.37 C ATOM 0 H LEU A 40 -3.643 37.771 -44.676 1.00 23.17 H new ATOM 0 HA LEU A 40 -1.706 37.683 -42.922 1.00 24.01 H new ATOM 0 HB2 LEU A 40 -3.769 39.572 -43.293 1.00 23.74 H new ATOM 0 HB3 LEU A 40 -2.684 39.770 -42.190 1.00 23.74 H new ATOM 0 HG LEU A 40 -2.030 39.685 -44.958 1.00 25.48 H new ATOM 0 HD11 LEU A 40 -1.826 41.997 -44.627 1.00 27.75 H new ATOM 0 HD12 LEU A 40 -3.295 41.550 -44.240 1.00 27.75 H new ATOM 0 HD13 LEU A 40 -2.222 41.810 -43.105 1.00 27.75 H new ATOM 0 HD21 LEU A 40 0.046 40.385 -44.356 1.00 24.37 H new ATOM 0 HD22 LEU A 40 -0.358 40.342 -42.825 1.00 24.37 H new ATOM 0 HD23 LEU A 40 -0.264 38.998 -43.657 1.00 24.37 H new ATOM 339 N SER A 41 -4.276 36.468 -41.913 1.00 28.01 N ATOM 340 CA SER A 41 -4.936 35.900 -40.739 1.00 30.18 C ATOM 341 C SER A 41 -4.145 34.677 -40.264 1.00 30.20 C ATOM 342 O SER A 41 -4.461 34.061 -39.218 1.00 30.07 O ATOM 343 CB SER A 41 -6.360 35.521 -41.085 1.00 28.95 C ATOM 344 OG SER A 41 -6.316 34.393 -41.933 1.00 33.40 O ATOM 0 H SER A 41 -4.556 36.180 -42.674 1.00 28.01 H new ATOM 0 HA SER A 41 -4.963 36.554 -40.024 1.00 30.18 H new ATOM 0 HB2 SER A 41 -6.863 35.321 -40.280 1.00 28.95 H new ATOM 0 HB3 SER A 41 -6.810 36.259 -41.525 1.00 28.95 H new ATOM 0 HG SER A 41 -6.133 34.637 -42.715 1.00 33.40 H new ATOM 345 N LYS A 42 -3.139 34.328 -41.056 1.00 30.14 N ATOM 346 CA LYS A 42 -2.368 33.161 -40.747 1.00 30.67 C ATOM 347 C LYS A 42 -1.099 33.566 -40.017 1.00 30.92 C ATOM 348 O LYS A 42 -0.263 32.717 -39.741 1.00 31.72 O ATOM 349 CB LYS A 42 -2.083 32.291 -41.980 1.00 30.94 C ATOM 350 CG LYS A 42 -3.360 31.821 -42.743 1.00 35.39 C ATOM 351 CD LYS A 42 -4.015 30.527 -42.277 1.00 41.82 C ATOM 352 CE LYS A 42 -5.550 30.790 -42.070 1.00 47.79 C ATOM 353 NZ LYS A 42 -6.252 29.967 -41.022 1.00 49.27 N ATOM 0 H LYS A 42 -2.898 34.753 -41.764 1.00 30.14 H new ATOM 0 HA LYS A 42 -2.896 32.598 -40.159 1.00 30.67 H new ATOM 0 HB2 LYS A 42 -1.519 32.790 -42.591 1.00 30.94 H new ATOM 0 HB3 LYS A 42 -1.579 31.510 -41.702 1.00 30.94 H new ATOM 0 HG2 LYS A 42 -4.021 32.529 -42.687 1.00 35.39 H new ATOM 0 HG3 LYS A 42 -3.130 31.721 -43.680 1.00 35.39 H new ATOM 0 HD2 LYS A 42 -3.879 29.825 -42.933 1.00 41.82 H new ATOM 0 HD3 LYS A 42 -3.611 30.224 -41.449 1.00 41.82 H new ATOM 0 HE2 LYS A 42 -5.667 31.726 -41.846 1.00 47.79 H new ATOM 0 HE3 LYS A 42 -5.998 30.643 -42.918 1.00 47.79 H new ATOM 0 HZ1 LYS A 42 -7.111 30.197 -40.990 1.00 49.27 H new ATOM 0 HZ2 LYS A 42 -6.184 29.104 -41.227 1.00 49.27 H new ATOM 0 HZ3 LYS A 42 -5.876 30.113 -40.229 1.00 49.27 H new ATOM 354 N GLY A 43 -0.970 34.838 -39.628 1.00 30.28 N ATOM 355 CA GLY A 43 0.297 35.285 -39.062 1.00 27.93 C ATOM 356 C GLY A 43 0.957 36.378 -39.878 1.00 26.59 C ATOM 357 O GLY A 43 0.577 36.546 -41.005 1.00 26.64 O ATOM 0 H GLY A 43 -1.584 35.437 -39.682 1.00 30.28 H new ATOM 0 HA2 GLY A 43 0.146 35.608 -38.160 1.00 27.93 H new ATOM 0 HA3 GLY A 43 0.901 34.529 -38.996 1.00 27.93 H new ATOM 358 N PHE A 44 1.923 37.110 -39.293 1.00 24.69 N ATOM 359 CA PHE A 44 2.527 38.270 -39.909 1.00 21.97 C ATOM 360 C PHE A 44 3.769 37.799 -40.693 1.00 21.84 C ATOM 361 O PHE A 44 4.545 37.025 -40.202 1.00 21.56 O ATOM 362 CB PHE A 44 2.886 39.287 -38.829 1.00 22.03 C ATOM 363 CG PHE A 44 3.388 40.629 -39.380 1.00 21.70 C ATOM 364 CD1 PHE A 44 4.734 40.883 -39.501 1.00 25.91 C ATOM 365 CD2 PHE A 44 2.514 41.600 -39.823 1.00 24.72 C ATOM 366 CE1 PHE A 44 5.234 42.123 -40.052 1.00 25.98 C ATOM 367 CE2 PHE A 44 2.993 42.827 -40.371 1.00 26.79 C ATOM 368 CZ PHE A 44 4.373 43.075 -40.464 1.00 24.71 C ATOM 0 H PHE A 44 2.240 36.930 -38.514 1.00 24.69 H new ATOM 0 HA PHE A 44 1.915 38.704 -40.524 1.00 21.97 H new ATOM 0 HB2 PHE A 44 2.106 39.446 -38.275 1.00 22.03 H new ATOM 0 HB3 PHE A 44 3.569 38.908 -38.254 1.00 22.03 H new ATOM 0 HD1 PHE A 44 5.342 40.237 -39.220 1.00 25.91 H new ATOM 0 HD2 PHE A 44 1.598 41.452 -39.763 1.00 24.72 H new ATOM 0 HE1 PHE A 44 6.151 42.264 -40.122 1.00 25.98 H new ATOM 0 HE2 PHE A 44 2.388 43.467 -40.669 1.00 26.79 H new ATOM 0 HZ PHE A 44 4.687 43.882 -40.804 1.00 24.71 H new ATOM 369 N PRO A 45 3.896 38.168 -41.970 1.00 21.43 N ATOM 370 CA PRO A 45 5.045 37.733 -42.764 1.00 20.12 C ATOM 371 C PRO A 45 6.361 38.397 -42.570 1.00 18.65 C ATOM 372 O PRO A 45 6.841 38.998 -43.519 1.00 18.61 O ATOM 373 CB PRO A 45 4.585 38.040 -44.181 1.00 20.13 C ATOM 374 CG PRO A 45 3.683 39.266 -43.976 1.00 21.18 C ATOM 375 CD PRO A 45 2.882 38.822 -42.835 1.00 21.56 C ATOM 0 HA PRO A 45 5.241 36.817 -42.514 1.00 20.12 H new ATOM 0 HB2 PRO A 45 5.331 38.234 -44.769 1.00 20.13 H new ATOM 0 HB3 PRO A 45 4.101 37.296 -44.573 1.00 20.13 H new ATOM 0 HG2 PRO A 45 4.191 40.069 -43.780 1.00 21.18 H new ATOM 0 HG3 PRO A 45 3.139 39.458 -44.756 1.00 21.18 H new ATOM 0 HD2 PRO A 45 2.449 39.565 -42.386 1.00 21.56 H new ATOM 0 HD3 PRO A 45 2.183 38.205 -43.102 1.00 21.56 H new ATOM 376 N LEU A 46 6.946 38.300 -41.381 1.00 18.08 N ATOM 377 CA LEU A 46 8.331 38.784 -41.189 1.00 17.08 C ATOM 378 C LEU A 46 9.252 37.508 -41.418 1.00 18.02 C ATOM 379 O LEU A 46 9.024 36.421 -40.809 1.00 16.44 O ATOM 380 CB LEU A 46 8.485 39.514 -39.837 1.00 15.46 C ATOM 381 CG LEU A 46 9.803 40.284 -39.623 1.00 15.48 C ATOM 382 CD1 LEU A 46 9.973 41.509 -40.443 1.00 12.13 C ATOM 383 CD2 LEU A 46 9.838 40.699 -38.163 1.00 17.97 C ATOM 0 H LEU A 46 6.576 37.966 -40.680 1.00 18.08 H new ATOM 0 HA LEU A 46 8.600 39.471 -41.819 1.00 17.08 H new ATOM 0 HB2 LEU A 46 7.749 40.138 -39.743 1.00 15.46 H new ATOM 0 HB3 LEU A 46 8.395 38.860 -39.126 1.00 15.46 H new ATOM 0 HG LEU A 46 10.518 39.687 -39.892 1.00 15.48 H new ATOM 0 HD11 LEU A 46 10.827 41.920 -40.238 1.00 12.13 H new ATOM 0 HD12 LEU A 46 9.945 41.275 -41.384 1.00 12.13 H new ATOM 0 HD13 LEU A 46 9.258 42.134 -40.244 1.00 12.13 H new ATOM 0 HD21 LEU A 46 10.656 41.189 -37.985 1.00 17.97 H new ATOM 0 HD22 LEU A 46 9.074 41.264 -37.969 1.00 17.97 H new ATOM 0 HD23 LEU A 46 9.806 39.909 -37.601 1.00 17.97 H new ATOM 384 N LEU A 47 10.193 37.585 -42.379 1.00 17.26 N ATOM 385 CA LEU A 47 10.772 36.331 -42.874 1.00 16.31 C ATOM 386 C LEU A 47 11.373 35.716 -41.615 1.00 18.20 C ATOM 387 O LEU A 47 12.144 36.423 -40.912 1.00 18.00 O ATOM 388 CB LEU A 47 11.873 36.608 -43.890 1.00 15.29 C ATOM 389 CG LEU A 47 11.534 37.165 -45.243 1.00 12.76 C ATOM 390 CD1 LEU A 47 12.721 36.959 -46.121 1.00 15.24 C ATOM 391 CD2 LEU A 47 10.427 36.309 -45.841 1.00 15.27 C ATOM 0 H LEU A 47 10.492 38.308 -42.736 1.00 17.26 H new ATOM 0 HA LEU A 47 10.124 35.763 -43.319 1.00 16.31 H new ATOM 0 HB2 LEU A 47 12.498 37.223 -43.475 1.00 15.29 H new ATOM 0 HB3 LEU A 47 12.348 35.774 -44.034 1.00 15.29 H new ATOM 0 HG LEU A 47 11.278 38.098 -45.172 1.00 12.76 H new ATOM 0 HD11 LEU A 47 12.534 37.309 -47.006 1.00 15.24 H new ATOM 0 HD12 LEU A 47 13.486 37.422 -45.745 1.00 15.24 H new ATOM 0 HD13 LEU A 47 12.917 36.011 -46.184 1.00 15.24 H new ATOM 0 HD21 LEU A 47 10.191 36.651 -46.717 1.00 15.27 H new ATOM 0 HD22 LEU A 47 10.735 35.393 -45.924 1.00 15.27 H new ATOM 0 HD23 LEU A 47 9.648 36.337 -45.263 1.00 15.27 H new ATOM 392 N THR A 48 11.023 34.447 -41.312 1.00 18.32 N ATOM 393 CA THR A 48 11.769 33.654 -40.295 1.00 17.50 C ATOM 394 C THR A 48 13.063 33.021 -40.858 1.00 19.21 C ATOM 395 O THR A 48 14.048 32.818 -40.115 1.00 19.52 O ATOM 396 CB THR A 48 10.967 32.530 -39.692 1.00 17.44 C ATOM 397 OG1 THR A 48 10.840 31.459 -40.658 1.00 16.39 O ATOM 398 CG2 THR A 48 9.554 33.019 -39.233 1.00 15.63 C ATOM 0 H THR A 48 10.366 34.029 -41.677 1.00 18.32 H new ATOM 0 HA THR A 48 11.976 34.312 -39.613 1.00 17.50 H new ATOM 0 HB THR A 48 11.433 32.206 -38.906 1.00 17.44 H new ATOM 0 HG1 THR A 48 10.504 31.759 -41.367 1.00 16.39 H new ATOM 0 HG21 THR A 48 9.063 32.275 -38.850 1.00 15.63 H new ATOM 0 HG22 THR A 48 9.654 33.717 -38.567 1.00 15.63 H new ATOM 0 HG23 THR A 48 9.068 33.368 -39.997 1.00 15.63 H new ATOM 399 N THR A 49 13.120 32.736 -42.161 1.00 18.97 N ATOM 400 CA THR A 49 14.388 32.198 -42.630 1.00 19.46 C ATOM 401 C THR A 49 15.612 33.121 -42.573 1.00 18.30 C ATOM 402 O THR A 49 16.647 32.711 -43.019 1.00 18.02 O ATOM 403 CB THR A 49 14.351 31.654 -44.041 1.00 19.29 C ATOM 404 OG1 THR A 49 14.099 32.729 -44.964 1.00 18.39 O ATOM 405 CG2 THR A 49 13.402 30.549 -44.142 1.00 19.09 C ATOM 0 H THR A 49 12.494 32.836 -42.742 1.00 18.97 H new ATOM 0 HA THR A 49 14.501 31.495 -41.971 1.00 19.46 H new ATOM 0 HB THR A 49 15.212 31.278 -44.280 1.00 19.29 H new ATOM 0 HG1 THR A 49 13.288 32.945 -44.928 1.00 18.39 H new ATOM 0 HG21 THR A 49 13.392 30.213 -45.052 1.00 19.09 H new ATOM 0 HG22 THR A 49 13.668 29.838 -43.538 1.00 19.09 H new ATOM 0 HG23 THR A 49 12.515 30.861 -43.903 1.00 19.09 H new ATOM 406 N LYS A 50 15.497 34.336 -42.045 1.00 19.41 N ATOM 407 CA LYS A 50 16.669 35.294 -41.848 1.00 20.44 C ATOM 408 C LYS A 50 16.198 36.426 -40.935 1.00 22.51 C ATOM 409 O LYS A 50 15.019 36.764 -40.926 1.00 23.32 O ATOM 410 CB LYS A 50 17.094 35.827 -43.162 1.00 18.42 C ATOM 411 CG LYS A 50 17.192 37.256 -43.235 1.00 18.44 C ATOM 412 CD LYS A 50 18.003 37.635 -44.520 1.00 14.47 C ATOM 413 CE LYS A 50 17.070 38.256 -45.582 1.00 15.39 C ATOM 414 NZ LYS A 50 17.562 39.579 -46.216 1.00 12.78 N ATOM 0 H LYS A 50 14.745 34.659 -41.780 1.00 19.41 H new ATOM 0 HA LYS A 50 17.426 34.840 -41.445 1.00 20.44 H new ATOM 0 HB2 LYS A 50 17.957 35.445 -43.387 1.00 18.42 H new ATOM 0 HB3 LYS A 50 16.466 35.525 -43.837 1.00 18.42 H new ATOM 0 HG2 LYS A 50 16.308 37.653 -43.266 1.00 18.44 H new ATOM 0 HG3 LYS A 50 17.632 37.604 -42.444 1.00 18.44 H new ATOM 0 HD2 LYS A 50 18.706 38.263 -44.292 1.00 14.47 H new ATOM 0 HD3 LYS A 50 18.434 36.845 -44.882 1.00 14.47 H new ATOM 0 HE2 LYS A 50 16.936 37.607 -46.290 1.00 15.39 H new ATOM 0 HE3 LYS A 50 16.204 38.414 -45.175 1.00 15.39 H new ATOM 0 HZ1 LYS A 50 16.906 40.180 -46.196 1.00 12.78 H new ATOM 0 HZ2 LYS A 50 18.260 39.887 -45.757 1.00 12.78 H new ATOM 0 HZ3 LYS A 50 17.804 39.432 -47.060 1.00 12.78 H new ATOM 415 N LYS A 51 17.085 36.986 -40.125 1.00 25.01 N ATOM 416 CA LYS A 51 16.698 38.028 -39.144 1.00 26.63 C ATOM 417 C LYS A 51 16.482 39.336 -39.865 1.00 26.47 C ATOM 418 O LYS A 51 17.441 39.915 -40.420 1.00 26.92 O ATOM 419 CB LYS A 51 17.795 38.194 -38.090 1.00 26.96 C ATOM 420 CG LYS A 51 17.359 38.602 -36.649 1.00 28.96 C ATOM 421 CD LYS A 51 18.609 39.172 -35.919 1.00 29.54 C ATOM 422 CE LYS A 51 18.514 39.309 -34.421 1.00 33.90 C ATOM 423 NZ LYS A 51 18.132 38.061 -33.712 1.00 41.09 N ATOM 0 H LYS A 51 17.921 36.785 -40.117 1.00 25.01 H new ATOM 0 HA LYS A 51 15.878 37.760 -38.701 1.00 26.63 H new ATOM 0 HB2 LYS A 51 18.280 37.356 -38.029 1.00 26.96 H new ATOM 0 HB3 LYS A 51 18.421 38.861 -38.413 1.00 26.96 H new ATOM 0 HG2 LYS A 51 16.653 39.266 -36.683 1.00 28.96 H new ATOM 0 HG3 LYS A 51 17.006 37.836 -36.171 1.00 28.96 H new ATOM 0 HD2 LYS A 51 19.366 38.601 -36.123 1.00 29.54 H new ATOM 0 HD3 LYS A 51 18.805 40.046 -36.291 1.00 29.54 H new ATOM 0 HE2 LYS A 51 19.370 39.612 -34.080 1.00 33.90 H new ATOM 0 HE3 LYS A 51 17.865 39.999 -34.211 1.00 33.90 H new ATOM 0 HZ1 LYS A 51 18.180 38.192 -32.833 1.00 41.09 H new ATOM 0 HZ2 LYS A 51 17.300 37.837 -33.933 1.00 41.09 H new ATOM 0 HZ3 LYS A 51 18.687 37.405 -33.945 1.00 41.09 H new ATOM 424 N VAL A 52 15.230 39.798 -39.863 1.00 26.28 N ATOM 425 CA VAL A 52 14.918 41.114 -40.400 1.00 25.62 C ATOM 426 C VAL A 52 14.551 41.995 -39.210 1.00 26.19 C ATOM 427 O VAL A 52 13.724 41.568 -38.416 1.00 27.75 O ATOM 428 CB VAL A 52 13.702 41.031 -41.334 1.00 25.48 C ATOM 429 CG1 VAL A 52 13.317 42.375 -41.828 1.00 23.63 C ATOM 430 CG2 VAL A 52 13.991 40.086 -42.522 1.00 25.06 C ATOM 0 H VAL A 52 14.554 39.365 -39.556 1.00 26.28 H new ATOM 0 HA VAL A 52 15.672 41.465 -40.899 1.00 25.62 H new ATOM 0 HB VAL A 52 12.959 40.671 -40.824 1.00 25.48 H new ATOM 0 HG11 VAL A 52 12.548 42.296 -42.415 1.00 23.63 H new ATOM 0 HG12 VAL A 52 13.092 42.944 -41.076 1.00 23.63 H new ATOM 0 HG13 VAL A 52 14.058 42.765 -42.318 1.00 23.63 H new ATOM 0 HG21 VAL A 52 13.213 40.046 -43.100 1.00 25.06 H new ATOM 0 HG22 VAL A 52 14.750 40.420 -43.025 1.00 25.06 H new ATOM 0 HG23 VAL A 52 14.191 39.198 -42.188 1.00 25.06 H new ATOM 431 N PRO A 53 15.109 43.225 -39.097 1.00 25.00 N ATOM 432 CA PRO A 53 14.856 44.210 -38.064 1.00 23.98 C ATOM 433 C PRO A 53 13.527 44.964 -38.147 1.00 24.40 C ATOM 434 O PRO A 53 13.330 46.021 -38.805 1.00 24.13 O ATOM 435 CB PRO A 53 16.014 45.181 -38.246 1.00 23.59 C ATOM 436 CG PRO A 53 16.257 45.124 -39.669 1.00 23.74 C ATOM 437 CD PRO A 53 16.127 43.731 -40.027 1.00 26.06 C ATOM 0 HA PRO A 53 14.791 43.771 -37.201 1.00 23.98 H new ATOM 0 HB2 PRO A 53 15.782 46.077 -37.956 1.00 23.59 H new ATOM 0 HB3 PRO A 53 16.794 44.911 -37.736 1.00 23.59 H new ATOM 0 HG2 PRO A 53 15.619 45.670 -40.154 1.00 23.74 H new ATOM 0 HG3 PRO A 53 17.141 45.459 -39.886 1.00 23.74 H new ATOM 0 HD2 PRO A 53 15.850 43.625 -40.951 1.00 26.06 H new ATOM 0 HD3 PRO A 53 16.968 43.258 -39.927 1.00 26.06 H new ATOM 438 N PHE A 54 12.621 44.454 -37.389 1.00 23.79 N ATOM 439 CA PHE A 54 11.361 45.055 -37.344 1.00 23.77 C ATOM 440 C PHE A 54 11.330 46.534 -36.931 1.00 22.85 C ATOM 441 O PHE A 54 10.599 47.356 -37.547 1.00 22.71 O ATOM 442 CB PHE A 54 10.469 44.192 -36.508 1.00 23.53 C ATOM 443 CG PHE A 54 9.013 44.465 -36.725 1.00 28.53 C ATOM 444 CD1 PHE A 54 8.488 44.544 -38.019 1.00 28.09 C ATOM 445 CD2 PHE A 54 8.155 44.610 -35.646 1.00 25.04 C ATOM 446 CE1 PHE A 54 7.136 44.791 -38.185 1.00 32.83 C ATOM 447 CE2 PHE A 54 6.811 44.822 -35.836 1.00 31.91 C ATOM 448 CZ PHE A 54 6.284 44.899 -37.083 1.00 26.90 C ATOM 0 H PHE A 54 12.721 43.758 -36.893 1.00 23.79 H new ATOM 0 HA PHE A 54 11.033 45.105 -38.256 1.00 23.77 H new ATOM 0 HB2 PHE A 54 10.651 43.260 -36.707 1.00 23.53 H new ATOM 0 HB3 PHE A 54 10.682 44.328 -35.571 1.00 23.53 H new ATOM 0 HD1 PHE A 54 9.040 44.432 -38.759 1.00 28.09 H new ATOM 0 HD2 PHE A 54 8.494 44.563 -34.781 1.00 25.04 H new ATOM 0 HE1 PHE A 54 6.790 44.886 -39.043 1.00 32.83 H new ATOM 0 HE2 PHE A 54 6.254 44.914 -35.097 1.00 31.91 H new ATOM 0 HZ PHE A 54 5.370 45.022 -37.203 1.00 26.90 H new ATOM 449 N GLY A 55 12.129 46.899 -35.944 1.00 22.31 N ATOM 450 CA GLY A 55 12.178 48.304 -35.439 1.00 21.27 C ATOM 451 C GLY A 55 12.421 49.265 -36.574 1.00 21.55 C ATOM 452 O GLY A 55 11.744 50.318 -36.714 1.00 22.48 O ATOM 0 H GLY A 55 12.662 46.360 -35.537 1.00 22.31 H new ATOM 0 HA2 GLY A 55 11.344 48.523 -34.995 1.00 21.27 H new ATOM 0 HA3 GLY A 55 12.882 48.391 -34.778 1.00 21.27 H new ATOM 453 N LEU A 56 13.339 48.907 -37.450 1.00 22.00 N ATOM 454 CA LEU A 56 13.611 49.785 -38.595 1.00 23.40 C ATOM 455 C LEU A 56 12.377 49.953 -39.438 1.00 24.57 C ATOM 456 O LEU A 56 12.120 51.071 -39.941 1.00 24.71 O ATOM 457 CB LEU A 56 14.739 49.296 -39.480 1.00 23.98 C ATOM 458 CG LEU A 56 16.055 49.248 -38.722 1.00 24.93 C ATOM 459 CD1 LEU A 56 17.155 49.014 -39.667 1.00 23.68 C ATOM 460 CD2 LEU A 56 16.257 50.607 -38.081 1.00 31.53 C ATOM 0 H LEU A 56 13.807 48.187 -37.413 1.00 22.00 H new ATOM 0 HA LEU A 56 13.885 50.633 -38.212 1.00 23.40 H new ATOM 0 HB2 LEU A 56 14.527 48.413 -39.820 1.00 23.98 H new ATOM 0 HB3 LEU A 56 14.827 49.882 -40.248 1.00 23.98 H new ATOM 0 HG LEU A 56 16.040 48.540 -38.059 1.00 24.93 H new ATOM 0 HD11 LEU A 56 17.996 48.983 -39.184 1.00 23.68 H new ATOM 0 HD12 LEU A 56 17.015 48.171 -40.125 1.00 23.68 H new ATOM 0 HD13 LEU A 56 17.182 49.734 -40.317 1.00 23.68 H new ATOM 0 HD21 LEU A 56 17.092 50.611 -37.587 1.00 31.53 H new ATOM 0 HD22 LEU A 56 16.286 51.289 -38.770 1.00 31.53 H new ATOM 0 HD23 LEU A 56 15.522 50.792 -37.475 1.00 31.53 H new ATOM 461 N ILE A 57 11.599 48.878 -39.586 1.00 24.67 N ATOM 462 CA ILE A 57 10.552 48.918 -40.561 1.00 24.48 C ATOM 463 C ILE A 57 9.418 49.719 -39.901 1.00 24.77 C ATOM 464 O ILE A 57 8.812 50.562 -40.519 1.00 25.40 O ATOM 465 CB ILE A 57 10.084 47.516 -41.243 1.00 24.76 C ATOM 466 CG1 ILE A 57 8.870 47.002 -40.608 1.00 28.17 C ATOM 467 CG2 ILE A 57 11.070 46.316 -41.448 1.00 22.48 C ATOM 468 CD1 ILE A 57 7.762 47.287 -41.528 1.00 35.02 C ATOM 0 H ILE A 57 11.669 48.146 -39.140 1.00 24.67 H new ATOM 0 HA ILE A 57 10.892 49.345 -41.363 1.00 24.48 H new ATOM 0 HB ILE A 57 9.974 47.838 -42.151 1.00 24.76 H new ATOM 0 HG12 ILE A 57 8.944 46.049 -40.443 1.00 28.17 H new ATOM 0 HG13 ILE A 57 8.723 47.428 -39.749 1.00 28.17 H new ATOM 0 HG21 ILE A 57 10.600 45.579 -41.868 1.00 22.48 H new ATOM 0 HG22 ILE A 57 11.806 46.595 -42.015 1.00 22.48 H new ATOM 0 HG23 ILE A 57 11.416 46.030 -40.588 1.00 22.48 H new ATOM 0 HD11 ILE A 57 6.932 46.962 -41.146 1.00 35.02 H new ATOM 0 HD12 ILE A 57 7.698 48.244 -41.671 1.00 35.02 H new ATOM 0 HD13 ILE A 57 7.923 46.844 -42.376 1.00 35.02 H new ATOM 469 N LYS A 58 9.158 49.531 -38.620 1.00 24.24 N ATOM 470 CA LYS A 58 8.018 50.233 -38.078 1.00 22.69 C ATOM 471 C LYS A 58 8.248 51.735 -37.859 1.00 23.29 C ATOM 472 O LYS A 58 7.456 52.593 -38.291 1.00 23.04 O ATOM 473 CB LYS A 58 7.461 49.523 -36.848 1.00 23.15 C ATOM 474 CG LYS A 58 7.770 50.036 -35.562 1.00 21.18 C ATOM 475 CD LYS A 58 7.566 48.854 -34.678 1.00 26.95 C ATOM 476 CE LYS A 58 7.946 49.222 -33.247 1.00 29.62 C ATOM 477 NZ LYS A 58 7.406 48.287 -32.214 1.00 33.00 N ATOM 0 H LYS A 58 9.600 49.032 -38.076 1.00 24.24 H new ATOM 0 HA LYS A 58 7.332 50.201 -38.763 1.00 22.69 H new ATOM 0 HB2 LYS A 58 6.495 49.505 -36.932 1.00 23.15 H new ATOM 0 HB3 LYS A 58 7.766 48.603 -36.878 1.00 23.15 H new ATOM 0 HG2 LYS A 58 8.681 50.367 -35.516 1.00 21.18 H new ATOM 0 HG3 LYS A 58 7.187 50.772 -35.319 1.00 21.18 H new ATOM 0 HD2 LYS A 58 6.640 48.566 -34.714 1.00 26.95 H new ATOM 0 HD3 LYS A 58 8.107 48.110 -34.986 1.00 26.95 H new ATOM 0 HE2 LYS A 58 8.913 49.245 -33.175 1.00 29.62 H new ATOM 0 HE3 LYS A 58 7.626 50.118 -33.058 1.00 29.62 H new ATOM 0 HZ1 LYS A 58 7.613 48.589 -31.403 1.00 33.00 H new ATOM 0 HZ2 LYS A 58 6.521 48.235 -32.294 1.00 33.00 H new ATOM 0 HZ3 LYS A 58 7.761 47.479 -32.330 1.00 33.00 H new ATOM 478 N SER A 59 9.363 52.074 -37.223 1.00 22.67 N ATOM 479 CA SER A 59 9.764 53.439 -37.157 1.00 21.52 C ATOM 480 C SER A 59 9.762 54.115 -38.575 1.00 21.13 C ATOM 481 O SER A 59 9.549 55.272 -38.644 1.00 23.21 O ATOM 482 CB SER A 59 11.152 53.559 -36.485 1.00 22.59 C ATOM 483 OG SER A 59 12.260 53.364 -37.408 1.00 25.01 O ATOM 0 H SER A 59 9.890 51.520 -36.829 1.00 22.67 H new ATOM 0 HA SER A 59 9.116 53.914 -36.614 1.00 21.52 H new ATOM 0 HB2 SER A 59 11.231 54.435 -36.076 1.00 22.59 H new ATOM 0 HB3 SER A 59 11.216 52.906 -35.771 1.00 22.59 H new ATOM 0 HG SER A 59 12.883 52.959 -37.017 1.00 25.01 H new ATOM 484 N GLU A 60 9.971 53.446 -39.699 1.00 19.38 N ATOM 485 CA GLU A 60 9.910 54.158 -40.995 1.00 19.76 C ATOM 486 C GLU A 60 8.423 54.317 -41.430 1.00 20.23 C ATOM 487 O GLU A 60 8.029 55.380 -41.939 1.00 20.71 O ATOM 488 CB GLU A 60 10.753 53.434 -42.044 1.00 18.41 C ATOM 489 CG GLU A 60 10.808 54.118 -43.293 1.00 19.71 C ATOM 490 CD GLU A 60 11.151 53.191 -44.465 1.00 23.33 C ATOM 491 OE1 GLU A 60 12.011 53.601 -45.263 1.00 23.64 O ATOM 492 OE2 GLU A 60 10.552 52.088 -44.631 1.00 22.44 O ATOM 0 H GLU A 60 10.145 52.605 -39.748 1.00 19.38 H new ATOM 0 HA GLU A 60 10.287 55.047 -40.901 1.00 19.76 H new ATOM 0 HB2 GLU A 60 11.654 53.322 -41.704 1.00 18.41 H new ATOM 0 HB3 GLU A 60 10.390 52.546 -42.185 1.00 18.41 H new ATOM 0 HG2 GLU A 60 9.953 54.543 -43.462 1.00 19.71 H new ATOM 0 HG3 GLU A 60 11.470 54.825 -43.241 1.00 19.71 H new ATOM 493 N LEU A 61 7.586 53.304 -41.210 1.00 18.76 N ATOM 494 CA LEU A 61 6.209 53.415 -41.652 1.00 18.68 C ATOM 495 C LEU A 61 5.474 54.539 -40.921 1.00 20.08 C ATOM 496 O LEU A 61 4.746 55.279 -41.581 1.00 19.76 O ATOM 497 CB LEU A 61 5.416 52.155 -41.454 1.00 18.12 C ATOM 498 CG LEU A 61 3.980 52.105 -42.063 1.00 16.99 C ATOM 499 CD1 LEU A 61 4.021 52.233 -43.587 1.00 15.11 C ATOM 500 CD2 LEU A 61 3.520 50.719 -41.757 1.00 9.99 C ATOM 0 H LEU A 61 7.792 52.567 -40.818 1.00 18.76 H new ATOM 0 HA LEU A 61 6.271 53.602 -42.602 1.00 18.68 H new ATOM 0 HB2 LEU A 61 5.925 51.419 -41.827 1.00 18.12 H new ATOM 0 HB3 LEU A 61 5.343 51.994 -40.500 1.00 18.12 H new ATOM 0 HG LEU A 61 3.421 52.816 -41.712 1.00 16.99 H new ATOM 0 HD11 LEU A 61 3.118 52.199 -43.939 1.00 15.11 H new ATOM 0 HD12 LEU A 61 4.431 53.078 -43.830 1.00 15.11 H new ATOM 0 HD13 LEU A 61 4.540 51.503 -43.959 1.00 15.11 H new ATOM 0 HD21 LEU A 61 2.623 50.592 -42.103 1.00 9.99 H new ATOM 0 HD22 LEU A 61 4.120 50.080 -42.173 1.00 9.99 H new ATOM 0 HD23 LEU A 61 3.518 50.583 -40.797 1.00 9.99 H new ATOM 501 N LEU A 62 5.612 54.601 -39.592 1.00 19.53 N ATOM 502 CA LEU A 62 5.179 55.772 -38.787 1.00 19.50 C ATOM 503 C LEU A 62 5.640 57.112 -39.338 1.00 19.92 C ATOM 504 O LEU A 62 4.877 58.071 -39.429 1.00 21.65 O ATOM 505 CB LEU A 62 5.618 55.644 -37.329 1.00 18.95 C ATOM 506 CG LEU A 62 4.992 54.457 -36.549 1.00 16.95 C ATOM 507 CD1 LEU A 62 5.233 54.516 -35.034 1.00 19.53 C ATOM 508 CD2 LEU A 62 3.490 54.170 -36.783 1.00 16.70 C ATOM 0 H LEU A 62 5.959 53.968 -39.124 1.00 19.53 H new ATOM 0 HA LEU A 62 4.211 55.762 -38.842 1.00 19.50 H new ATOM 0 HB2 LEU A 62 6.584 55.555 -37.304 1.00 18.95 H new ATOM 0 HB3 LEU A 62 5.397 56.468 -36.867 1.00 18.95 H new ATOM 0 HG LEU A 62 5.482 53.720 -36.946 1.00 16.95 H new ATOM 0 HD11 LEU A 62 4.818 53.749 -34.610 1.00 19.53 H new ATOM 0 HD12 LEU A 62 6.187 54.506 -34.857 1.00 19.53 H new ATOM 0 HD13 LEU A 62 4.847 55.331 -34.676 1.00 19.53 H new ATOM 0 HD21 LEU A 62 3.218 53.411 -36.244 1.00 16.70 H new ATOM 0 HD22 LEU A 62 2.969 54.948 -36.531 1.00 16.70 H new ATOM 0 HD23 LEU A 62 3.341 53.971 -37.720 1.00 16.70 H new ATOM 509 N TRP A 63 6.900 57.202 -39.730 1.00 19.87 N ATOM 510 CA TRP A 63 7.390 58.389 -40.371 1.00 16.82 C ATOM 511 C TRP A 63 6.504 58.699 -41.561 1.00 18.25 C ATOM 512 O TRP A 63 5.940 59.777 -41.615 1.00 18.72 O ATOM 513 CB TRP A 63 8.788 58.126 -40.796 1.00 15.37 C ATOM 514 CG TRP A 63 9.554 59.216 -41.301 1.00 13.57 C ATOM 515 CD1 TRP A 63 9.860 60.416 -40.642 1.00 15.54 C ATOM 516 CD2 TRP A 63 10.298 59.231 -42.530 1.00 16.19 C ATOM 517 NE1 TRP A 63 10.674 61.208 -41.461 1.00 19.70 N ATOM 518 CE2 TRP A 63 10.977 60.502 -42.613 1.00 14.44 C ATOM 519 CE3 TRP A 63 10.471 58.298 -43.582 1.00 19.00 C ATOM 520 CZ2 TRP A 63 11.827 60.851 -43.705 1.00 15.38 C ATOM 521 CZ3 TRP A 63 11.296 58.674 -44.714 1.00 15.52 C ATOM 522 CH2 TRP A 63 11.971 59.944 -44.748 1.00 15.30 C ATOM 0 H TRP A 63 7.485 56.579 -39.630 1.00 19.87 H new ATOM 0 HA TRP A 63 7.375 59.153 -39.774 1.00 16.82 H new ATOM 0 HB2 TRP A 63 9.264 57.756 -40.036 1.00 15.37 H new ATOM 0 HB3 TRP A 63 8.766 57.438 -41.479 1.00 15.37 H new ATOM 0 HD1 TRP A 63 9.567 60.650 -39.791 1.00 15.54 H new ATOM 0 HE1 TRP A 63 10.942 62.004 -41.278 1.00 19.70 H new ATOM 0 HE3 TRP A 63 10.064 57.462 -43.547 1.00 19.00 H new ATOM 0 HZ2 TRP A 63 12.274 61.666 -43.718 1.00 15.38 H new ATOM 0 HZ3 TRP A 63 11.390 58.086 -45.428 1.00 15.52 H new ATOM 0 HH2 TRP A 63 12.509 60.160 -45.475 1.00 15.30 H new ATOM 523 N PHE A 64 6.354 57.773 -42.505 1.00 18.56 N ATOM 524 CA PHE A 64 5.511 57.970 -43.664 1.00 18.90 C ATOM 525 C PHE A 64 4.126 58.418 -43.199 1.00 20.63 C ATOM 526 O PHE A 64 3.554 59.369 -43.760 1.00 22.55 O ATOM 527 CB PHE A 64 5.365 56.642 -44.468 1.00 18.97 C ATOM 528 CG PHE A 64 6.679 56.125 -45.178 1.00 18.84 C ATOM 529 CD1 PHE A 64 7.776 56.955 -45.420 1.00 19.34 C ATOM 530 CD2 PHE A 64 6.743 54.824 -45.683 1.00 17.32 C ATOM 531 CE1 PHE A 64 8.920 56.471 -46.117 1.00 20.99 C ATOM 532 CE2 PHE A 64 7.898 54.326 -46.408 1.00 12.28 C ATOM 533 CZ PHE A 64 8.947 55.124 -46.592 1.00 16.44 C ATOM 0 H PHE A 64 6.745 57.008 -42.484 1.00 18.56 H new ATOM 0 HA PHE A 64 5.915 58.642 -44.235 1.00 18.90 H new ATOM 0 HB2 PHE A 64 5.049 55.951 -43.865 1.00 18.97 H new ATOM 0 HB3 PHE A 64 4.679 56.765 -45.143 1.00 18.97 H new ATOM 0 HD1 PHE A 64 7.759 57.836 -45.122 1.00 19.34 H new ATOM 0 HD2 PHE A 64 6.019 54.256 -45.550 1.00 17.32 H new ATOM 0 HE1 PHE A 64 9.648 57.031 -46.263 1.00 20.99 H new ATOM 0 HE2 PHE A 64 7.905 53.458 -46.741 1.00 12.28 H new ATOM 0 HZ PHE A 64 9.701 54.803 -47.032 1.00 16.44 H new ATOM 534 N LEU A 65 3.612 57.763 -42.163 1.00 19.78 N ATOM 535 CA LEU A 65 2.238 57.939 -41.652 1.00 21.94 C ATOM 536 C LEU A 65 2.021 59.356 -41.022 1.00 23.29 C ATOM 537 O LEU A 65 0.984 59.868 -41.006 1.00 23.84 O ATOM 538 CB LEU A 65 1.958 56.865 -40.617 1.00 19.58 C ATOM 539 CG LEU A 65 0.747 56.026 -40.875 1.00 24.65 C ATOM 540 CD1 LEU A 65 0.805 55.373 -42.196 1.00 18.65 C ATOM 541 CD2 LEU A 65 0.560 55.006 -39.745 1.00 25.57 C ATOM 0 H LEU A 65 4.063 57.182 -41.717 1.00 19.78 H new ATOM 0 HA LEU A 65 1.624 57.860 -42.399 1.00 21.94 H new ATOM 0 HB2 LEU A 65 2.731 56.282 -40.561 1.00 19.58 H new ATOM 0 HB3 LEU A 65 1.860 57.290 -39.751 1.00 19.58 H new ATOM 0 HG LEU A 65 -0.028 56.609 -40.889 1.00 24.65 H new ATOM 0 HD11 LEU A 65 0.006 54.839 -42.329 1.00 18.65 H new ATOM 0 HD12 LEU A 65 0.860 56.049 -42.889 1.00 18.65 H new ATOM 0 HD13 LEU A 65 1.587 54.801 -42.240 1.00 18.65 H new ATOM 0 HD21 LEU A 65 -0.227 54.468 -39.922 1.00 25.57 H new ATOM 0 HD22 LEU A 65 1.340 54.431 -39.695 1.00 25.57 H new ATOM 0 HD23 LEU A 65 0.449 55.473 -38.902 1.00 25.57 H new ATOM 542 N HIS A 66 3.028 59.962 -40.469 1.00 23.84 N ATOM 543 CA HIS A 66 2.866 61.274 -39.922 1.00 25.17 C ATOM 544 C HIS A 66 3.007 62.261 -41.027 1.00 23.89 C ATOM 545 O HIS A 66 2.861 63.438 -40.798 1.00 22.25 O ATOM 546 CB HIS A 66 3.962 61.498 -38.861 1.00 26.29 C ATOM 547 CG HIS A 66 3.891 60.525 -37.731 1.00 28.12 C ATOM 548 ND1 HIS A 66 4.832 60.489 -36.722 1.00 29.59 N ATOM 549 CD2 HIS A 66 2.964 59.572 -37.427 1.00 31.93 C ATOM 550 CE1 HIS A 66 4.473 59.572 -35.827 1.00 33.03 C ATOM 551 NE2 HIS A 66 3.340 59.006 -36.225 1.00 32.37 N ATOM 0 H HIS A 66 3.819 59.632 -40.398 1.00 23.84 H new ATOM 0 HA HIS A 66 1.995 61.377 -39.508 1.00 25.17 H new ATOM 0 HB2 HIS A 66 4.832 61.431 -39.284 1.00 26.29 H new ATOM 0 HB3 HIS A 66 3.885 62.399 -38.510 1.00 26.29 H new ATOM 0 HD2 HIS A 66 2.218 59.346 -37.934 1.00 31.93 H new ATOM 0 HE1 HIS A 66 4.939 59.362 -35.050 1.00 33.03 H new ATOM 0 HE2 HIS A 66 2.912 58.390 -35.805 1.00 32.37 H new ATOM 552 N GLY A 67 3.325 61.779 -42.227 1.00 24.01 N ATOM 553 CA GLY A 67 3.501 62.706 -43.377 1.00 23.63 C ATOM 554 C GLY A 67 4.822 63.473 -43.331 1.00 24.33 C ATOM 555 O GLY A 67 5.001 64.431 -44.080 1.00 26.42 O ATOM 0 H GLY A 67 3.443 60.946 -42.406 1.00 24.01 H new ATOM 0 HA2 GLY A 67 3.455 62.200 -44.203 1.00 23.63 H new ATOM 0 HA3 GLY A 67 2.766 63.339 -43.391 1.00 23.63 H new ATOM 556 N ASP A 68 5.761 63.038 -42.488 1.00 22.95 N ATOM 557 CA ASP A 68 7.057 63.699 -42.229 1.00 23.60 C ATOM 558 C ASP A 68 8.047 63.402 -43.355 1.00 24.53 C ATOM 559 O ASP A 68 8.034 62.303 -43.881 1.00 27.16 O ATOM 560 CB ASP A 68 7.553 63.061 -40.960 1.00 22.71 C ATOM 561 CG ASP A 68 8.507 63.861 -40.210 1.00 25.51 C ATOM 562 OD1 ASP A 68 8.456 63.645 -38.963 1.00 29.31 O ATOM 563 OD2 ASP A 68 9.348 64.621 -40.785 1.00 27.16 O ATOM 0 H ASP A 68 5.661 62.318 -42.028 1.00 22.95 H new ATOM 0 HA ASP A 68 6.966 64.663 -42.167 1.00 23.60 H new ATOM 0 HB2 ASP A 68 6.792 62.869 -40.390 1.00 22.71 H new ATOM 0 HB3 ASP A 68 7.965 62.211 -41.180 1.00 22.71 H new ATOM 564 N THR A 69 8.939 64.325 -43.683 1.00 23.53 N ATOM 565 CA THR A 69 9.893 64.162 -44.793 1.00 22.88 C ATOM 566 C THR A 69 11.302 64.527 -44.302 1.00 22.98 C ATOM 567 O THR A 69 12.282 64.637 -45.089 1.00 23.40 O ATOM 568 CB THR A 69 9.583 65.180 -45.881 1.00 22.25 C ATOM 569 OG1 THR A 69 9.345 66.461 -45.230 1.00 23.01 O ATOM 570 CG2 THR A 69 8.355 64.817 -46.566 1.00 22.10 C ATOM 0 H THR A 69 9.015 65.075 -43.268 1.00 23.53 H new ATOM 0 HA THR A 69 9.834 63.249 -45.115 1.00 22.88 H new ATOM 0 HB THR A 69 10.319 65.216 -46.512 1.00 22.25 H new ATOM 0 HG1 THR A 69 9.970 66.991 -45.417 1.00 23.01 H new ATOM 0 HG21 THR A 69 8.165 65.470 -47.257 1.00 22.10 H new ATOM 0 HG22 THR A 69 8.456 63.940 -46.969 1.00 22.10 H new ATOM 0 HG23 THR A 69 7.623 64.797 -45.930 1.00 22.10 H new ATOM 571 N ASN A 70 11.395 64.761 -43.009 1.00 23.04 N ATOM 572 CA ASN A 70 12.642 65.106 -42.389 1.00 23.71 C ATOM 573 C ASN A 70 13.247 63.916 -41.649 1.00 24.71 C ATOM 574 O ASN A 70 12.639 63.347 -40.725 1.00 25.19 O ATOM 575 CB ASN A 70 12.500 66.323 -41.444 1.00 22.49 C ATOM 576 CG ASN A 70 13.841 66.954 -41.103 1.00 23.52 C ATOM 577 OD1 ASN A 70 14.679 66.346 -40.410 1.00 23.10 O ATOM 578 ND2 ASN A 70 14.085 68.153 -41.631 1.00 23.01 N ATOM 0 H ASN A 70 10.729 64.723 -42.466 1.00 23.04 H new ATOM 0 HA ASN A 70 13.249 65.357 -43.103 1.00 23.71 H new ATOM 0 HB2 ASN A 70 11.930 66.988 -41.861 1.00 22.49 H new ATOM 0 HB3 ASN A 70 12.060 66.044 -40.626 1.00 22.49 H new ATOM 0 HD21 ASN A 70 14.844 68.535 -41.498 1.00 23.01 H new ATOM 0 HD22 ASN A 70 13.484 68.545 -42.105 1.00 23.01 H new ATOM 579 N ILE A 71 14.487 63.599 -42.032 1.00 26.56 N ATOM 580 CA ILE A 71 15.312 62.506 -41.447 1.00 28.27 C ATOM 581 C ILE A 71 15.431 62.558 -39.915 1.00 29.14 C ATOM 582 O ILE A 71 15.648 61.517 -39.225 1.00 31.10 O ATOM 583 CB ILE A 71 16.694 62.554 -42.080 1.00 28.16 C ATOM 584 CG1 ILE A 71 16.724 61.624 -43.253 1.00 31.32 C ATOM 585 CG2 ILE A 71 17.806 62.192 -41.170 1.00 29.55 C ATOM 586 CD1 ILE A 71 16.625 62.382 -44.537 1.00 34.05 C ATOM 0 H ILE A 71 14.894 64.023 -42.660 1.00 26.56 H new ATOM 0 HA ILE A 71 14.860 61.670 -41.643 1.00 28.27 H new ATOM 0 HB ILE A 71 16.837 63.479 -42.335 1.00 28.16 H new ATOM 0 HG12 ILE A 71 17.545 61.108 -43.240 1.00 31.32 H new ATOM 0 HG13 ILE A 71 15.991 60.992 -43.189 1.00 31.32 H new ATOM 0 HG21 ILE A 71 18.648 62.248 -41.649 1.00 29.55 H new ATOM 0 HG22 ILE A 71 17.821 62.804 -40.418 1.00 29.55 H new ATOM 0 HG23 ILE A 71 17.678 61.287 -40.846 1.00 29.55 H new ATOM 0 HD11 ILE A 71 16.646 61.761 -45.282 1.00 34.05 H new ATOM 0 HD12 ILE A 71 15.793 62.880 -44.556 1.00 34.05 H new ATOM 0 HD13 ILE A 71 17.371 62.997 -44.608 1.00 34.05 H new ATOM 587 N ARG A 72 15.321 63.755 -39.349 1.00 27.99 N ATOM 588 CA ARG A 72 15.605 63.879 -37.941 1.00 26.44 C ATOM 589 C ARG A 72 14.741 62.881 -37.182 1.00 25.46 C ATOM 590 O ARG A 72 15.203 62.225 -36.264 1.00 26.53 O ATOM 591 CB ARG A 72 15.358 65.303 -37.480 1.00 26.47 C ATOM 592 CG ARG A 72 15.196 65.381 -35.983 1.00 28.30 C ATOM 593 CD ARG A 72 14.837 66.790 -35.548 1.00 34.68 C ATOM 594 NE ARG A 72 15.949 67.765 -35.698 1.00 38.75 N ATOM 595 CZ ARG A 72 15.970 68.929 -35.060 1.00 37.72 C ATOM 596 NH1 ARG A 72 16.986 69.780 -35.196 1.00 39.45 N ATOM 597 NH2 ARG A 72 14.949 69.199 -34.256 1.00 38.63 N ATOM 0 H ARG A 72 15.091 64.480 -39.751 1.00 27.99 H new ATOM 0 HA ARG A 72 16.538 63.680 -37.766 1.00 26.44 H new ATOM 0 HB2 ARG A 72 16.098 65.866 -37.756 1.00 26.47 H new ATOM 0 HB3 ARG A 72 14.561 65.650 -37.911 1.00 26.47 H new ATOM 0 HG2 ARG A 72 14.504 64.764 -35.697 1.00 28.30 H new ATOM 0 HG3 ARG A 72 16.019 65.105 -35.550 1.00 28.30 H new ATOM 0 HD2 ARG A 72 14.077 67.096 -36.067 1.00 34.68 H new ATOM 0 HD3 ARG A 72 14.557 66.772 -34.619 1.00 34.68 H new ATOM 0 HE ARG A 72 16.604 67.567 -36.218 1.00 38.75 H new ATOM 0 HH11 ARG A 72 17.649 69.580 -35.707 1.00 39.45 H new ATOM 0 HH12 ARG A 72 16.979 70.529 -34.773 1.00 39.45 H new ATOM 0 HH21 ARG A 72 14.310 68.630 -34.166 1.00 38.63 H new ATOM 0 HH22 ARG A 72 14.926 69.943 -33.825 1.00 38.63 H new ATOM 598 N PHE A 73 13.494 62.700 -37.591 1.00 24.01 N ATOM 599 CA PHE A 73 12.557 61.790 -36.780 1.00 23.80 C ATOM 600 C PHE A 73 13.121 60.405 -36.746 1.00 22.78 C ATOM 601 O PHE A 73 13.052 59.778 -35.747 1.00 22.78 O ATOM 602 CB PHE A 73 11.091 61.812 -37.301 1.00 21.03 C ATOM 603 CG PHE A 73 10.244 60.655 -36.816 1.00 21.19 C ATOM 604 CD1 PHE A 73 10.207 59.440 -37.539 1.00 17.08 C ATOM 605 CD2 PHE A 73 9.439 60.758 -35.658 1.00 14.65 C ATOM 606 CE1 PHE A 73 9.402 58.340 -37.121 1.00 15.19 C ATOM 607 CE2 PHE A 73 8.679 59.618 -35.207 1.00 15.36 C ATOM 608 CZ PHE A 73 8.645 58.427 -35.943 1.00 11.35 C ATOM 0 H PHE A 73 13.147 63.057 -38.293 1.00 24.01 H new ATOM 0 HA PHE A 73 12.509 62.135 -35.875 1.00 23.80 H new ATOM 0 HB2 PHE A 73 10.673 62.643 -37.027 1.00 21.03 H new ATOM 0 HB3 PHE A 73 11.103 61.807 -38.271 1.00 21.03 H new ATOM 0 HD1 PHE A 73 10.722 59.356 -38.309 1.00 17.08 H new ATOM 0 HD2 PHE A 73 9.400 61.559 -35.188 1.00 14.65 H new ATOM 0 HE1 PHE A 73 9.379 57.562 -37.631 1.00 15.19 H new ATOM 0 HE2 PHE A 73 8.202 59.675 -34.411 1.00 15.36 H new ATOM 0 HZ PHE A 73 8.130 57.707 -35.656 1.00 11.35 H new ATOM 609 N LEU A 74 13.711 59.980 -37.875 1.00 23.83 N ATOM 610 CA LEU A 74 14.367 58.657 -38.061 1.00 24.69 C ATOM 611 C LEU A 74 15.624 58.506 -37.200 1.00 25.17 C ATOM 612 O LEU A 74 15.733 57.512 -36.400 1.00 25.92 O ATOM 613 CB LEU A 74 14.739 58.444 -39.557 1.00 23.85 C ATOM 614 CG LEU A 74 13.536 58.363 -40.472 1.00 22.30 C ATOM 615 CD1 LEU A 74 13.924 58.064 -41.891 1.00 20.52 C ATOM 616 CD2 LEU A 74 12.597 57.344 -39.884 1.00 18.76 C ATOM 0 H LEU A 74 13.745 60.468 -38.583 1.00 23.83 H new ATOM 0 HA LEU A 74 13.729 57.983 -37.779 1.00 24.69 H new ATOM 0 HB2 LEU A 74 15.309 59.173 -39.848 1.00 23.85 H new ATOM 0 HB3 LEU A 74 15.256 57.628 -39.641 1.00 23.85 H new ATOM 0 HG LEU A 74 13.088 59.222 -40.524 1.00 22.30 H new ATOM 0 HD11 LEU A 74 13.127 58.021 -42.442 1.00 20.52 H new ATOM 0 HD12 LEU A 74 14.508 58.765 -42.222 1.00 20.52 H new ATOM 0 HD13 LEU A 74 14.388 57.213 -41.927 1.00 20.52 H new ATOM 0 HD21 LEU A 74 11.811 57.265 -40.447 1.00 18.76 H new ATOM 0 HD22 LEU A 74 13.044 56.485 -39.831 1.00 18.76 H new ATOM 0 HD23 LEU A 74 12.330 57.625 -38.995 1.00 18.76 H new ATOM 617 N LEU A 75 16.565 59.456 -37.356 1.00 24.87 N ATOM 618 CA LEU A 75 17.755 59.450 -36.519 1.00 25.86 C ATOM 619 C LEU A 75 17.405 59.382 -35.060 1.00 28.75 C ATOM 620 O LEU A 75 18.165 58.794 -34.304 1.00 31.05 O ATOM 621 CB LEU A 75 18.545 60.645 -36.690 1.00 22.46 C ATOM 622 CG LEU A 75 19.017 60.781 -38.099 1.00 25.47 C ATOM 623 CD1 LEU A 75 19.752 62.140 -38.127 1.00 22.16 C ATOM 624 CD2 LEU A 75 19.918 59.583 -38.628 1.00 19.94 C ATOM 0 H LEU A 75 16.526 60.095 -37.931 1.00 24.87 H new ATOM 0 HA LEU A 75 18.256 58.667 -36.795 1.00 25.86 H new ATOM 0 HB2 LEU A 75 18.018 61.422 -36.446 1.00 22.46 H new ATOM 0 HB3 LEU A 75 19.308 60.620 -36.091 1.00 22.46 H new ATOM 0 HG LEU A 75 18.266 60.745 -38.712 1.00 25.47 H new ATOM 0 HD11 LEU A 75 20.093 62.305 -39.020 1.00 22.16 H new ATOM 0 HD12 LEU A 75 19.135 62.847 -37.881 1.00 22.16 H new ATOM 0 HD13 LEU A 75 20.490 62.122 -37.497 1.00 22.16 H new ATOM 0 HD21 LEU A 75 20.178 59.754 -39.547 1.00 19.94 H new ATOM 0 HD22 LEU A 75 20.712 59.507 -38.077 1.00 19.94 H new ATOM 0 HD23 LEU A 75 19.414 58.755 -38.584 1.00 19.94 H new ATOM 625 N GLN A 76 16.262 59.921 -34.637 1.00 30.33 N ATOM 626 CA GLN A 76 15.910 59.805 -33.256 1.00 34.07 C ATOM 627 C GLN A 76 15.441 58.410 -32.852 1.00 34.06 C ATOM 628 O GLN A 76 14.948 58.244 -31.729 1.00 33.07 O ATOM 629 CB GLN A 76 14.803 60.790 -32.887 1.00 33.39 C ATOM 630 CG GLN A 76 15.074 62.268 -33.187 1.00 37.83 C ATOM 631 CD GLN A 76 13.760 63.076 -33.015 1.00 39.03 C ATOM 632 OE1 GLN A 76 13.597 64.225 -33.718 1.00 46.69 O flip ATOM 633 NE2 GLN A 76 12.895 62.636 -32.268 1.00 44.26 N flip ATOM 0 H GLN A 76 15.699 60.345 -35.131 1.00 30.33 H new ATOM 0 HA GLN A 76 16.730 60.001 -32.777 1.00 34.07 H new ATOM 0 HB2 GLN A 76 13.995 60.528 -33.356 1.00 33.39 H new ATOM 0 HB3 GLN A 76 14.622 60.701 -31.938 1.00 33.39 H new ATOM 0 HG2 GLN A 76 15.757 62.610 -32.589 1.00 37.83 H new ATOM 0 HG3 GLN A 76 15.412 62.369 -34.091 1.00 37.83 H new ATOM 0 HE21 GLN A 76 13.031 61.904 -31.837 1.00 44.26 H new ATOM 0 HE22 GLN A 76 12.152 63.059 -32.175 1.00 44.26 H new ATOM 634 N HIS A 77 15.464 57.453 -33.789 1.00 35.70 N ATOM 635 CA HIS A 77 15.097 56.045 -33.492 1.00 36.86 C ATOM 636 C HIS A 77 16.179 55.169 -34.061 1.00 38.00 C ATOM 637 O HIS A 77 16.027 53.957 -34.173 1.00 39.70 O ATOM 638 CB HIS A 77 13.715 55.664 -34.026 1.00 37.10 C ATOM 639 CG HIS A 77 12.609 56.499 -33.461 1.00 37.14 C ATOM 640 ND1 HIS A 77 12.323 57.771 -33.925 1.00 40.67 N ATOM 641 CD2 HIS A 77 11.758 56.276 -32.427 1.00 35.19 C ATOM 642 CE1 HIS A 77 11.330 58.284 -33.209 1.00 35.78 C ATOM 643 NE2 HIS A 77 10.995 57.410 -32.271 1.00 29.80 N ATOM 0 H HIS A 77 15.689 57.593 -34.607 1.00 35.70 H new ATOM 0 HA HIS A 77 15.032 55.924 -32.532 1.00 36.86 H new ATOM 0 HB2 HIS A 77 13.714 55.749 -34.992 1.00 37.10 H new ATOM 0 HB3 HIS A 77 13.543 54.731 -33.823 1.00 37.10 H new ATOM 0 HD1 HIS A 77 12.725 58.166 -34.574 1.00 40.67 H new ATOM 0 HD2 HIS A 77 11.701 55.500 -31.918 1.00 35.19 H new ATOM 0 HE1 HIS A 77 10.936 59.116 -33.343 1.00 35.78 H new ATOM 644 N ARG A 78 17.307 55.790 -34.397 1.00 37.77 N ATOM 645 CA ARG A 78 18.522 55.051 -34.720 1.00 38.79 C ATOM 646 C ARG A 78 18.131 54.382 -35.995 1.00 36.69 C ATOM 647 O ARG A 78 18.493 53.268 -36.267 1.00 38.01 O ATOM 648 CB ARG A 78 18.919 54.053 -33.595 1.00 38.20 C ATOM 649 CG ARG A 78 18.662 54.649 -32.165 1.00 42.21 C ATOM 650 CD ARG A 78 19.182 53.901 -30.915 1.00 44.73 C ATOM 651 NE ARG A 78 18.870 52.456 -30.931 1.00 58.81 N ATOM 652 CZ ARG A 78 19.774 51.452 -30.814 1.00 63.73 C ATOM 653 NH1 ARG A 78 19.367 50.166 -30.868 1.00 67.78 N ATOM 654 NH2 ARG A 78 21.076 51.705 -30.618 1.00 64.67 N ATOM 0 H ARG A 78 17.389 56.645 -34.444 1.00 37.77 H new ATOM 0 HA ARG A 78 19.316 55.602 -34.805 1.00 38.79 H new ATOM 0 HB2 ARG A 78 18.413 53.232 -33.698 1.00 38.20 H new ATOM 0 HB3 ARG A 78 19.857 53.822 -33.685 1.00 38.20 H new ATOM 0 HG2 ARG A 78 19.046 55.540 -32.150 1.00 42.21 H new ATOM 0 HG3 ARG A 78 17.703 54.752 -32.063 1.00 42.21 H new ATOM 0 HD2 ARG A 78 20.143 54.018 -30.851 1.00 44.73 H new ATOM 0 HD3 ARG A 78 18.794 54.301 -30.121 1.00 44.73 H new ATOM 0 HE ARG A 78 18.044 52.233 -31.022 1.00 58.81 H new ATOM 0 HH11 ARG A 78 18.534 49.983 -30.977 1.00 67.78 H new ATOM 0 HH12 ARG A 78 19.941 49.530 -30.794 1.00 67.78 H new ATOM 0 HH21 ARG A 78 21.353 52.517 -30.564 1.00 64.67 H new ATOM 0 HH22 ARG A 78 21.634 51.055 -30.546 1.00 64.67 H new ATOM 655 N ASN A 79 17.343 55.075 -36.784 1.00 34.68 N ATOM 656 CA ASN A 79 17.048 54.555 -38.063 1.00 32.48 C ATOM 657 C ASN A 79 17.782 55.282 -39.185 1.00 31.68 C ATOM 658 O ASN A 79 17.424 56.399 -39.556 1.00 30.97 O ATOM 659 CB ASN A 79 15.530 54.502 -38.269 1.00 32.18 C ATOM 660 CG ASN A 79 15.157 53.916 -39.600 1.00 28.18 C ATOM 661 OD1 ASN A 79 15.862 54.079 -40.593 1.00 29.08 O ATOM 662 ND2 ASN A 79 14.063 53.235 -39.629 1.00 26.08 N ATOM 0 H ASN A 79 16.982 55.831 -36.592 1.00 34.68 H new ATOM 0 HA ASN A 79 17.385 53.646 -38.103 1.00 32.48 H new ATOM 0 HB2 ASN A 79 15.128 53.975 -37.561 1.00 32.18 H new ATOM 0 HB3 ASN A 79 15.164 55.398 -38.198 1.00 32.18 H new ATOM 0 HD21 ASN A 79 13.801 52.873 -40.364 1.00 26.08 H new ATOM 0 HD22 ASN A 79 13.595 53.142 -38.913 1.00 26.08 H new ATOM 663 N HIS A 80 18.801 54.629 -39.755 1.00 31.82 N ATOM 664 CA HIS A 80 19.647 55.269 -40.797 1.00 30.03 C ATOM 665 C HIS A 80 19.288 55.000 -42.228 1.00 30.60 C ATOM 666 O HIS A 80 20.046 55.400 -43.095 1.00 31.59 O ATOM 667 CB HIS A 80 21.097 54.963 -40.559 1.00 28.75 C ATOM 668 CG HIS A 80 21.568 55.520 -39.287 1.00 23.49 C ATOM 669 ND1 HIS A 80 21.794 56.866 -39.131 1.00 25.50 N ATOM 670 CD2 HIS A 80 21.705 54.951 -38.060 1.00 24.37 C ATOM 671 CE1 HIS A 80 22.140 57.090 -37.864 1.00 30.07 C ATOM 672 NE2 HIS A 80 22.091 55.939 -37.191 1.00 27.37 N ATOM 0 H HIS A 80 19.025 53.822 -39.560 1.00 31.82 H new ATOM 0 HA HIS A 80 19.464 56.215 -40.687 1.00 30.03 H new ATOM 0 HB2 HIS A 80 21.230 54.002 -40.560 1.00 28.75 H new ATOM 0 HB3 HIS A 80 21.628 55.324 -41.287 1.00 28.75 H new ATOM 0 HD1 HIS A 80 21.724 57.463 -39.746 1.00 25.50 H new ATOM 0 HD2 HIS A 80 21.563 54.056 -37.849 1.00 24.37 H new ATOM 0 HE1 HIS A 80 22.377 57.915 -37.507 1.00 30.07 H new ATOM 673 N ILE A 81 18.135 54.356 -42.480 1.00 31.34 N ATOM 674 CA ILE A 81 17.741 53.966 -43.868 1.00 31.87 C ATOM 675 C ILE A 81 17.849 55.047 -44.907 1.00 31.09 C ATOM 676 O ILE A 81 17.939 54.752 -46.088 1.00 32.34 O ATOM 677 CB ILE A 81 16.252 53.382 -44.017 1.00 32.21 C ATOM 678 CG1 ILE A 81 15.990 52.202 -43.116 1.00 30.72 C ATOM 679 CG2 ILE A 81 16.021 52.846 -45.392 1.00 32.62 C ATOM 680 CD1 ILE A 81 17.283 51.585 -42.691 1.00 31.23 C ATOM 0 H ILE A 81 17.567 54.134 -41.874 1.00 31.34 H new ATOM 0 HA ILE A 81 18.403 53.276 -44.030 1.00 31.87 H new ATOM 0 HB ILE A 81 15.676 54.131 -43.796 1.00 32.21 H new ATOM 0 HG12 ILE A 81 15.487 52.486 -42.337 1.00 30.72 H new ATOM 0 HG13 ILE A 81 15.447 51.546 -43.580 1.00 30.72 H new ATOM 0 HG21 ILE A 81 15.117 52.500 -45.457 1.00 32.62 H new ATOM 0 HG22 ILE A 81 16.142 53.557 -46.041 1.00 32.62 H new ATOM 0 HG23 ILE A 81 16.654 52.133 -45.572 1.00 32.62 H new ATOM 0 HD11 ILE A 81 17.105 50.827 -42.112 1.00 31.23 H new ATOM 0 HD12 ILE A 81 17.772 51.286 -43.474 1.00 31.23 H new ATOM 0 HD13 ILE A 81 17.812 52.241 -42.211 1.00 31.23 H new ATOM 681 N TRP A 82 17.748 56.293 -44.493 1.00 29.47 N ATOM 682 CA TRP A 82 17.583 57.354 -45.465 1.00 28.03 C ATOM 683 C TRP A 82 18.683 58.415 -45.444 1.00 29.15 C ATOM 684 O TRP A 82 18.729 59.256 -46.348 1.00 27.64 O ATOM 685 CB TRP A 82 16.208 57.993 -45.296 1.00 24.83 C ATOM 686 CG TRP A 82 14.996 57.158 -45.755 1.00 21.61 C ATOM 687 CD1 TRP A 82 14.156 56.372 -44.969 1.00 17.06 C ATOM 688 CD2 TRP A 82 14.404 57.157 -47.065 1.00 16.17 C ATOM 689 NE1 TRP A 82 13.149 55.844 -45.747 1.00 12.84 N ATOM 690 CE2 TRP A 82 13.263 56.344 -47.018 1.00 15.82 C ATOM 691 CE3 TRP A 82 14.743 57.752 -48.275 1.00 22.19 C ATOM 692 CZ2 TRP A 82 12.500 56.072 -48.155 1.00 20.61 C ATOM 693 CZ3 TRP A 82 13.927 57.503 -49.438 1.00 19.90 C ATOM 694 CH2 TRP A 82 12.849 56.671 -49.345 1.00 20.32 C ATOM 0 H TRP A 82 17.772 56.545 -43.671 1.00 29.47 H new ATOM 0 HA TRP A 82 17.657 56.937 -46.338 1.00 28.03 H new ATOM 0 HB2 TRP A 82 16.088 58.211 -44.358 1.00 24.83 H new ATOM 0 HB3 TRP A 82 16.201 58.831 -45.785 1.00 24.83 H new ATOM 0 HD1 TRP A 82 14.259 56.226 -44.056 1.00 17.06 H new ATOM 0 HE1 TRP A 82 12.547 55.291 -45.479 1.00 12.84 H new ATOM 0 HE3 TRP A 82 15.488 58.305 -48.334 1.00 22.19 H new ATOM 0 HZ2 TRP A 82 11.770 55.497 -48.110 1.00 20.61 H new ATOM 0 HZ3 TRP A 82 14.135 57.908 -50.249 1.00 19.90 H new ATOM 0 HH2 TRP A 82 12.338 56.505 -50.104 1.00 20.32 H new ATOM 695 N ASP A 83 19.586 58.347 -44.461 1.00 30.86 N ATOM 696 CA ASP A 83 20.754 59.232 -44.383 1.00 33.70 C ATOM 697 C ASP A 83 21.424 59.523 -45.711 1.00 37.28 C ATOM 698 O ASP A 83 21.789 60.666 -45.964 1.00 38.35 O ATOM 699 CB ASP A 83 21.806 58.726 -43.388 1.00 32.43 C ATOM 700 CG ASP A 83 21.255 58.513 -41.985 1.00 33.16 C ATOM 701 OD1 ASP A 83 22.041 58.384 -41.034 1.00 30.52 O ATOM 702 OD2 ASP A 83 20.023 58.450 -41.822 1.00 35.81 O ATOM 0 H ASP A 83 19.537 57.781 -43.815 1.00 30.86 H new ATOM 0 HA ASP A 83 20.379 60.069 -44.066 1.00 33.70 H new ATOM 0 HB2 ASP A 83 22.175 57.890 -43.714 1.00 32.43 H new ATOM 0 HB3 ASP A 83 22.537 59.362 -43.348 1.00 32.43 H new ATOM 703 N GLU A 84 21.601 58.513 -46.557 1.00 41.09 N ATOM 704 CA GLU A 84 22.381 58.675 -47.775 1.00 45.89 C ATOM 705 C GLU A 84 21.910 59.879 -48.574 1.00 46.52 C ATOM 706 O GLU A 84 22.691 60.789 -48.843 1.00 46.61 O ATOM 707 CB GLU A 84 22.229 57.434 -48.646 1.00 48.55 C ATOM 708 CG GLU A 84 22.894 56.139 -48.116 1.00 56.72 C ATOM 709 CD GLU A 84 24.257 55.872 -48.831 1.00 67.74 C ATOM 710 OE1 GLU A 84 25.274 55.674 -48.107 1.00 70.84 O ATOM 711 OE2 GLU A 84 24.314 55.877 -50.114 1.00 70.34 O ATOM 0 H GLU A 84 21.276 57.725 -46.442 1.00 41.09 H new ATOM 0 HA GLU A 84 23.308 58.806 -47.520 1.00 45.89 H new ATOM 0 HB2 GLU A 84 21.282 57.262 -48.769 1.00 48.55 H new ATOM 0 HB3 GLU A 84 22.598 57.629 -49.522 1.00 48.55 H new ATOM 0 HG2 GLU A 84 23.037 56.214 -47.159 1.00 56.72 H new ATOM 0 HG3 GLU A 84 22.299 55.386 -48.256 1.00 56.72 H new ATOM 712 N TRP A 85 20.605 59.901 -48.867 1.00 48.21 N ATOM 713 CA TRP A 85 19.982 60.831 -49.800 1.00 49.48 C ATOM 714 C TRP A 85 20.004 62.234 -49.267 1.00 50.50 C ATOM 715 O TRP A 85 20.161 63.164 -50.060 1.00 51.41 O ATOM 716 CB TRP A 85 18.544 60.440 -50.109 1.00 50.60 C ATOM 717 CG TRP A 85 18.363 59.038 -50.584 1.00 51.39 C ATOM 718 CD1 TRP A 85 17.971 57.946 -49.821 1.00 53.74 C ATOM 719 CD2 TRP A 85 18.567 58.537 -51.920 1.00 52.39 C ATOM 720 NE1 TRP A 85 17.923 56.797 -50.609 1.00 54.43 N ATOM 721 CE2 TRP A 85 18.277 57.131 -51.898 1.00 52.72 C ATOM 722 CE3 TRP A 85 18.976 59.128 -53.135 1.00 55.19 C ATOM 723 CZ2 TRP A 85 18.364 56.310 -53.060 1.00 52.93 C ATOM 724 CZ3 TRP A 85 19.075 58.292 -54.321 1.00 54.54 C ATOM 725 CH2 TRP A 85 18.782 56.897 -54.250 1.00 53.58 C ATOM 0 H TRP A 85 20.044 59.354 -48.513 1.00 48.21 H new ATOM 0 HA TRP A 85 20.501 60.790 -50.618 1.00 49.48 H new ATOM 0 HB2 TRP A 85 18.009 60.569 -49.310 1.00 50.60 H new ATOM 0 HB3 TRP A 85 18.196 61.044 -50.784 1.00 50.60 H new ATOM 0 HD1 TRP A 85 17.769 57.977 -48.914 1.00 53.74 H new ATOM 0 HE1 TRP A 85 17.708 56.010 -50.336 1.00 54.43 H new ATOM 0 HE3 TRP A 85 19.178 60.035 -53.176 1.00 55.19 H new ATOM 0 HZ2 TRP A 85 18.147 55.406 -53.024 1.00 52.93 H new ATOM 0 HZ3 TRP A 85 19.331 58.669 -55.132 1.00 54.54 H new ATOM 0 HH2 TRP A 85 18.872 56.372 -55.012 1.00 53.58 H new ATOM 726 N ALA A 86 19.855 62.390 -47.945 1.00 51.10 N ATOM 727 CA ALA A 86 19.972 63.690 -47.249 1.00 51.47 C ATOM 728 C ALA A 86 21.352 64.234 -47.322 1.00 52.48 C ATOM 729 O ALA A 86 21.536 65.377 -47.685 1.00 53.18 O ATOM 730 CB ALA A 86 19.606 63.559 -45.788 1.00 50.77 C ATOM 0 H ALA A 86 19.680 61.735 -47.416 1.00 51.10 H new ATOM 0 HA ALA A 86 19.360 64.293 -47.699 1.00 51.47 H new ATOM 0 HB1 ALA A 86 19.690 64.423 -45.354 1.00 50.77 H new ATOM 0 HB2 ALA A 86 18.691 63.247 -45.710 1.00 50.77 H new ATOM 0 HB3 ALA A 86 20.202 62.924 -45.361 1.00 50.77 H new ATOM 731 N PHE A 87 22.313 63.414 -46.904 1.00 54.42 N ATOM 732 CA PHE A 87 23.745 63.743 -46.817 1.00 55.99 C ATOM 733 C PHE A 87 24.288 64.071 -48.206 1.00 57.07 C ATOM 734 O PHE A 87 25.113 64.957 -48.395 1.00 56.65 O ATOM 735 CB PHE A 87 24.433 62.539 -46.178 1.00 55.89 C ATOM 736 CG PHE A 87 25.950 62.577 -46.136 1.00 58.08 C ATOM 737 CD1 PHE A 87 26.725 62.317 -47.283 1.00 59.39 C ATOM 738 CD2 PHE A 87 26.623 62.733 -44.918 1.00 59.12 C ATOM 739 CE1 PHE A 87 28.139 62.296 -47.221 1.00 57.54 C ATOM 740 CE2 PHE A 87 28.042 62.708 -44.853 1.00 58.28 C ATOM 741 CZ PHE A 87 28.785 62.495 -46.009 1.00 57.33 C ATOM 0 H PHE A 87 22.145 62.610 -46.650 1.00 54.42 H new ATOM 0 HA PHE A 87 23.910 64.530 -46.274 1.00 55.99 H new ATOM 0 HB2 PHE A 87 24.105 62.447 -45.270 1.00 55.89 H new ATOM 0 HB3 PHE A 87 24.161 61.742 -46.659 1.00 55.89 H new ATOM 0 HD1 PHE A 87 26.301 62.156 -48.095 1.00 59.39 H new ATOM 0 HD2 PHE A 87 26.132 62.855 -44.138 1.00 59.12 H new ATOM 0 HE1 PHE A 87 28.636 62.149 -47.993 1.00 57.54 H new ATOM 0 HE2 PHE A 87 28.473 62.834 -44.039 1.00 58.28 H new ATOM 0 HZ PHE A 87 29.714 62.486 -45.970 1.00 57.33 H new ATOM 742 N GLU A 88 23.791 63.371 -49.198 1.00 59.25 N ATOM 743 CA GLU A 88 24.227 63.645 -50.519 1.00 62.02 C ATOM 744 C GLU A 88 24.003 65.106 -50.817 1.00 63.36 C ATOM 745 O GLU A 88 24.821 65.720 -51.473 1.00 64.10 O ATOM 746 CB GLU A 88 23.461 62.791 -51.481 1.00 62.05 C ATOM 747 CG GLU A 88 23.864 63.024 -52.895 1.00 67.68 C ATOM 748 CD GLU A 88 22.679 62.830 -53.816 1.00 75.91 C ATOM 749 OE1 GLU A 88 22.415 61.655 -54.187 1.00 78.29 O ATOM 750 OE2 GLU A 88 21.996 63.849 -54.144 1.00 78.75 O ATOM 0 H GLU A 88 23.209 62.743 -49.121 1.00 59.25 H new ATOM 0 HA GLU A 88 25.172 63.445 -50.608 1.00 62.02 H new ATOM 0 HB2 GLU A 88 23.597 61.857 -51.259 1.00 62.05 H new ATOM 0 HB3 GLU A 88 22.513 62.971 -51.384 1.00 62.05 H new ATOM 0 HG2 GLU A 88 24.215 63.923 -52.994 1.00 67.68 H new ATOM 0 HG3 GLU A 88 24.576 62.413 -53.140 1.00 67.68 H new ATOM 751 N LYS A 89 22.916 65.665 -50.285 1.00 65.34 N ATOM 752 CA LYS A 89 22.462 67.035 -50.601 1.00 67.07 C ATOM 753 C LYS A 89 23.425 68.013 -50.032 1.00 67.45 C ATOM 754 O LYS A 89 23.873 68.933 -50.705 1.00 67.35 O ATOM 755 CB LYS A 89 21.106 67.336 -49.965 1.00 67.28 C ATOM 756 CG LYS A 89 19.915 67.108 -50.848 1.00 69.58 C ATOM 757 CD LYS A 89 18.656 67.663 -50.177 1.00 73.39 C ATOM 758 CE LYS A 89 18.696 69.190 -50.082 1.00 73.07 C ATOM 759 NZ LYS A 89 17.343 69.698 -49.708 1.00 73.09 N ATOM 0 H LYS A 89 22.410 65.258 -49.721 1.00 65.34 H new ATOM 0 HA LYS A 89 22.397 67.104 -51.566 1.00 67.07 H new ATOM 0 HB2 LYS A 89 21.010 66.788 -49.170 1.00 67.28 H new ATOM 0 HB3 LYS A 89 21.101 68.261 -49.674 1.00 67.28 H new ATOM 0 HG2 LYS A 89 20.051 67.540 -51.706 1.00 69.58 H new ATOM 0 HG3 LYS A 89 19.808 66.160 -51.021 1.00 69.58 H new ATOM 0 HD2 LYS A 89 17.873 67.390 -50.680 1.00 73.39 H new ATOM 0 HD3 LYS A 89 18.569 67.285 -49.288 1.00 73.39 H new ATOM 0 HE2 LYS A 89 19.350 69.466 -49.421 1.00 73.07 H new ATOM 0 HE3 LYS A 89 18.972 69.570 -50.931 1.00 73.07 H new ATOM 0 HZ1 LYS A 89 17.364 70.586 -49.652 1.00 73.09 H new ATOM 0 HZ2 LYS A 89 16.752 69.454 -50.327 1.00 73.09 H new ATOM 0 HZ3 LYS A 89 17.105 69.357 -48.921 1.00 73.09 H new ATOM 760 N TRP A 90 23.666 67.801 -48.748 1.00 68.20 N ATOM 761 CA TRP A 90 24.668 68.459 -47.976 1.00 69.34 C ATOM 762 C TRP A 90 25.953 68.599 -48.765 1.00 71.14 C ATOM 763 O TRP A 90 26.511 69.708 -48.892 1.00 71.75 O ATOM 764 CB TRP A 90 24.913 67.569 -46.779 1.00 69.01 C ATOM 765 CG TRP A 90 25.965 67.973 -45.805 1.00 68.30 C ATOM 766 CD1 TRP A 90 26.748 67.137 -45.096 1.00 67.91 C ATOM 767 CD2 TRP A 90 26.313 69.296 -45.395 1.00 67.73 C ATOM 768 NE1 TRP A 90 27.566 67.839 -44.262 1.00 68.88 N ATOM 769 CE2 TRP A 90 27.322 69.173 -44.427 1.00 68.16 C ATOM 770 CE3 TRP A 90 25.874 70.574 -45.758 1.00 67.71 C ATOM 771 CZ2 TRP A 90 27.905 70.274 -43.808 1.00 67.95 C ATOM 772 CZ3 TRP A 90 26.449 71.663 -45.150 1.00 68.83 C ATOM 773 CH2 TRP A 90 27.462 71.508 -44.179 1.00 67.89 C ATOM 0 H TRP A 90 23.215 67.232 -48.288 1.00 68.20 H new ATOM 0 HA TRP A 90 24.381 69.351 -47.724 1.00 69.34 H new ATOM 0 HB2 TRP A 90 24.077 67.487 -46.295 1.00 69.01 H new ATOM 0 HB3 TRP A 90 25.138 66.685 -47.108 1.00 69.01 H new ATOM 0 HD1 TRP A 90 26.733 66.210 -45.166 1.00 67.91 H new ATOM 0 HE1 TRP A 90 28.141 67.498 -43.721 1.00 68.88 H new ATOM 0 HE3 TRP A 90 25.207 70.684 -46.397 1.00 67.71 H new ATOM 0 HZ2 TRP A 90 28.571 70.172 -43.167 1.00 67.95 H new ATOM 0 HZ3 TRP A 90 26.166 72.518 -45.382 1.00 68.83 H new ATOM 0 HH2 TRP A 90 27.834 72.263 -43.785 1.00 67.89 H new ATOM 774 N VAL A 91 26.390 67.464 -49.321 1.00 72.42 N ATOM 775 CA VAL A 91 27.718 67.290 -49.920 1.00 73.00 C ATOM 776 C VAL A 91 27.995 68.162 -51.154 1.00 74.10 C ATOM 777 O VAL A 91 29.146 68.522 -51.431 1.00 74.65 O ATOM 778 CB VAL A 91 27.953 65.787 -50.137 1.00 72.57 C ATOM 779 CG1 VAL A 91 28.584 65.451 -51.503 1.00 71.93 C ATOM 780 CG2 VAL A 91 28.726 65.271 -48.961 1.00 72.03 C ATOM 0 H VAL A 91 25.907 66.754 -49.361 1.00 72.42 H new ATOM 0 HA VAL A 91 28.381 67.628 -49.298 1.00 73.00 H new ATOM 0 HB VAL A 91 27.100 65.327 -50.181 1.00 72.57 H new ATOM 0 HG11 VAL A 91 28.705 64.491 -51.576 1.00 71.93 H new ATOM 0 HG12 VAL A 91 28.000 65.758 -52.214 1.00 71.93 H new ATOM 0 HG13 VAL A 91 29.445 65.892 -51.579 1.00 71.93 H new ATOM 0 HG21 VAL A 91 28.889 64.321 -49.072 1.00 72.03 H new ATOM 0 HG22 VAL A 91 29.573 65.739 -48.900 1.00 72.03 H new ATOM 0 HG23 VAL A 91 28.217 65.418 -48.149 1.00 72.03 H new ATOM 781 N LYS A 92 26.933 68.533 -51.853 1.00 75.10 N ATOM 782 CA LYS A 92 27.031 69.382 -53.017 1.00 76.84 C ATOM 783 C LYS A 92 26.618 70.840 -52.742 1.00 77.48 C ATOM 784 O LYS A 92 26.359 71.615 -53.668 1.00 77.97 O ATOM 785 CB LYS A 92 26.192 68.779 -54.127 1.00 77.01 C ATOM 786 CG LYS A 92 26.780 67.475 -54.670 1.00 80.57 C ATOM 787 CD LYS A 92 25.724 66.373 -54.873 1.00 86.03 C ATOM 788 CE LYS A 92 24.275 66.936 -55.047 1.00 88.84 C ATOM 789 NZ LYS A 92 24.109 68.013 -56.096 1.00 91.04 N ATOM 0 H LYS A 92 26.130 68.295 -51.660 1.00 75.10 H new ATOM 0 HA LYS A 92 27.963 69.423 -53.282 1.00 76.84 H new ATOM 0 HB2 LYS A 92 25.296 68.612 -53.796 1.00 77.01 H new ATOM 0 HB3 LYS A 92 26.112 69.419 -54.851 1.00 77.01 H new ATOM 0 HG2 LYS A 92 27.220 67.653 -55.516 1.00 80.57 H new ATOM 0 HG3 LYS A 92 27.461 67.154 -54.058 1.00 80.57 H new ATOM 0 HD2 LYS A 92 25.958 65.849 -55.655 1.00 86.03 H new ATOM 0 HD3 LYS A 92 25.742 65.771 -54.112 1.00 86.03 H new ATOM 0 HE2 LYS A 92 23.684 66.199 -55.268 1.00 88.84 H new ATOM 0 HE3 LYS A 92 23.979 67.291 -54.194 1.00 88.84 H new ATOM 0 HZ1 LYS A 92 24.003 68.802 -55.698 1.00 91.04 H new ATOM 0 HZ2 LYS A 92 24.832 68.037 -56.614 1.00 91.04 H new ATOM 0 HZ3 LYS A 92 23.393 67.835 -56.594 1.00 91.04 H new ATOM 790 N SER A 93 26.575 71.223 -51.473 1.00 78.06 N ATOM 791 CA SER A 93 26.165 72.561 -51.127 1.00 78.31 C ATOM 792 C SER A 93 27.385 73.384 -50.881 1.00 79.30 C ATOM 793 O SER A 93 28.488 72.879 -50.668 1.00 78.88 O ATOM 794 CB SER A 93 25.283 72.576 -49.879 1.00 78.38 C ATOM 795 OG SER A 93 26.067 72.646 -48.702 1.00 76.49 O ATOM 0 H SER A 93 26.779 70.722 -50.805 1.00 78.06 H new ATOM 0 HA SER A 93 25.645 72.924 -51.861 1.00 78.31 H new ATOM 0 HB2 SER A 93 24.680 73.335 -49.915 1.00 78.38 H new ATOM 0 HB3 SER A 93 24.733 71.777 -49.858 1.00 78.38 H new ATOM 0 HG SER A 93 26.348 71.879 -48.506 1.00 76.49 H new ATOM 796 N ASP A 94 27.130 74.678 -50.884 1.00 80.79 N ATOM 797 CA ASP A 94 28.115 75.702 -50.698 1.00 81.87 C ATOM 798 C ASP A 94 28.576 75.779 -49.281 1.00 81.61 C ATOM 799 O ASP A 94 29.712 76.163 -49.039 1.00 82.81 O ATOM 800 CB ASP A 94 27.506 77.010 -51.105 1.00 82.43 C ATOM 801 CG ASP A 94 26.912 76.917 -52.465 1.00 86.42 C ATOM 802 OD1 ASP A 94 25.890 76.179 -52.610 1.00 91.20 O ATOM 803 OD2 ASP A 94 27.495 77.526 -53.399 1.00 90.14 O ATOM 0 H ASP A 94 26.338 74.991 -51.001 1.00 80.79 H new ATOM 0 HA ASP A 94 28.892 75.495 -51.241 1.00 81.87 H new ATOM 0 HB2 ASP A 94 26.822 77.266 -50.466 1.00 82.43 H new ATOM 0 HB3 ASP A 94 28.183 77.705 -51.090 1.00 82.43 H new ATOM 804 N GLU A 95 27.728 75.402 -48.342 1.00 80.56 N ATOM 805 CA GLU A 95 28.137 75.457 -46.961 1.00 80.18 C ATOM 806 C GLU A 95 29.038 74.281 -46.564 1.00 79.98 C ATOM 807 O GLU A 95 29.464 74.162 -45.400 1.00 79.32 O ATOM 808 CB GLU A 95 26.917 75.539 -46.071 1.00 80.43 C ATOM 809 CG GLU A 95 26.183 76.848 -46.185 1.00 81.03 C ATOM 810 CD GLU A 95 24.724 76.722 -45.792 1.00 82.42 C ATOM 811 OE1 GLU A 95 23.864 77.313 -46.494 1.00 83.22 O ATOM 812 OE2 GLU A 95 24.431 76.025 -44.791 1.00 83.19 O ATOM 0 H GLU A 95 26.928 75.117 -48.481 1.00 80.56 H new ATOM 0 HA GLU A 95 28.673 76.257 -46.843 1.00 80.18 H new ATOM 0 HB2 GLU A 95 26.311 74.815 -46.296 1.00 80.43 H new ATOM 0 HB3 GLU A 95 27.188 75.406 -45.149 1.00 80.43 H new ATOM 0 HG2 GLU A 95 26.613 77.508 -45.619 1.00 81.03 H new ATOM 0 HG3 GLU A 95 26.244 77.173 -47.097 1.00 81.03 H new ATOM 813 N TYR A 96 29.340 73.430 -47.546 1.00 79.91 N ATOM 814 CA TYR A 96 30.112 72.217 -47.301 1.00 79.91 C ATOM 815 C TYR A 96 31.607 72.437 -47.440 1.00 80.64 C ATOM 816 O TYR A 96 32.084 72.668 -48.553 1.00 81.47 O ATOM 817 CB TYR A 96 29.681 71.058 -48.230 1.00 78.83 C ATOM 818 CG TYR A 96 30.483 69.794 -47.944 1.00 77.89 C ATOM 819 CD1 TYR A 96 31.143 69.102 -48.967 1.00 78.03 C ATOM 820 CD2 TYR A 96 30.619 69.316 -46.623 1.00 75.75 C ATOM 821 CE1 TYR A 96 31.910 67.960 -48.677 1.00 76.81 C ATOM 822 CE2 TYR A 96 31.370 68.199 -46.326 1.00 74.83 C ATOM 823 CZ TYR A 96 32.020 67.525 -47.347 1.00 76.41 C ATOM 824 OH TYR A 96 32.773 66.418 -47.031 1.00 76.40 O ATOM 0 H TYR A 96 29.104 73.541 -48.366 1.00 79.91 H new ATOM 0 HA TYR A 96 29.923 71.974 -46.381 1.00 79.91 H new ATOM 0 HB2 TYR A 96 28.735 70.878 -48.109 1.00 78.83 H new ATOM 0 HB3 TYR A 96 29.804 71.320 -49.156 1.00 78.83 H new ATOM 0 HD1 TYR A 96 31.073 69.400 -49.845 1.00 78.03 H new ATOM 0 HD2 TYR A 96 30.189 69.768 -45.933 1.00 75.75 H new ATOM 0 HE1 TYR A 96 32.340 67.497 -49.360 1.00 76.81 H new ATOM 0 HE2 TYR A 96 31.440 67.900 -45.448 1.00 74.83 H new ATOM 0 HH TYR A 96 33.293 66.242 -47.666 1.00 76.40 H new ATOM 825 N HIS A 97 32.360 72.340 -46.346 1.00 81.16 N ATOM 826 CA HIS A 97 33.821 72.421 -46.493 1.00 82.17 C ATOM 827 C HIS A 97 34.528 71.202 -45.961 1.00 82.23 C ATOM 828 O HIS A 97 34.807 71.118 -44.778 1.00 82.83 O ATOM 829 CB HIS A 97 34.372 73.728 -45.905 1.00 82.29 C ATOM 830 CG HIS A 97 33.747 74.932 -46.525 1.00 84.31 C ATOM 831 ND1 HIS A 97 33.827 75.189 -47.880 1.00 86.58 N ATOM 832 CD2 HIS A 97 32.945 75.892 -46.006 1.00 86.32 C ATOM 833 CE1 HIS A 97 33.131 76.277 -48.163 1.00 87.24 C ATOM 834 NE2 HIS A 97 32.586 76.724 -47.043 1.00 87.51 N ATOM 0 H HIS A 97 32.068 72.232 -45.544 1.00 81.16 H new ATOM 0 HA HIS A 97 34.009 72.436 -47.444 1.00 82.17 H new ATOM 0 HB2 HIS A 97 34.216 73.741 -44.948 1.00 82.29 H new ATOM 0 HB3 HIS A 97 35.333 73.760 -46.036 1.00 82.29 H new ATOM 0 HD2 HIS A 97 32.686 75.974 -45.117 1.00 86.32 H new ATOM 0 HE1 HIS A 97 33.040 76.662 -49.005 1.00 87.24 H new ATOM 0 HE2 HIS A 97 32.088 77.422 -46.974 1.00 87.51 H new ATOM 835 N GLY A 98 34.812 70.249 -46.832 1.00 81.81 N ATOM 836 CA GLY A 98 35.355 68.998 -46.357 1.00 81.78 C ATOM 837 C GLY A 98 35.839 68.194 -47.533 1.00 82.21 C ATOM 838 O GLY A 98 35.801 68.701 -48.671 1.00 82.03 O ATOM 0 H GLY A 98 34.700 70.306 -47.683 1.00 81.81 H new ATOM 0 HA2 GLY A 98 36.086 69.163 -45.741 1.00 81.78 H new ATOM 0 HA3 GLY A 98 34.678 68.503 -45.869 1.00 81.78 H new ATOM 839 N PRO A 99 36.291 66.937 -47.269 1.00 82.33 N ATOM 840 CA PRO A 99 36.791 65.987 -48.280 1.00 82.72 C ATOM 841 C PRO A 99 35.733 65.855 -49.366 1.00 83.69 C ATOM 842 O PRO A 99 34.570 65.752 -49.023 1.00 83.99 O ATOM 843 CB PRO A 99 36.910 64.688 -47.494 1.00 82.62 C ATOM 844 CG PRO A 99 37.078 65.124 -46.049 1.00 81.78 C ATOM 845 CD PRO A 99 36.301 66.370 -45.902 1.00 81.89 C ATOM 0 HA PRO A 99 37.624 66.244 -48.705 1.00 82.72 H new ATOM 0 HB2 PRO A 99 36.121 64.135 -47.606 1.00 82.62 H new ATOM 0 HB3 PRO A 99 37.669 64.163 -47.794 1.00 82.62 H new ATOM 0 HG2 PRO A 99 36.755 64.441 -45.441 1.00 81.78 H new ATOM 0 HG3 PRO A 99 38.013 65.272 -45.838 1.00 81.78 H new ATOM 0 HD2 PRO A 99 35.402 66.194 -45.582 1.00 81.89 H new ATOM 0 HD3 PRO A 99 36.715 66.976 -45.267 1.00 81.89 H new ATOM 846 N ASP A 100 36.102 65.887 -50.647 1.00 84.84 N ATOM 847 CA ASP A 100 35.113 66.121 -51.729 1.00 86.25 C ATOM 848 C ASP A 100 33.983 65.066 -51.878 1.00 87.19 C ATOM 849 O ASP A 100 32.939 65.351 -52.512 1.00 87.77 O ATOM 850 CB ASP A 100 35.799 66.288 -53.079 1.00 86.44 C ATOM 851 CG ASP A 100 36.264 64.957 -53.650 1.00 88.09 C ATOM 852 OD1 ASP A 100 36.869 64.176 -52.871 1.00 90.15 O ATOM 853 OD2 ASP A 100 36.020 64.687 -54.859 1.00 90.17 O ATOM 0 H ASP A 100 36.910 65.778 -50.919 1.00 84.84 H new ATOM 0 HA ASP A 100 34.676 66.939 -51.444 1.00 86.25 H new ATOM 0 HB2 ASP A 100 35.187 66.710 -53.702 1.00 86.44 H new ATOM 0 HB3 ASP A 100 36.560 66.882 -52.983 1.00 86.44 H new ATOM 854 N MET A 101 34.192 63.855 -51.339 1.00 87.30 N ATOM 855 CA MET A 101 33.116 62.851 -51.200 1.00 87.17 C ATOM 856 C MET A 101 32.331 62.611 -52.472 1.00 88.16 C ATOM 857 O MET A 101 31.161 62.254 -52.408 1.00 88.70 O ATOM 858 CB MET A 101 32.131 63.238 -50.090 1.00 86.29 C ATOM 859 CG MET A 101 32.730 63.303 -48.709 1.00 84.65 C ATOM 860 SD MET A 101 32.625 61.710 -47.919 1.00 83.16 S ATOM 861 CE MET A 101 33.697 61.895 -46.503 1.00 84.76 C ATOM 0 H MET A 101 34.956 63.592 -51.045 1.00 87.30 H new ATOM 0 HA MET A 101 33.577 62.028 -50.976 1.00 87.17 H new ATOM 0 HB2 MET A 101 31.746 64.103 -50.303 1.00 86.29 H new ATOM 0 HB3 MET A 101 31.403 62.597 -50.083 1.00 86.29 H new ATOM 0 HG2 MET A 101 33.657 63.584 -48.764 1.00 84.65 H new ATOM 0 HG3 MET A 101 32.263 63.967 -48.177 1.00 84.65 H new ATOM 0 HE1 MET A 101 34.253 61.105 -46.413 1.00 84.76 H new ATOM 0 HE2 MET A 101 34.261 62.675 -46.623 1.00 84.76 H new ATOM 0 HE3 MET A 101 33.160 62.005 -45.703 1.00 84.76 H new ATOM 862 N THR A 102 32.966 62.832 -53.619 1.00 89.16 N ATOM 863 CA THR A 102 32.405 62.445 -54.904 1.00 90.05 C ATOM 864 C THR A 102 32.254 60.916 -54.907 1.00 90.65 C ATOM 865 O THR A 102 33.194 60.200 -54.536 1.00 90.88 O ATOM 866 CB THR A 102 33.318 62.918 -56.078 1.00 90.10 C ATOM 867 OG1 THR A 102 33.226 64.339 -56.219 1.00 90.10 O ATOM 868 CG2 THR A 102 32.930 62.269 -57.409 1.00 90.44 C ATOM 0 H THR A 102 33.736 63.212 -53.672 1.00 89.16 H new ATOM 0 HA THR A 102 31.541 62.867 -55.032 1.00 90.05 H new ATOM 0 HB THR A 102 34.225 62.651 -55.861 1.00 90.10 H new ATOM 0 HG1 THR A 102 33.921 64.697 -55.912 1.00 90.10 H new ATOM 0 HG21 THR A 102 33.520 62.589 -58.109 1.00 90.44 H new ATOM 0 HG22 THR A 102 33.010 61.305 -57.335 1.00 90.44 H new ATOM 0 HG23 THR A 102 32.014 62.501 -57.628 1.00 90.44 H new ATOM 869 N ASP A 103 31.056 60.444 -55.271 1.00 91.25 N ATOM 870 CA ASP A 103 30.777 59.034 -55.593 1.00 91.81 C ATOM 871 C ASP A 103 31.145 58.080 -54.466 1.00 92.02 C ATOM 872 O ASP A 103 31.618 56.956 -54.686 1.00 92.03 O ATOM 873 CB ASP A 103 31.477 58.651 -56.906 1.00 92.24 C ATOM 874 CG ASP A 103 30.829 57.469 -57.610 1.00 93.23 C ATOM 875 OD1 ASP A 103 29.927 56.823 -57.028 1.00 93.83 O ATOM 876 OD2 ASP A 103 31.243 57.184 -58.759 1.00 95.64 O ATOM 0 H ASP A 103 30.363 60.948 -55.340 1.00 91.25 H new ATOM 0 HA ASP A 103 29.818 58.946 -55.706 1.00 91.81 H new ATOM 0 HB2 ASP A 103 31.474 59.416 -57.502 1.00 92.24 H new ATOM 0 HB3 ASP A 103 32.405 58.440 -56.721 1.00 92.24 H new ATOM 877 N PHE A 104 30.923 58.559 -53.253 1.00 92.52 N ATOM 878 CA PHE A 104 31.048 57.770 -52.044 1.00 93.11 C ATOM 879 C PHE A 104 30.171 56.507 -52.102 1.00 93.97 C ATOM 880 O PHE A 104 30.348 55.601 -51.302 1.00 94.03 O ATOM 881 CB PHE A 104 30.684 58.634 -50.823 1.00 92.86 C ATOM 882 CG PHE A 104 29.260 59.161 -50.855 1.00 92.59 C ATOM 883 CD1 PHE A 104 28.827 60.005 -51.880 1.00 92.89 C ATOM 884 CD2 PHE A 104 28.351 58.800 -49.877 1.00 91.36 C ATOM 885 CE1 PHE A 104 27.521 60.477 -51.915 1.00 92.07 C ATOM 886 CE2 PHE A 104 27.056 59.262 -49.901 1.00 90.65 C ATOM 887 CZ PHE A 104 26.639 60.107 -50.922 1.00 91.71 C ATOM 0 H PHE A 104 30.689 59.374 -53.108 1.00 92.52 H new ATOM 0 HA PHE A 104 31.969 57.476 -51.963 1.00 93.11 H new ATOM 0 HB2 PHE A 104 30.809 58.110 -50.016 1.00 92.86 H new ATOM 0 HB3 PHE A 104 31.297 59.384 -50.772 1.00 92.86 H new ATOM 0 HD1 PHE A 104 29.422 60.255 -52.549 1.00 92.89 H new ATOM 0 HD2 PHE A 104 28.621 58.234 -49.190 1.00 91.36 H new ATOM 0 HE1 PHE A 104 27.244 61.038 -52.603 1.00 92.07 H new ATOM 0 HE2 PHE A 104 26.459 59.009 -49.234 1.00 90.65 H new ATOM 0 HZ PHE A 104 25.765 60.423 -50.936 1.00 91.71 H new ATOM 888 N GLY A 105 29.223 56.432 -53.033 1.00 94.97 N ATOM 889 CA GLY A 105 28.488 55.186 -53.231 1.00 96.64 C ATOM 890 C GLY A 105 29.456 54.010 -53.354 1.00 98.10 C ATOM 891 O GLY A 105 29.461 53.091 -52.501 1.00 98.47 O ATOM 0 H GLY A 105 28.993 57.078 -53.552 1.00 94.97 H new ATOM 0 HA2 GLY A 105 27.884 55.038 -52.487 1.00 96.64 H new ATOM 0 HA3 GLY A 105 27.943 55.249 -54.031 1.00 96.64 H new ATOM 892 N HIS A 106 30.289 54.064 -54.402 1.00 98.96 N ATOM 893 CA HIS A 106 31.298 53.046 -54.694 1.00100.04 C ATOM 894 C HIS A 106 32.478 53.314 -53.811 1.00100.05 C ATOM 895 O HIS A 106 32.944 52.440 -53.101 1.00 99.74 O ATOM 896 CB HIS A 106 31.781 53.149 -56.144 1.00100.56 C ATOM 897 CG HIS A 106 30.686 53.372 -57.142 1.00103.12 C ATOM 898 ND1 HIS A 106 29.540 54.091 -56.854 1.00104.80 N ATOM 899 CD2 HIS A 106 30.576 52.995 -58.439 1.00104.79 C ATOM 900 CE1 HIS A 106 28.763 54.129 -57.923 1.00105.35 C ATOM 901 NE2 HIS A 106 29.372 53.478 -58.901 1.00105.64 N ATOM 0 H HIS A 106 30.280 54.708 -54.972 1.00 98.96 H new ATOM 0 HA HIS A 106 30.913 52.168 -54.547 1.00100.04 H new ATOM 0 HB2 HIS A 106 32.419 53.877 -56.211 1.00100.56 H new ATOM 0 HB3 HIS A 106 32.255 52.335 -56.375 1.00100.56 H new ATOM 0 HD2 HIS A 106 31.197 52.503 -58.926 1.00104.79 H new ATOM 0 HE1 HIS A 106 27.932 54.542 -57.978 1.00105.35 H new ATOM 0 HE2 HIS A 106 29.065 53.373 -59.698 1.00105.64 H new ATOM 902 N ARG A 107 32.927 54.561 -53.853 1.00100.38 N ATOM 903 CA ARG A 107 34.199 54.976 -53.296 1.00100.98 C ATOM 904 C ARG A 107 34.469 54.593 -51.851 1.00100.68 C ATOM 905 O ARG A 107 35.617 54.594 -51.414 1.00100.29 O ATOM 906 CB ARG A 107 34.320 56.472 -53.443 1.00101.34 C ATOM 907 CG ARG A 107 34.417 56.912 -54.870 1.00104.18 C ATOM 908 CD ARG A 107 35.365 58.052 -54.895 1.00110.07 C ATOM 909 NE ARG A 107 36.610 57.638 -54.244 1.00115.42 N ATOM 910 CZ ARG A 107 37.465 58.454 -53.626 1.00118.19 C ATOM 911 NH1 ARG A 107 38.581 57.951 -53.085 1.00118.83 N ATOM 912 NH2 ARG A 107 37.212 59.766 -53.549 1.00119.74 N ATOM 0 H ARG A 107 32.487 55.204 -54.216 1.00100.38 H new ATOM 0 HA ARG A 107 34.867 54.487 -53.802 1.00100.98 H new ATOM 0 HB2 ARG A 107 33.551 56.896 -53.030 1.00101.34 H new ATOM 0 HB3 ARG A 107 35.105 56.777 -52.961 1.00101.34 H new ATOM 0 HG2 ARG A 107 34.732 56.188 -55.434 1.00104.18 H new ATOM 0 HG3 ARG A 107 33.548 57.178 -55.209 1.00104.18 H new ATOM 0 HD2 ARG A 107 35.538 58.326 -55.809 1.00110.07 H new ATOM 0 HD3 ARG A 107 34.984 58.817 -54.437 1.00110.07 H new ATOM 0 HE ARG A 107 36.806 56.801 -54.262 1.00115.42 H new ATOM 0 HH11 ARG A 107 38.742 57.108 -53.137 1.00118.83 H new ATOM 0 HH12 ARG A 107 39.137 58.471 -52.685 1.00118.83 H new ATOM 0 HH21 ARG A 107 36.495 60.087 -53.899 1.00119.74 H new ATOM 0 HH22 ARG A 107 37.766 60.288 -53.149 1.00119.74 H new ATOM 913 N SER A 108 33.406 54.266 -51.124 1.00100.96 N ATOM 914 CA SER A 108 33.487 53.959 -49.700 1.00101.38 C ATOM 915 C SER A 108 33.340 52.495 -49.538 1.00101.33 C ATOM 916 O SER A 108 33.128 52.002 -48.431 1.00101.11 O ATOM 917 CB SER A 108 32.320 54.567 -48.946 1.00101.56 C ATOM 918 OG SER A 108 31.092 54.158 -49.509 1.00103.06 O ATOM 0 H SER A 108 32.610 54.216 -51.446 1.00100.96 H new ATOM 0 HA SER A 108 34.329 54.303 -49.363 1.00101.38 H new ATOM 0 HB2 SER A 108 32.358 54.301 -48.014 1.00101.56 H new ATOM 0 HB3 SER A 108 32.384 55.535 -48.968 1.00101.56 H new ATOM 0 HG SER A 108 30.975 54.551 -50.242 1.00103.06 H new ATOM 919 N GLN A 109 33.389 51.806 -50.662 1.00101.68 N ATOM 920 CA GLN A 109 33.271 50.369 -50.651 1.00102.23 C ATOM 921 C GLN A 109 34.475 49.722 -51.343 1.00102.07 C ATOM 922 O GLN A 109 34.615 48.495 -51.341 1.00102.11 O ATOM 923 CB GLN A 109 31.926 49.926 -51.247 1.00102.35 C ATOM 924 CG GLN A 109 31.237 48.941 -50.326 1.00103.34 C ATOM 925 CD GLN A 109 29.928 48.419 -50.846 1.00104.81 C ATOM 926 OE1 GLN A 109 29.822 47.983 -52.005 1.00106.08 O ATOM 927 NE2 GLN A 109 28.917 48.413 -49.968 1.00105.10 N ATOM 0 H GLN A 109 33.490 52.154 -51.442 1.00101.68 H new ATOM 0 HA GLN A 109 33.279 50.059 -49.732 1.00102.23 H new ATOM 0 HB2 GLN A 109 31.357 50.699 -51.386 1.00102.35 H new ATOM 0 HB3 GLN A 109 32.069 49.519 -52.116 1.00102.35 H new ATOM 0 HG2 GLN A 109 31.832 48.191 -50.168 1.00103.34 H new ATOM 0 HG3 GLN A 109 31.085 49.368 -49.468 1.00103.34 H new ATOM 0 HE21 GLN A 109 29.034 48.725 -49.175 1.00105.10 H new ATOM 0 HE22 GLN A 109 28.151 48.097 -50.197 1.00105.10 H new ATOM 928 N LYS A 110 35.333 50.567 -51.923 1.00101.77 N ATOM 929 CA LYS A 110 36.641 50.159 -52.439 1.00101.31 C ATOM 930 C LYS A 110 37.659 50.668 -51.427 1.00100.98 C ATOM 931 O LYS A 110 38.009 49.960 -50.469 1.00100.94 O ATOM 932 CB LYS A 110 36.901 50.736 -53.848 1.00101.27 C ATOM 933 CG LYS A 110 35.687 50.689 -54.794 1.00101.14 C ATOM 934 CD LYS A 110 35.054 49.280 -54.893 1.00101.24 C ATOM 935 CE LYS A 110 33.550 49.347 -55.216 1.00101.58 C ATOM 936 NZ LYS A 110 32.851 48.014 -55.195 1.00101.00 N ATOM 0 H LYS A 110 35.168 51.404 -52.028 1.00101.77 H new ATOM 0 HA LYS A 110 36.696 49.196 -52.541 1.00101.31 H new ATOM 0 HB2 LYS A 110 37.191 51.657 -53.759 1.00101.27 H new ATOM 0 HB3 LYS A 110 37.633 50.246 -54.255 1.00101.27 H new ATOM 0 HG2 LYS A 110 35.017 51.318 -54.484 1.00101.14 H new ATOM 0 HG3 LYS A 110 35.961 50.978 -55.678 1.00101.14 H new ATOM 0 HD2 LYS A 110 35.509 48.769 -55.580 1.00101.24 H new ATOM 0 HD3 LYS A 110 35.184 48.808 -54.056 1.00101.24 H new ATOM 0 HE2 LYS A 110 33.119 49.936 -54.577 1.00101.58 H new ATOM 0 HE3 LYS A 110 33.436 49.746 -56.093 1.00101.58 H new ATOM 0 HZ1 LYS A 110 32.258 47.979 -55.858 1.00101.00 H new ATOM 0 HZ2 LYS A 110 33.449 47.363 -55.298 1.00101.00 H new ATOM 0 HZ3 LYS A 110 32.431 47.911 -54.417 1.00101.00 H new ATOM 937 N ASP A 111 38.092 51.912 -51.613 1.00100.46 N ATOM 938 CA ASP A 111 38.967 52.565 -50.657 1.00 99.97 C ATOM 939 C ASP A 111 38.503 52.256 -49.216 1.00 99.66 C ATOM 940 O ASP A 111 37.339 52.412 -48.908 1.00 99.64 O ATOM 941 CB ASP A 111 39.001 54.066 -50.949 1.00 99.74 C ATOM 942 CG ASP A 111 40.094 54.776 -50.190 1.00 99.29 C ATOM 943 OD1 ASP A 111 40.203 54.531 -48.976 1.00 97.08 O ATOM 944 OD2 ASP A 111 40.831 55.579 -50.803 1.00 98.75 O ATOM 0 H ASP A 111 37.886 52.395 -52.294 1.00100.46 H new ATOM 0 HA ASP A 111 39.871 52.225 -50.742 1.00 99.97 H new ATOM 0 HB2 ASP A 111 39.129 54.205 -51.900 1.00 99.74 H new ATOM 0 HB3 ASP A 111 38.144 54.457 -50.718 1.00 99.74 H new ATOM 945 N PRO A 112 39.398 51.751 -48.354 1.00 99.44 N ATOM 946 CA PRO A 112 38.975 51.466 -46.997 1.00 99.31 C ATOM 947 C PRO A 112 39.452 52.569 -46.065 1.00 99.36 C ATOM 948 O PRO A 112 39.159 52.546 -44.855 1.00 99.42 O ATOM 949 CB PRO A 112 39.716 50.172 -46.691 1.00 99.38 C ATOM 950 CG PRO A 112 41.019 50.293 -47.495 1.00 99.45 C ATOM 951 CD PRO A 112 40.807 51.372 -48.557 1.00 99.60 C ATOM 0 HA PRO A 112 38.013 51.403 -46.889 1.00 99.31 H new ATOM 0 HB2 PRO A 112 39.892 50.079 -45.742 1.00 99.38 H new ATOM 0 HB3 PRO A 112 39.202 49.395 -46.962 1.00 99.38 H new ATOM 0 HG2 PRO A 112 41.758 50.528 -46.913 1.00 99.45 H new ATOM 0 HG3 PRO A 112 41.243 49.446 -47.910 1.00 99.45 H new ATOM 0 HD2 PRO A 112 41.405 52.125 -48.430 1.00 99.60 H new ATOM 0 HD3 PRO A 112 40.964 51.033 -49.452 1.00 99.60 H new ATOM 952 N GLU A 113 40.216 53.503 -46.634 1.00 99.17 N ATOM 953 CA GLU A 113 40.634 54.715 -45.933 1.00 99.25 C ATOM 954 C GLU A 113 39.460 55.663 -46.066 1.00 98.21 C ATOM 955 O GLU A 113 38.801 55.980 -45.075 1.00 98.59 O ATOM 956 CB GLU A 113 41.883 55.374 -46.564 1.00100.03 C ATOM 957 CG GLU A 113 42.799 54.472 -47.447 1.00103.15 C ATOM 958 CD GLU A 113 43.624 53.427 -46.659 1.00106.00 C ATOM 959 OE1 GLU A 113 43.624 52.234 -47.072 1.00106.81 O ATOM 960 OE2 GLU A 113 44.272 53.799 -45.644 1.00106.56 O ATOM 0 H GLU A 113 40.507 53.449 -47.442 1.00 99.17 H new ATOM 0 HA GLU A 113 40.872 54.506 -45.016 1.00 99.25 H new ATOM 0 HB2 GLU A 113 41.586 56.122 -47.106 1.00100.03 H new ATOM 0 HB3 GLU A 113 42.424 55.740 -45.847 1.00100.03 H new ATOM 0 HG2 GLU A 113 42.247 54.009 -48.097 1.00103.15 H new ATOM 0 HG3 GLU A 113 43.408 55.039 -47.945 1.00103.15 H new ATOM 961 N PHE A 114 39.199 56.096 -47.302 1.00 96.49 N ATOM 962 CA PHE A 114 38.018 56.884 -47.644 1.00 94.46 C ATOM 963 C PHE A 114 36.815 56.506 -46.790 1.00 92.65 C ATOM 964 O PHE A 114 36.282 57.326 -46.065 1.00 92.10 O ATOM 965 CB PHE A 114 37.691 56.667 -49.109 1.00 94.87 C ATOM 966 CG PHE A 114 36.709 57.639 -49.667 1.00 95.76 C ATOM 967 CD1 PHE A 114 37.126 58.892 -50.104 1.00 96.21 C ATOM 968 CD2 PHE A 114 35.365 57.294 -49.791 1.00 96.54 C ATOM 969 CE1 PHE A 114 36.216 59.789 -50.641 1.00 97.13 C ATOM 970 CE2 PHE A 114 34.440 58.186 -50.329 1.00 96.47 C ATOM 971 CZ PHE A 114 34.863 59.429 -50.761 1.00 96.74 C ATOM 0 H PHE A 114 39.712 55.936 -47.973 1.00 96.49 H new ATOM 0 HA PHE A 114 38.215 57.818 -47.472 1.00 94.46 H new ATOM 0 HB2 PHE A 114 38.511 56.720 -49.624 1.00 94.87 H new ATOM 0 HB3 PHE A 114 37.342 55.769 -49.222 1.00 94.87 H new ATOM 0 HD1 PHE A 114 38.022 59.130 -50.035 1.00 96.21 H new ATOM 0 HD2 PHE A 114 35.081 56.454 -49.510 1.00 96.54 H new ATOM 0 HE1 PHE A 114 36.501 60.629 -50.922 1.00 97.13 H new ATOM 0 HE2 PHE A 114 33.544 57.947 -50.397 1.00 96.47 H new ATOM 0 HZ PHE A 114 34.253 60.026 -51.130 1.00 96.74 H new ATOM 972 N ALA A 115 36.426 55.242 -46.854 1.00 90.77 N ATOM 973 CA ALA A 115 35.294 54.737 -46.098 1.00 89.32 C ATOM 974 C ALA A 115 35.419 54.899 -44.579 1.00 88.33 C ATOM 975 O ALA A 115 34.794 54.154 -43.823 1.00 88.68 O ATOM 976 CB ALA A 115 35.044 53.288 -46.448 1.00 89.07 C ATOM 0 H ALA A 115 36.815 54.649 -47.341 1.00 90.77 H new ATOM 0 HA ALA A 115 34.538 55.286 -46.358 1.00 89.32 H new ATOM 0 HB1 ALA A 115 34.287 52.958 -45.939 1.00 89.07 H new ATOM 0 HB2 ALA A 115 34.854 53.212 -47.396 1.00 89.07 H new ATOM 0 HB3 ALA A 115 35.831 52.763 -46.233 1.00 89.07 H new ATOM 977 N ALA A 116 36.203 55.868 -44.123 1.00 86.69 N ATOM 978 CA ALA A 116 36.393 56.062 -42.685 1.00 85.46 C ATOM 979 C ALA A 116 36.387 57.545 -42.370 1.00 84.76 C ATOM 980 O ALA A 116 36.049 57.959 -41.244 1.00 84.23 O ATOM 981 CB ALA A 116 37.691 55.400 -42.208 1.00 85.62 C ATOM 0 H ALA A 116 36.632 56.421 -44.622 1.00 86.69 H new ATOM 0 HA ALA A 116 35.662 55.638 -42.209 1.00 85.46 H new ATOM 0 HB1 ALA A 116 37.795 55.542 -41.254 1.00 85.62 H new ATOM 0 HB2 ALA A 116 37.655 54.448 -42.391 1.00 85.62 H new ATOM 0 HB3 ALA A 116 38.445 55.791 -42.677 1.00 85.62 H new ATOM 982 N VAL A 117 36.784 58.329 -43.377 1.00 83.84 N ATOM 983 CA VAL A 117 36.443 59.752 -43.441 1.00 83.53 C ATOM 984 C VAL A 117 34.952 59.932 -43.900 1.00 83.28 C ATOM 985 O VAL A 117 34.358 61.031 -43.786 1.00 83.42 O ATOM 986 CB VAL A 117 37.447 60.563 -44.325 1.00 83.50 C ATOM 987 CG1 VAL A 117 37.369 60.150 -45.792 1.00 83.35 C ATOM 988 CG2 VAL A 117 37.226 62.081 -44.160 1.00 83.50 C ATOM 0 H VAL A 117 37.257 58.051 -44.039 1.00 83.84 H new ATOM 0 HA VAL A 117 36.525 60.123 -42.549 1.00 83.53 H new ATOM 0 HB VAL A 117 38.342 60.354 -44.015 1.00 83.50 H new ATOM 0 HG11 VAL A 117 38.003 60.671 -46.309 1.00 83.35 H new ATOM 0 HG12 VAL A 117 37.582 59.207 -45.875 1.00 83.35 H new ATOM 0 HG13 VAL A 117 36.472 60.308 -46.126 1.00 83.35 H new ATOM 0 HG21 VAL A 117 37.858 62.563 -44.716 1.00 83.50 H new ATOM 0 HG22 VAL A 117 36.322 62.308 -44.428 1.00 83.50 H new ATOM 0 HG23 VAL A 117 37.359 62.329 -43.232 1.00 83.50 H new ATOM 989 N TYR A 118 34.360 58.834 -44.390 1.00 82.01 N ATOM 990 CA TYR A 118 32.964 58.798 -44.765 1.00 80.33 C ATOM 991 C TYR A 118 32.032 58.643 -43.564 1.00 80.06 C ATOM 992 O TYR A 118 31.103 59.396 -43.469 1.00 80.10 O ATOM 993 CB TYR A 118 32.728 57.722 -45.803 1.00 79.52 C ATOM 994 CG TYR A 118 31.290 57.546 -46.163 1.00 78.30 C ATOM 995 CD1 TYR A 118 30.583 56.410 -45.773 1.00 77.66 C ATOM 996 CD2 TYR A 118 30.629 58.518 -46.894 1.00 78.47 C ATOM 997 CE1 TYR A 118 29.249 56.253 -46.112 1.00 77.50 C ATOM 998 CE2 TYR A 118 29.306 58.383 -47.215 1.00 77.89 C ATOM 999 CZ TYR A 118 28.619 57.249 -46.835 1.00 77.49 C ATOM 1000 OH TYR A 118 27.302 57.149 -47.193 1.00 76.50 O ATOM 0 H TYR A 118 34.772 58.089 -44.510 1.00 82.01 H new ATOM 0 HA TYR A 118 32.746 59.658 -45.158 1.00 80.33 H new ATOM 0 HB2 TYR A 118 33.230 57.940 -46.604 1.00 79.52 H new ATOM 0 HB3 TYR A 118 33.076 56.880 -45.470 1.00 79.52 H new ATOM 0 HD1 TYR A 118 31.012 55.749 -45.279 1.00 77.66 H new ATOM 0 HD2 TYR A 118 31.092 59.275 -47.172 1.00 78.47 H new ATOM 0 HE1 TYR A 118 28.784 55.489 -45.857 1.00 77.50 H new ATOM 0 HE2 TYR A 118 28.871 59.055 -47.689 1.00 77.89 H new ATOM 0 HH TYR A 118 27.137 56.362 -47.436 1.00 76.50 H new ATOM 1001 N HIS A 119 32.273 57.695 -42.655 1.00 79.95 N ATOM 1002 CA HIS A 119 31.506 57.607 -41.386 1.00 80.61 C ATOM 1003 C HIS A 119 31.976 58.680 -40.452 1.00 80.35 C ATOM 1004 O HIS A 119 31.550 58.778 -39.290 1.00 80.72 O ATOM 1005 CB HIS A 119 31.700 56.268 -40.696 1.00 81.09 C ATOM 1006 CG HIS A 119 31.548 55.118 -41.619 1.00 83.45 C ATOM 1007 ND1 HIS A 119 31.436 55.077 -42.971 1.00 85.87 N flip ATOM 1008 CD2 HIS A 119 31.476 53.816 -41.180 1.00 84.75 C flip ATOM 1009 CE1 HIS A 119 31.310 53.761 -43.326 1.00 87.34 C flip ATOM 1010 NE2 HIS A 119 31.339 53.020 -42.229 1.00 86.25 N flip ATOM 0 H HIS A 119 32.876 57.088 -42.746 1.00 79.95 H new ATOM 0 HA HIS A 119 30.567 57.711 -41.605 1.00 80.61 H new ATOM 0 HB2 HIS A 119 32.583 56.241 -40.295 1.00 81.09 H new ATOM 0 HB3 HIS A 119 31.058 56.185 -39.974 1.00 81.09 H new ATOM 0 HD2 HIS A 119 31.517 53.541 -40.293 1.00 84.75 H new ATOM 0 HE1 HIS A 119 31.219 53.440 -44.194 1.00 87.34 H new ATOM 0 HE2 HIS A 119 31.279 52.163 -42.202 1.00 86.25 H new ATOM 1011 N GLU A 120 32.897 59.468 -40.972 1.00 79.73 N ATOM 1012 CA GLU A 120 33.329 60.637 -40.311 1.00 78.96 C ATOM 1013 C GLU A 120 32.294 61.683 -40.632 1.00 76.55 C ATOM 1014 O GLU A 120 31.549 62.108 -39.762 1.00 76.69 O ATOM 1015 CB GLU A 120 34.713 61.044 -40.829 1.00 80.47 C ATOM 1016 CG GLU A 120 35.601 61.778 -39.804 1.00 85.95 C ATOM 1017 CD GLU A 120 35.682 61.001 -38.499 1.00 92.55 C ATOM 1018 OE1 GLU A 120 36.575 60.115 -38.385 1.00 96.45 O ATOM 1019 OE2 GLU A 120 34.832 61.260 -37.605 1.00 95.15 O ATOM 0 H GLU A 120 33.283 59.323 -41.727 1.00 79.73 H new ATOM 0 HA GLU A 120 33.414 60.514 -39.353 1.00 78.96 H new ATOM 0 HB2 GLU A 120 35.179 60.248 -41.129 1.00 80.47 H new ATOM 0 HB3 GLU A 120 34.598 61.615 -41.605 1.00 80.47 H new ATOM 0 HG2 GLU A 120 36.492 61.897 -40.169 1.00 85.95 H new ATOM 0 HG3 GLU A 120 35.242 62.663 -39.636 1.00 85.95 H new ATOM 1020 N GLU A 121 32.215 62.086 -41.885 1.00 73.91 N ATOM 1021 CA GLU A 121 31.354 63.199 -42.182 1.00 71.84 C ATOM 1022 C GLU A 121 29.892 62.908 -41.848 1.00 69.43 C ATOM 1023 O GLU A 121 29.185 63.768 -41.362 1.00 69.59 O ATOM 1024 CB GLU A 121 31.529 63.657 -43.619 1.00 72.37 C ATOM 1025 CG GLU A 121 32.941 64.184 -43.979 1.00 74.64 C ATOM 1026 CD GLU A 121 33.397 65.441 -43.209 1.00 77.61 C ATOM 1027 OE1 GLU A 121 33.081 66.607 -43.600 1.00 76.84 O ATOM 1028 OE2 GLU A 121 34.129 65.234 -42.218 1.00 79.44 O ATOM 0 H GLU A 121 32.635 61.742 -42.552 1.00 73.91 H new ATOM 0 HA GLU A 121 31.623 63.932 -41.606 1.00 71.84 H new ATOM 0 HB2 GLU A 121 31.317 62.915 -44.207 1.00 72.37 H new ATOM 0 HB3 GLU A 121 30.883 64.357 -43.801 1.00 72.37 H new ATOM 0 HG2 GLU A 121 33.584 63.475 -43.820 1.00 74.64 H new ATOM 0 HG3 GLU A 121 32.964 64.380 -44.929 1.00 74.64 H new ATOM 1029 N MET A 122 29.465 61.681 -42.071 1.00 66.57 N ATOM 1030 CA MET A 122 28.112 61.259 -41.763 1.00 64.09 C ATOM 1031 C MET A 122 27.742 61.397 -40.281 1.00 63.15 C ATOM 1032 O MET A 122 26.696 61.949 -39.972 1.00 63.31 O ATOM 1033 CB MET A 122 27.929 59.808 -42.194 1.00 63.71 C ATOM 1034 CG MET A 122 26.530 59.258 -42.107 1.00 61.21 C ATOM 1035 SD MET A 122 25.438 59.874 -43.411 1.00 55.11 S ATOM 1036 CE MET A 122 26.073 59.198 -44.955 1.00 55.71 C ATOM 0 H MET A 122 29.956 61.061 -42.409 1.00 66.57 H new ATOM 0 HA MET A 122 27.519 61.851 -42.252 1.00 64.09 H new ATOM 0 HB2 MET A 122 28.234 59.722 -43.111 1.00 63.71 H new ATOM 0 HB3 MET A 122 28.509 59.253 -41.649 1.00 63.71 H new ATOM 0 HG2 MET A 122 26.566 58.290 -42.154 1.00 61.21 H new ATOM 0 HG3 MET A 122 26.153 59.486 -41.243 1.00 61.21 H new ATOM 0 HE1 MET A 122 25.444 59.380 -45.671 1.00 55.71 H new ATOM 0 HE2 MET A 122 26.926 59.610 -45.162 1.00 55.71 H new ATOM 0 HE3 MET A 122 26.191 58.240 -44.864 1.00 55.71 H new ATOM 1037 N ALA A 123 28.574 60.883 -39.380 1.00 61.30 N ATOM 1038 CA ALA A 123 28.269 60.867 -37.944 1.00 60.34 C ATOM 1039 C ALA A 123 28.090 62.299 -37.487 1.00 59.88 C ATOM 1040 O ALA A 123 27.345 62.598 -36.530 1.00 59.20 O ATOM 1041 CB ALA A 123 29.396 60.204 -37.162 1.00 59.95 C ATOM 0 H ALA A 123 29.333 60.532 -39.580 1.00 61.30 H new ATOM 0 HA ALA A 123 27.459 60.357 -37.785 1.00 60.34 H new ATOM 0 HB1 ALA A 123 29.177 60.203 -36.217 1.00 59.95 H new ATOM 0 HB2 ALA A 123 29.509 59.291 -37.469 1.00 59.95 H new ATOM 0 HB3 ALA A 123 30.220 60.696 -37.302 1.00 59.95 H new ATOM 1042 N LYS A 124 28.802 63.153 -38.228 1.00 59.10 N ATOM 1043 CA LYS A 124 28.944 64.589 -38.014 1.00 58.63 C ATOM 1044 C LYS A 124 27.706 65.276 -38.579 1.00 56.38 C ATOM 1045 O LYS A 124 27.171 66.237 -37.999 1.00 56.24 O ATOM 1046 CB LYS A 124 30.175 65.053 -38.803 1.00 58.73 C ATOM 1047 CG LYS A 124 30.966 66.226 -38.244 1.00 61.15 C ATOM 1048 CD LYS A 124 31.834 66.869 -39.380 1.00 61.25 C ATOM 1049 CE LYS A 124 33.349 66.539 -39.342 1.00 64.45 C ATOM 1050 NZ LYS A 124 33.717 65.127 -39.574 1.00 66.67 N ATOM 0 H LYS A 124 29.244 62.886 -38.916 1.00 59.10 H new ATOM 0 HA LYS A 124 29.042 64.800 -37.072 1.00 58.63 H new ATOM 0 HB2 LYS A 124 30.778 64.298 -38.888 1.00 58.73 H new ATOM 0 HB3 LYS A 124 29.886 65.287 -39.699 1.00 58.73 H new ATOM 0 HG2 LYS A 124 30.361 66.888 -37.873 1.00 61.15 H new ATOM 0 HG3 LYS A 124 31.537 65.926 -37.519 1.00 61.15 H new ATOM 0 HD2 LYS A 124 31.479 66.582 -40.236 1.00 61.25 H new ATOM 0 HD3 LYS A 124 31.729 67.832 -39.338 1.00 61.25 H new ATOM 0 HE2 LYS A 124 33.796 67.084 -40.009 1.00 64.45 H new ATOM 0 HE3 LYS A 124 33.697 66.806 -38.477 1.00 64.45 H new ATOM 0 HZ1 LYS A 124 34.529 64.973 -39.243 1.00 66.67 H new ATOM 0 HZ2 LYS A 124 33.127 64.596 -39.171 1.00 66.67 H new ATOM 0 HZ3 LYS A 124 33.717 64.960 -40.448 1.00 66.67 H new ATOM 1051 N PHE A 125 27.285 64.766 -39.734 1.00 53.80 N ATOM 1052 CA PHE A 125 26.104 65.212 -40.397 1.00 50.86 C ATOM 1053 C PHE A 125 24.875 64.851 -39.598 1.00 49.78 C ATOM 1054 O PHE A 125 24.049 65.708 -39.314 1.00 49.84 O ATOM 1055 CB PHE A 125 25.993 64.586 -41.749 1.00 49.77 C ATOM 1056 CG PHE A 125 24.728 64.934 -42.441 1.00 49.66 C ATOM 1057 CD1 PHE A 125 23.744 63.982 -42.643 1.00 47.31 C ATOM 1058 CD2 PHE A 125 24.482 66.241 -42.849 1.00 47.29 C ATOM 1059 CE1 PHE A 125 22.539 64.323 -43.292 1.00 47.31 C ATOM 1060 CE2 PHE A 125 23.289 66.580 -43.493 1.00 47.61 C ATOM 1061 CZ PHE A 125 22.323 65.617 -43.733 1.00 45.91 C ATOM 0 H PHE A 125 27.699 64.137 -40.150 1.00 53.80 H new ATOM 0 HA PHE A 125 26.164 66.176 -40.486 1.00 50.86 H new ATOM 0 HB2 PHE A 125 26.744 64.869 -42.294 1.00 49.77 H new ATOM 0 HB3 PHE A 125 26.054 63.622 -41.661 1.00 49.77 H new ATOM 0 HD1 PHE A 125 23.878 63.110 -42.348 1.00 47.31 H new ATOM 0 HD2 PHE A 125 25.120 66.898 -42.691 1.00 47.29 H new ATOM 0 HE1 PHE A 125 21.886 63.674 -43.424 1.00 47.31 H new ATOM 0 HE2 PHE A 125 23.143 67.458 -43.762 1.00 47.61 H new ATOM 0 HZ PHE A 125 21.540 65.837 -44.184 1.00 45.91 H new ATOM 1062 N ASP A 126 24.741 63.583 -39.240 1.00 48.24 N ATOM 1063 CA ASP A 126 23.595 63.137 -38.472 1.00 46.77 C ATOM 1064 C ASP A 126 23.438 63.934 -37.192 1.00 46.16 C ATOM 1065 O ASP A 126 22.335 64.049 -36.627 1.00 46.18 O ATOM 1066 CB ASP A 126 23.770 61.670 -38.056 1.00 46.76 C ATOM 1067 CG ASP A 126 23.578 60.684 -39.199 1.00 46.05 C ATOM 1068 OD1 ASP A 126 23.168 61.048 -40.332 1.00 40.62 O ATOM 1069 OD2 ASP A 126 23.847 59.499 -38.916 1.00 45.63 O ATOM 0 H ASP A 126 25.306 62.964 -39.433 1.00 48.24 H new ATOM 0 HA ASP A 126 22.818 63.256 -39.040 1.00 46.77 H new ATOM 0 HB2 ASP A 126 24.657 61.551 -37.683 1.00 46.76 H new ATOM 0 HB3 ASP A 126 23.136 61.464 -37.351 1.00 46.76 H new ATOM 1070 N ASP A 127 24.544 64.465 -36.698 1.00 45.54 N ATOM 1071 CA ASP A 127 24.508 64.967 -35.348 1.00 45.43 C ATOM 1072 C ASP A 127 23.986 66.369 -35.314 1.00 44.17 C ATOM 1073 O ASP A 127 23.231 66.785 -34.408 1.00 42.91 O ATOM 1074 CB ASP A 127 25.867 64.919 -34.676 1.00 46.04 C ATOM 1075 CG ASP A 127 25.748 65.187 -33.175 1.00 48.28 C ATOM 1076 OD1 ASP A 127 25.098 64.347 -32.463 1.00 49.29 O ATOM 1077 OD2 ASP A 127 26.243 66.273 -32.751 1.00 49.69 O ATOM 0 H ASP A 127 25.294 64.541 -37.111 1.00 45.54 H new ATOM 0 HA ASP A 127 23.909 64.384 -34.855 1.00 45.43 H new ATOM 0 HB2 ASP A 127 26.273 64.050 -34.821 1.00 46.04 H new ATOM 0 HB3 ASP A 127 26.454 65.577 -35.080 1.00 46.04 H new ATOM 1078 N ARG A 128 24.413 67.081 -36.330 1.00 44.29 N ATOM 1079 CA ARG A 128 23.933 68.394 -36.604 1.00 45.30 C ATOM 1080 C ARG A 128 22.414 68.420 -36.910 1.00 44.45 C ATOM 1081 O ARG A 128 21.677 69.257 -36.356 1.00 45.13 O ATOM 1082 CB ARG A 128 24.725 68.991 -37.743 1.00 46.23 C ATOM 1083 CG ARG A 128 24.626 70.500 -37.632 1.00 54.02 C ATOM 1084 CD ARG A 128 25.968 71.163 -37.372 1.00 62.37 C ATOM 1085 NE ARG A 128 26.584 71.366 -38.686 1.00 68.63 N ATOM 1086 CZ ARG A 128 26.542 72.509 -39.369 1.00 70.07 C ATOM 1087 NH1 ARG A 128 27.108 72.587 -40.572 1.00 71.77 N ATOM 1088 NH2 ARG A 128 25.950 73.576 -38.844 1.00 69.80 N ATOM 0 H ARG A 128 25.004 66.802 -36.889 1.00 44.29 H new ATOM 0 HA ARG A 128 24.058 68.930 -35.805 1.00 45.30 H new ATOM 0 HB2 ARG A 128 25.651 68.707 -37.699 1.00 46.23 H new ATOM 0 HB3 ARG A 128 24.375 68.689 -38.596 1.00 46.23 H new ATOM 0 HG2 ARG A 128 24.248 70.856 -38.451 1.00 54.02 H new ATOM 0 HG3 ARG A 128 24.014 70.727 -36.915 1.00 54.02 H new ATOM 0 HD2 ARG A 128 25.853 72.008 -36.909 1.00 62.37 H new ATOM 0 HD3 ARG A 128 26.527 70.605 -36.810 1.00 62.37 H new ATOM 0 HE ARG A 128 27.001 70.702 -39.040 1.00 68.63 H new ATOM 0 HH11 ARG A 128 27.501 71.899 -40.908 1.00 71.77 H new ATOM 0 HH12 ARG A 128 27.081 73.325 -41.013 1.00 71.77 H new ATOM 0 HH21 ARG A 128 25.594 73.529 -38.063 1.00 69.80 H new ATOM 0 HH22 ARG A 128 25.923 74.314 -39.285 1.00 69.80 H new ATOM 1089 N VAL A 129 21.942 67.478 -37.731 1.00 41.82 N ATOM 1090 CA VAL A 129 20.508 67.295 -37.905 1.00 38.73 C ATOM 1091 C VAL A 129 19.830 67.042 -36.586 1.00 39.02 C ATOM 1092 O VAL A 129 18.719 67.523 -36.364 1.00 38.76 O ATOM 1093 CB VAL A 129 20.155 66.179 -38.911 1.00 38.44 C ATOM 1094 CG1 VAL A 129 18.657 66.051 -39.109 1.00 32.76 C ATOM 1095 CG2 VAL A 129 20.879 66.448 -40.237 1.00 34.29 C ATOM 0 H VAL A 129 22.433 66.942 -38.190 1.00 41.82 H new ATOM 0 HA VAL A 129 20.176 68.126 -38.279 1.00 38.73 H new ATOM 0 HB VAL A 129 20.455 65.329 -38.553 1.00 38.44 H new ATOM 0 HG11 VAL A 129 18.474 65.342 -39.746 1.00 32.76 H new ATOM 0 HG12 VAL A 129 18.235 65.841 -38.261 1.00 32.76 H new ATOM 0 HG13 VAL A 129 18.302 66.888 -39.447 1.00 32.76 H new ATOM 0 HG21 VAL A 129 20.660 65.749 -40.873 1.00 34.29 H new ATOM 0 HG22 VAL A 129 20.598 67.306 -40.591 1.00 34.29 H new ATOM 0 HG23 VAL A 129 21.837 66.459 -40.086 1.00 34.29 H new ATOM 1096 N LEU A 130 20.457 66.328 -35.680 1.00 38.84 N ATOM 1097 CA LEU A 130 19.743 66.097 -34.420 1.00 39.36 C ATOM 1098 C LEU A 130 19.599 67.363 -33.555 1.00 39.86 C ATOM 1099 O LEU A 130 18.586 67.540 -32.854 1.00 37.84 O ATOM 1100 CB LEU A 130 20.361 64.946 -33.638 1.00 38.84 C ATOM 1101 CG LEU A 130 20.035 63.592 -34.262 1.00 40.92 C ATOM 1102 CD1 LEU A 130 21.323 62.746 -34.334 1.00 39.34 C ATOM 1103 CD2 LEU A 130 18.833 62.872 -33.552 1.00 36.25 C ATOM 0 H LEU A 130 21.242 65.983 -35.751 1.00 38.84 H new ATOM 0 HA LEU A 130 18.839 65.844 -34.664 1.00 39.36 H new ATOM 0 HB2 LEU A 130 21.323 65.061 -33.601 1.00 38.84 H new ATOM 0 HB3 LEU A 130 20.037 64.966 -32.724 1.00 38.84 H new ATOM 0 HG LEU A 130 19.719 63.725 -35.169 1.00 40.92 H new ATOM 0 HD11 LEU A 130 21.122 61.884 -34.730 1.00 39.34 H new ATOM 0 HD12 LEU A 130 21.982 63.205 -34.878 1.00 39.34 H new ATOM 0 HD13 LEU A 130 21.676 62.616 -33.440 1.00 39.34 H new ATOM 0 HD21 LEU A 130 18.666 62.019 -33.983 1.00 36.25 H new ATOM 0 HD22 LEU A 130 19.050 62.724 -32.618 1.00 36.25 H new ATOM 0 HD23 LEU A 130 18.040 63.427 -33.615 1.00 36.25 H new ATOM 1104 N HIS A 131 20.600 68.250 -33.661 1.00 41.38 N ATOM 1105 CA HIS A 131 20.749 69.382 -32.692 1.00 43.50 C ATOM 1106 C HIS A 131 20.484 70.782 -33.237 1.00 42.88 C ATOM 1107 O HIS A 131 19.948 71.634 -32.553 1.00 43.82 O ATOM 1108 CB HIS A 131 22.115 69.305 -31.983 1.00 43.87 C ATOM 1109 CG HIS A 131 22.348 67.996 -31.296 1.00 47.24 C ATOM 1110 ND1 HIS A 131 23.462 67.216 -31.531 1.00 49.37 N ATOM 1111 CD2 HIS A 131 21.572 67.295 -30.429 1.00 51.08 C ATOM 1112 CE1 HIS A 131 23.380 66.108 -30.817 1.00 50.66 C ATOM 1113 NE2 HIS A 131 22.237 66.125 -30.147 1.00 53.82 N ATOM 0 H HIS A 131 21.202 68.225 -34.275 1.00 41.38 H new ATOM 0 HA HIS A 131 20.030 69.251 -32.054 1.00 43.50 H new ATOM 0 HB2 HIS A 131 22.819 69.452 -32.633 1.00 43.87 H new ATOM 0 HB3 HIS A 131 22.176 70.021 -31.332 1.00 43.87 H new ATOM 0 HD2 HIS A 131 20.747 67.557 -30.090 1.00 51.08 H new ATOM 0 HE1 HIS A 131 24.017 65.431 -30.789 1.00 50.66 H new ATOM 0 HE2 HIS A 131 21.957 65.505 -29.621 1.00 53.82 H new ATOM 1114 N ASP A 132 20.800 70.988 -34.494 1.00 42.54 N ATOM 1115 CA ASP A 132 20.660 72.286 -35.079 1.00 42.73 C ATOM 1116 C ASP A 132 19.377 72.385 -35.963 1.00 43.36 C ATOM 1117 O ASP A 132 19.412 72.101 -37.175 1.00 43.18 O ATOM 1118 CB ASP A 132 21.952 72.585 -35.848 1.00 41.57 C ATOM 1119 CG ASP A 132 21.940 73.902 -36.509 1.00 42.61 C ATOM 1120 OD1 ASP A 132 22.884 74.200 -37.262 1.00 44.75 O ATOM 1121 OD2 ASP A 132 20.968 74.663 -36.317 1.00 48.82 O ATOM 0 H ASP A 132 21.099 70.382 -35.026 1.00 42.54 H new ATOM 0 HA ASP A 132 20.536 72.961 -34.393 1.00 42.73 H new ATOM 0 HB2 ASP A 132 22.703 72.543 -35.236 1.00 41.57 H new ATOM 0 HB3 ASP A 132 22.092 71.895 -36.516 1.00 41.57 H new ATOM 1122 N ASP A 133 18.261 72.809 -35.354 1.00 44.08 N ATOM 1123 CA ASP A 133 16.981 73.052 -36.075 1.00 44.83 C ATOM 1124 C ASP A 133 17.065 73.632 -37.479 1.00 44.59 C ATOM 1125 O ASP A 133 16.263 73.277 -38.341 1.00 45.08 O ATOM 1126 CB ASP A 133 16.018 73.958 -35.288 1.00 44.99 C ATOM 1127 CG ASP A 133 15.710 73.422 -33.892 1.00 48.38 C ATOM 1128 OD1 ASP A 133 16.051 72.247 -33.609 1.00 49.25 O ATOM 1129 OD2 ASP A 133 15.160 74.200 -33.061 1.00 52.23 O ATOM 0 H ASP A 133 18.217 72.966 -34.510 1.00 44.08 H new ATOM 0 HA ASP A 133 16.655 72.142 -36.157 1.00 44.83 H new ATOM 0 HB2 ASP A 133 16.404 74.845 -35.212 1.00 44.99 H new ATOM 0 HB3 ASP A 133 15.190 74.051 -35.784 1.00 44.99 H new ATOM 1130 N ALA A 134 17.978 74.551 -37.727 1.00 43.82 N ATOM 1131 CA ALA A 134 17.863 75.231 -38.982 1.00 42.85 C ATOM 1132 C ALA A 134 18.587 74.399 -40.009 1.00 42.60 C ATOM 1133 O ALA A 134 18.357 74.492 -41.232 1.00 42.33 O ATOM 1134 CB ALA A 134 18.463 76.579 -38.882 1.00 43.24 C ATOM 0 H ALA A 134 18.630 74.781 -37.216 1.00 43.82 H new ATOM 0 HA ALA A 134 16.933 75.342 -39.235 1.00 42.85 H new ATOM 0 HB1 ALA A 134 18.382 77.034 -39.735 1.00 43.24 H new ATOM 0 HB2 ALA A 134 18.001 77.089 -38.199 1.00 43.24 H new ATOM 0 HB3 ALA A 134 19.401 76.499 -38.647 1.00 43.24 H new ATOM 1135 N PHE A 135 19.510 73.604 -39.512 1.00 41.86 N ATOM 1136 CA PHE A 135 20.302 72.767 -40.398 1.00 41.86 C ATOM 1137 C PHE A 135 19.373 71.590 -40.800 1.00 40.34 C ATOM 1138 O PHE A 135 19.146 71.303 -41.996 1.00 40.26 O ATOM 1139 CB PHE A 135 21.623 72.343 -39.662 1.00 43.14 C ATOM 1140 CG PHE A 135 22.546 71.401 -40.482 1.00 45.95 C ATOM 1141 CD1 PHE A 135 23.280 71.891 -41.601 1.00 47.45 C ATOM 1142 CD2 PHE A 135 22.658 70.045 -40.138 1.00 45.80 C ATOM 1143 CE1 PHE A 135 24.094 71.078 -42.353 1.00 45.81 C ATOM 1144 CE2 PHE A 135 23.468 69.227 -40.884 1.00 46.82 C ATOM 1145 CZ PHE A 135 24.190 69.753 -41.997 1.00 47.54 C ATOM 0 H PHE A 135 19.696 73.531 -38.676 1.00 41.86 H new ATOM 0 HA PHE A 135 20.600 73.213 -41.206 1.00 41.86 H new ATOM 0 HB2 PHE A 135 22.121 73.142 -39.430 1.00 43.14 H new ATOM 0 HB3 PHE A 135 21.389 71.903 -38.830 1.00 43.14 H new ATOM 0 HD1 PHE A 135 23.206 72.789 -41.830 1.00 47.45 H new ATOM 0 HD2 PHE A 135 22.188 69.704 -39.412 1.00 45.80 H new ATOM 0 HE1 PHE A 135 24.566 71.414 -43.081 1.00 45.81 H new ATOM 0 HE2 PHE A 135 23.547 68.327 -40.664 1.00 46.82 H new ATOM 0 HZ PHE A 135 24.737 69.187 -42.492 1.00 47.54 H new ATOM 1146 N ALA A 136 18.812 70.965 -39.775 1.00 37.92 N ATOM 1147 CA ALA A 136 17.759 70.024 -39.945 1.00 37.81 C ATOM 1148 C ALA A 136 16.748 70.528 -41.012 1.00 37.78 C ATOM 1149 O ALA A 136 16.536 69.869 -41.990 1.00 38.17 O ATOM 1150 CB ALA A 136 17.121 69.731 -38.587 1.00 36.14 C ATOM 0 H ALA A 136 19.046 71.087 -38.956 1.00 37.92 H new ATOM 0 HA ALA A 136 18.105 69.184 -40.285 1.00 37.81 H new ATOM 0 HB1 ALA A 136 16.402 69.089 -38.699 1.00 36.14 H new ATOM 0 HB2 ALA A 136 17.790 69.365 -37.987 1.00 36.14 H new ATOM 0 HB3 ALA A 136 16.766 70.552 -38.212 1.00 36.14 H new ATOM 1151 N ALA A 137 16.182 71.721 -40.871 1.00 38.43 N ATOM 1152 CA ALA A 137 15.210 72.223 -41.841 1.00 38.32 C ATOM 1153 C ALA A 137 15.798 72.350 -43.188 1.00 40.21 C ATOM 1154 O ALA A 137 15.072 72.313 -44.167 1.00 40.76 O ATOM 1155 CB ALA A 137 14.678 73.500 -41.443 1.00 37.22 C ATOM 0 H ALA A 137 16.346 72.258 -40.220 1.00 38.43 H new ATOM 0 HA ALA A 137 14.492 71.571 -41.869 1.00 38.32 H new ATOM 0 HB1 ALA A 137 14.038 73.805 -42.105 1.00 37.22 H new ATOM 0 HB2 ALA A 137 14.237 73.413 -40.584 1.00 37.22 H new ATOM 0 HB3 ALA A 137 15.400 74.144 -41.372 1.00 37.22 H new ATOM 1156 N LYS A 138 17.112 72.520 -43.279 1.00 42.78 N ATOM 1157 CA LYS A 138 17.709 72.926 -44.584 1.00 44.71 C ATOM 1158 C LYS A 138 18.107 71.690 -45.344 1.00 45.05 C ATOM 1159 O LYS A 138 17.807 71.590 -46.544 1.00 45.35 O ATOM 1160 CB LYS A 138 18.924 73.836 -44.391 1.00 45.86 C ATOM 1161 CG LYS A 138 19.414 74.585 -45.648 1.00 49.32 C ATOM 1162 CD LYS A 138 19.771 76.081 -45.256 1.00 53.25 C ATOM 1163 CE LYS A 138 20.902 76.800 -46.090 1.00 53.31 C ATOM 1164 NZ LYS A 138 21.463 76.106 -47.342 1.00 55.17 N ATOM 0 H LYS A 138 17.670 72.414 -42.634 1.00 42.78 H new ATOM 0 HA LYS A 138 17.046 73.428 -45.083 1.00 44.71 H new ATOM 0 HB2 LYS A 138 18.710 74.491 -43.709 1.00 45.86 H new ATOM 0 HB3 LYS A 138 19.657 73.300 -44.050 1.00 45.86 H new ATOM 0 HG2 LYS A 138 20.193 74.142 -46.019 1.00 49.32 H new ATOM 0 HG3 LYS A 138 18.727 74.573 -46.333 1.00 49.32 H new ATOM 0 HD2 LYS A 138 18.962 76.611 -45.329 1.00 53.25 H new ATOM 0 HD3 LYS A 138 20.034 76.092 -44.322 1.00 53.25 H new ATOM 0 HE2 LYS A 138 20.558 77.665 -46.364 1.00 53.31 H new ATOM 0 HE3 LYS A 138 21.646 76.968 -45.490 1.00 53.31 H new ATOM 0 HZ1 LYS A 138 21.858 76.709 -47.864 1.00 55.17 H new ATOM 0 HZ2 LYS A 138 22.058 75.490 -47.099 1.00 55.17 H new ATOM 0 HZ3 LYS A 138 20.799 75.717 -47.789 1.00 55.17 H new ATOM 1165 N TYR A 139 18.756 70.753 -44.620 1.00 44.37 N ATOM 1166 CA TYR A 139 19.288 69.515 -45.205 1.00 42.93 C ATOM 1167 C TYR A 139 18.706 68.253 -44.627 1.00 41.65 C ATOM 1168 O TYR A 139 19.062 67.178 -45.082 1.00 42.38 O ATOM 1169 CB TYR A 139 20.793 69.427 -45.058 1.00 43.32 C ATOM 1170 CG TYR A 139 21.490 70.624 -45.544 1.00 43.87 C ATOM 1171 CD1 TYR A 139 21.675 70.811 -46.909 1.00 43.78 C ATOM 1172 CD2 TYR A 139 21.982 71.597 -44.643 1.00 44.76 C ATOM 1173 CE1 TYR A 139 22.340 71.932 -47.395 1.00 45.58 C ATOM 1174 CE2 TYR A 139 22.644 72.739 -45.120 1.00 44.39 C ATOM 1175 CZ TYR A 139 22.806 72.896 -46.509 1.00 45.00 C ATOM 1176 OH TYR A 139 23.445 73.975 -47.055 1.00 45.99 O ATOM 0 H TYR A 139 18.897 70.825 -43.775 1.00 44.37 H new ATOM 0 HA TYR A 139 19.028 69.572 -46.138 1.00 42.93 H new ATOM 0 HB2 TYR A 139 21.014 69.288 -44.124 1.00 43.32 H new ATOM 0 HB3 TYR A 139 21.115 68.652 -45.544 1.00 43.32 H new ATOM 0 HD1 TYR A 139 21.349 70.177 -47.506 1.00 43.78 H new ATOM 0 HD2 TYR A 139 21.866 71.479 -43.728 1.00 44.76 H new ATOM 0 HE1 TYR A 139 22.472 72.036 -48.310 1.00 45.58 H new ATOM 0 HE2 TYR A 139 22.969 73.380 -44.529 1.00 44.39 H new ATOM 0 HH TYR A 139 23.290 74.004 -47.880 1.00 45.99 H new ATOM 1177 N GLY A 140 17.805 68.347 -43.658 1.00 39.23 N ATOM 1178 CA GLY A 140 17.278 67.142 -43.075 1.00 36.23 C ATOM 1179 C GLY A 140 16.017 66.806 -43.793 1.00 35.24 C ATOM 1180 O GLY A 140 15.372 65.813 -43.483 1.00 36.85 O ATOM 0 H GLY A 140 17.497 69.082 -43.336 1.00 39.23 H new ATOM 0 HA2 GLY A 140 17.918 66.417 -43.154 1.00 36.23 H new ATOM 0 HA3 GLY A 140 17.108 67.268 -42.128 1.00 36.23 H new ATOM 1181 N ASP A 141 15.624 67.623 -44.739 1.00 32.63 N ATOM 1182 CA ASP A 141 14.313 67.444 -45.222 1.00 31.82 C ATOM 1183 C ASP A 141 14.365 67.006 -46.676 1.00 31.42 C ATOM 1184 O ASP A 141 14.771 67.759 -47.555 1.00 32.26 O ATOM 1185 CB ASP A 141 13.525 68.731 -45.025 1.00 31.28 C ATOM 1186 CG ASP A 141 12.100 68.720 -45.695 1.00 32.50 C ATOM 1187 OD1 ASP A 141 11.499 69.815 -45.809 1.00 36.91 O ATOM 1188 OD2 ASP A 141 11.543 67.689 -46.141 1.00 29.50 O ATOM 0 H ASP A 141 16.085 68.256 -45.094 1.00 32.63 H new ATOM 0 HA ASP A 141 13.857 66.745 -44.727 1.00 31.82 H new ATOM 0 HB2 ASP A 141 13.424 68.895 -44.074 1.00 31.28 H new ATOM 0 HB3 ASP A 141 14.037 69.471 -45.387 1.00 31.28 H new ATOM 1189 N LEU A 142 13.874 65.808 -46.944 1.00 30.74 N ATOM 1190 CA LEU A 142 13.928 65.255 -48.290 1.00 29.88 C ATOM 1191 C LEU A 142 12.972 65.875 -49.350 1.00 30.20 C ATOM 1192 O LEU A 142 13.314 65.945 -50.563 1.00 30.36 O ATOM 1193 CB LEU A 142 13.857 63.722 -48.227 1.00 30.63 C ATOM 1194 CG LEU A 142 14.956 63.133 -47.345 1.00 28.27 C ATOM 1195 CD1 LEU A 142 14.632 61.786 -46.813 1.00 28.92 C ATOM 1196 CD2 LEU A 142 16.208 63.106 -48.147 1.00 29.87 C ATOM 0 H LEU A 142 13.504 65.296 -46.361 1.00 30.74 H new ATOM 0 HA LEU A 142 14.790 65.527 -48.641 1.00 29.88 H new ATOM 0 HB2 LEU A 142 12.990 63.453 -47.885 1.00 30.63 H new ATOM 0 HB3 LEU A 142 13.933 63.359 -49.123 1.00 30.63 H new ATOM 0 HG LEU A 142 15.055 63.693 -46.559 1.00 28.27 H new ATOM 0 HD11 LEU A 142 15.366 61.470 -46.264 1.00 28.92 H new ATOM 0 HD12 LEU A 142 13.825 61.835 -46.276 1.00 28.92 H new ATOM 0 HD13 LEU A 142 14.492 61.172 -47.550 1.00 28.92 H new ATOM 0 HD21 LEU A 142 16.927 62.736 -47.612 1.00 29.87 H new ATOM 0 HD22 LEU A 142 16.076 62.556 -48.935 1.00 29.87 H new ATOM 0 HD23 LEU A 142 16.439 64.008 -48.418 1.00 29.87 H new ATOM 1197 N GLY A 143 11.793 66.332 -48.952 1.00 29.00 N ATOM 1198 CA GLY A 143 10.977 66.920 -49.956 1.00 27.96 C ATOM 1199 C GLY A 143 10.102 65.852 -50.501 1.00 27.84 C ATOM 1200 O GLY A 143 9.208 65.444 -49.829 1.00 29.23 O ATOM 0 H GLY A 143 11.474 66.309 -48.154 1.00 29.00 H new ATOM 0 HA2 GLY A 143 10.445 67.641 -49.584 1.00 27.96 H new ATOM 0 HA3 GLY A 143 11.524 67.305 -50.659 1.00 27.96 H new ATOM 1201 N LEU A 144 10.376 65.382 -51.707 1.00 28.26 N ATOM 1202 CA LEU A 144 9.598 64.291 -52.311 1.00 28.25 C ATOM 1203 C LEU A 144 9.924 62.879 -51.801 1.00 28.10 C ATOM 1204 O LEU A 144 10.864 62.227 -52.294 1.00 30.16 O ATOM 1205 CB LEU A 144 9.747 64.360 -53.808 1.00 27.74 C ATOM 1206 CG LEU A 144 9.178 65.752 -53.996 1.00 28.68 C ATOM 1207 CD1 LEU A 144 9.239 66.109 -55.424 1.00 31.80 C ATOM 1208 CD2 LEU A 144 7.779 65.885 -53.464 1.00 28.30 C ATOM 0 H LEU A 144 11.013 65.679 -52.203 1.00 28.26 H new ATOM 0 HA LEU A 144 8.679 64.434 -52.036 1.00 28.25 H new ATOM 0 HB2 LEU A 144 10.668 64.282 -54.103 1.00 27.74 H new ATOM 0 HB3 LEU A 144 9.241 63.676 -54.273 1.00 27.74 H new ATOM 0 HG LEU A 144 9.719 66.370 -53.479 1.00 28.68 H new ATOM 0 HD11 LEU A 144 8.876 67.000 -55.551 1.00 31.80 H new ATOM 0 HD12 LEU A 144 10.162 66.091 -55.723 1.00 31.80 H new ATOM 0 HD13 LEU A 144 8.720 65.472 -55.939 1.00 31.80 H new ATOM 0 HD21 LEU A 144 7.462 66.790 -53.608 1.00 28.30 H new ATOM 0 HD22 LEU A 144 7.196 65.262 -53.926 1.00 28.30 H new ATOM 0 HD23 LEU A 144 7.774 65.689 -52.514 1.00 28.30 H new ATOM 1209 N VAL A 145 9.137 62.430 -50.819 1.00 27.06 N ATOM 1210 CA VAL A 145 9.177 61.093 -50.228 1.00 24.55 C ATOM 1211 C VAL A 145 7.771 60.611 -49.799 1.00 24.00 C ATOM 1212 O VAL A 145 6.766 61.373 -49.835 1.00 24.39 O ATOM 1213 CB VAL A 145 10.114 60.980 -49.048 1.00 24.44 C ATOM 1214 CG1 VAL A 145 11.386 60.577 -49.544 1.00 24.48 C ATOM 1215 CG2 VAL A 145 10.232 62.273 -48.348 1.00 22.39 C ATOM 0 H VAL A 145 8.533 62.927 -50.462 1.00 27.06 H new ATOM 0 HA VAL A 145 9.518 60.523 -50.935 1.00 24.55 H new ATOM 0 HB VAL A 145 9.771 60.332 -48.413 1.00 24.44 H new ATOM 0 HG11 VAL A 145 12.010 60.496 -48.806 1.00 24.48 H new ATOM 0 HG12 VAL A 145 11.302 59.721 -49.992 1.00 24.48 H new ATOM 0 HG13 VAL A 145 11.713 61.239 -50.173 1.00 24.48 H new ATOM 0 HG21 VAL A 145 10.837 62.180 -47.595 1.00 22.39 H new ATOM 0 HG22 VAL A 145 10.578 62.942 -48.959 1.00 22.39 H new ATOM 0 HG23 VAL A 145 9.359 62.549 -48.028 1.00 22.39 H new ATOM 1216 N TYR A 146 7.669 59.320 -49.499 1.00 21.72 N ATOM 1217 CA TYR A 146 6.372 58.762 -49.362 1.00 21.34 C ATOM 1218 C TYR A 146 5.535 59.601 -48.435 1.00 19.89 C ATOM 1219 O TYR A 146 4.453 60.003 -48.838 1.00 21.13 O ATOM 1220 CB TYR A 146 6.489 57.357 -48.905 1.00 22.25 C ATOM 1221 CG TYR A 146 7.116 56.482 -49.971 1.00 24.65 C ATOM 1222 CD1 TYR A 146 6.464 56.248 -51.183 1.00 24.11 C ATOM 1223 CD2 TYR A 146 8.368 55.932 -49.772 1.00 24.34 C ATOM 1224 CE1 TYR A 146 7.055 55.470 -52.157 1.00 27.05 C ATOM 1225 CE2 TYR A 146 8.951 55.157 -50.709 1.00 26.06 C ATOM 1226 CZ TYR A 146 8.300 54.911 -51.902 1.00 25.58 C ATOM 1227 OH TYR A 146 8.911 54.109 -52.797 1.00 20.32 O ATOM 0 H TYR A 146 8.327 58.780 -49.378 1.00 21.72 H new ATOM 0 HA TYR A 146 5.919 58.759 -50.220 1.00 21.34 H new ATOM 0 HB2 TYR A 146 7.025 57.321 -48.097 1.00 22.25 H new ATOM 0 HB3 TYR A 146 5.610 57.014 -48.678 1.00 22.25 H new ATOM 0 HD1 TYR A 146 5.625 56.619 -51.335 1.00 24.11 H new ATOM 0 HD2 TYR A 146 8.818 56.100 -48.975 1.00 24.34 H new ATOM 0 HE1 TYR A 146 6.627 55.323 -52.970 1.00 27.05 H new ATOM 0 HE2 TYR A 146 9.790 54.789 -50.552 1.00 26.06 H new ATOM 0 HH TYR A 146 9.740 54.238 -52.769 1.00 20.32 H new ATOM 1228 N GLY A 147 6.040 59.956 -47.262 1.00 17.38 N ATOM 1229 CA GLY A 147 5.243 60.769 -46.304 1.00 19.85 C ATOM 1230 C GLY A 147 4.508 62.004 -46.918 1.00 20.97 C ATOM 1231 O GLY A 147 3.374 62.276 -46.599 1.00 22.77 O ATOM 0 H GLY A 147 6.829 59.748 -46.990 1.00 17.38 H new ATOM 0 HA2 GLY A 147 4.583 60.194 -45.887 1.00 19.85 H new ATOM 0 HA3 GLY A 147 5.833 61.081 -45.600 1.00 19.85 H new ATOM 1232 N SER A 148 5.112 62.733 -47.857 1.00 20.67 N ATOM 1233 CA SER A 148 4.422 63.845 -48.398 1.00 20.20 C ATOM 1234 C SER A 148 3.641 63.419 -49.636 1.00 20.32 C ATOM 1235 O SER A 148 2.605 64.042 -49.913 1.00 20.91 O ATOM 1236 CB SER A 148 5.357 64.972 -48.766 1.00 19.16 C ATOM 1237 OG SER A 148 6.129 64.556 -49.838 1.00 22.84 O ATOM 0 H SER A 148 5.899 62.589 -48.173 1.00 20.67 H new ATOM 0 HA SER A 148 3.817 64.169 -47.712 1.00 20.20 H new ATOM 0 HB2 SER A 148 4.854 65.768 -48.999 1.00 19.16 H new ATOM 0 HB3 SER A 148 5.921 65.204 -48.012 1.00 19.16 H new ATOM 0 HG SER A 148 6.915 64.838 -49.744 1.00 22.84 H new ATOM 1238 N GLN A 149 4.097 62.392 -50.363 1.00 19.47 N ATOM 1239 CA GLN A 149 3.260 61.799 -51.426 1.00 18.39 C ATOM 1240 C GLN A 149 2.002 61.245 -50.956 1.00 18.36 C ATOM 1241 O GLN A 149 0.988 61.415 -51.621 1.00 19.42 O ATOM 1242 CB GLN A 149 3.994 60.775 -52.233 1.00 19.31 C ATOM 1243 CG GLN A 149 5.176 61.449 -52.814 1.00 18.83 C ATOM 1244 CD GLN A 149 6.372 60.575 -53.039 1.00 22.51 C ATOM 1245 OE1 GLN A 149 6.542 59.490 -52.270 1.00 30.19 O flip ATOM 1246 NE2 GLN A 149 7.189 60.924 -53.892 1.00 18.32 N flip ATOM 0 H GLN A 149 4.870 62.028 -50.263 1.00 19.47 H new ATOM 0 HA GLN A 149 3.043 62.552 -51.997 1.00 18.39 H new ATOM 0 HB2 GLN A 149 4.264 60.028 -51.676 1.00 19.31 H new ATOM 0 HB3 GLN A 149 3.425 60.417 -52.932 1.00 19.31 H new ATOM 0 HG2 GLN A 149 4.919 61.844 -53.662 1.00 18.83 H new ATOM 0 HG3 GLN A 149 5.433 62.178 -52.228 1.00 18.83 H new ATOM 0 HE21 GLN A 149 7.043 61.627 -54.365 1.00 18.32 H new ATOM 0 HE22 GLN A 149 7.906 60.465 -54.014 1.00 18.32 H new ATOM 1247 N TRP A 150 2.016 60.612 -49.802 1.00 18.80 N ATOM 1248 CA TRP A 150 0.777 59.962 -49.328 1.00 19.70 C ATOM 1249 C TRP A 150 -0.169 60.991 -48.744 1.00 20.46 C ATOM 1250 O TRP A 150 -1.411 60.860 -48.853 1.00 21.85 O ATOM 1251 CB TRP A 150 1.070 58.873 -48.245 1.00 18.63 C ATOM 1252 CG TRP A 150 1.807 57.628 -48.687 1.00 19.77 C ATOM 1253 CD1 TRP A 150 2.076 57.232 -49.974 1.00 15.34 C ATOM 1254 CD2 TRP A 150 2.187 56.511 -47.842 1.00 17.81 C ATOM 1255 NE1 TRP A 150 2.664 56.020 -49.978 1.00 11.37 N ATOM 1256 CE2 TRP A 150 2.741 55.536 -48.693 1.00 13.54 C ATOM 1257 CE3 TRP A 150 2.075 56.250 -46.459 1.00 12.16 C ATOM 1258 CZ2 TRP A 150 3.262 54.345 -48.216 1.00 16.79 C ATOM 1259 CZ3 TRP A 150 2.561 55.137 -45.971 1.00 13.69 C ATOM 1260 CH2 TRP A 150 3.167 54.137 -46.847 1.00 20.41 C ATOM 0 H TRP A 150 2.698 60.539 -49.283 1.00 18.80 H new ATOM 0 HA TRP A 150 0.369 59.533 -50.097 1.00 19.70 H new ATOM 0 HB2 TRP A 150 1.583 59.288 -47.534 1.00 18.63 H new ATOM 0 HB3 TRP A 150 0.223 58.599 -47.860 1.00 18.63 H new ATOM 0 HD1 TRP A 150 1.880 57.730 -50.735 1.00 15.34 H new ATOM 0 HE1 TRP A 150 2.948 55.610 -50.679 1.00 11.37 H new ATOM 0 HE3 TRP A 150 1.659 56.865 -45.899 1.00 12.16 H new ATOM 0 HZ2 TRP A 150 3.654 53.719 -48.782 1.00 16.79 H new ATOM 0 HZ3 TRP A 150 2.520 54.981 -45.055 1.00 13.69 H new ATOM 0 HH2 TRP A 150 3.495 53.347 -46.481 1.00 20.41 H new ATOM 1261 N ARG A 151 0.414 61.998 -48.064 1.00 21.98 N ATOM 1262 CA ARG A 151 -0.366 62.915 -47.192 1.00 21.66 C ATOM 1263 C ARG A 151 -0.310 64.411 -47.522 1.00 21.65 C ATOM 1264 O ARG A 151 -0.753 65.244 -46.666 1.00 23.56 O ATOM 1265 CB ARG A 151 0.041 62.751 -45.723 1.00 22.09 C ATOM 1266 CG ARG A 151 0.178 61.347 -45.300 1.00 24.89 C ATOM 1267 CD ARG A 151 -0.208 61.068 -43.858 1.00 26.13 C ATOM 1268 NE ARG A 151 -1.501 61.688 -43.615 1.00 28.62 N ATOM 1269 CZ ARG A 151 -1.861 62.214 -42.449 1.00 25.62 C ATOM 1270 NH1 ARG A 151 -3.021 62.812 -42.314 1.00 24.10 N ATOM 1271 NH2 ARG A 151 -1.060 62.158 -41.410 1.00 25.95 N ATOM 0 H ARG A 151 1.256 62.169 -48.092 1.00 21.98 H new ATOM 0 HA ARG A 151 -1.279 62.637 -47.365 1.00 21.66 H new ATOM 0 HB2 ARG A 151 0.884 63.208 -45.576 1.00 22.09 H new ATOM 0 HB3 ARG A 151 -0.620 63.187 -45.162 1.00 22.09 H new ATOM 0 HG2 ARG A 151 -0.369 60.794 -45.879 1.00 24.89 H new ATOM 0 HG3 ARG A 151 1.099 61.072 -45.433 1.00 24.89 H new ATOM 0 HD2 ARG A 151 -0.254 60.113 -43.697 1.00 26.13 H new ATOM 0 HD3 ARG A 151 0.460 61.426 -43.252 1.00 26.13 H new ATOM 0 HE ARG A 151 -2.065 61.716 -44.263 1.00 28.62 H new ATOM 0 HH11 ARG A 151 -3.557 62.867 -42.984 1.00 24.10 H new ATOM 0 HH12 ARG A 151 -3.245 63.149 -41.555 1.00 24.10 H new ATOM 0 HH21 ARG A 151 -0.292 61.777 -41.479 1.00 25.95 H new ATOM 0 HH22 ARG A 151 -1.304 62.502 -40.660 1.00 25.95 H new ATOM 1272 N ALA A 152 0.211 64.812 -48.690 1.00 18.76 N ATOM 1273 CA ALA A 152 0.447 66.200 -48.872 1.00 18.92 C ATOM 1274 C ALA A 152 0.890 66.329 -50.289 1.00 22.33 C ATOM 1275 O ALA A 152 2.022 66.801 -50.546 1.00 19.84 O ATOM 1276 CB ALA A 152 1.589 66.615 -48.013 1.00 17.02 C ATOM 0 H ALA A 152 0.419 64.302 -49.350 1.00 18.76 H new ATOM 0 HA ALA A 152 -0.335 66.733 -48.658 1.00 18.92 H new ATOM 0 HB1 ALA A 152 1.756 67.563 -48.132 1.00 17.02 H new ATOM 0 HB2 ALA A 152 1.375 66.439 -47.083 1.00 17.02 H new ATOM 0 HB3 ALA A 152 2.381 66.114 -48.263 1.00 17.02 H new ATOM 1277 N TRP A 153 0.052 65.841 -51.204 1.00 24.63 N ATOM 1278 CA TRP A 153 0.442 65.704 -52.589 1.00 27.72 C ATOM 1279 C TRP A 153 0.174 67.140 -53.139 1.00 30.55 C ATOM 1280 O TRP A 153 -0.941 67.680 -53.003 1.00 31.98 O ATOM 1281 CB TRP A 153 -0.458 64.614 -53.254 1.00 26.17 C ATOM 1282 CG TRP A 153 -0.359 64.527 -54.728 1.00 24.66 C ATOM 1283 CD1 TRP A 153 -0.810 65.446 -55.654 1.00 25.83 C ATOM 1284 CD2 TRP A 153 0.265 63.472 -55.485 1.00 26.91 C ATOM 1285 NE1 TRP A 153 -0.510 65.018 -56.958 1.00 27.63 N ATOM 1286 CE2 TRP A 153 0.133 63.803 -56.874 1.00 28.21 C ATOM 1287 CE3 TRP A 153 0.908 62.269 -55.138 1.00 23.44 C ATOM 1288 CZ2 TRP A 153 0.622 62.955 -57.896 1.00 25.92 C ATOM 1289 CZ3 TRP A 153 1.400 61.463 -56.164 1.00 24.52 C ATOM 1290 CH2 TRP A 153 1.248 61.805 -57.509 1.00 22.63 C ATOM 0 H TRP A 153 -0.751 65.584 -51.033 1.00 24.63 H new ATOM 0 HA TRP A 153 1.355 65.420 -52.751 1.00 27.72 H new ATOM 0 HB2 TRP A 153 -0.227 63.751 -52.877 1.00 26.17 H new ATOM 0 HB3 TRP A 153 -1.382 64.789 -53.016 1.00 26.17 H new ATOM 0 HD1 TRP A 153 -1.251 66.238 -55.444 1.00 25.83 H new ATOM 0 HE1 TRP A 153 -0.696 65.441 -57.683 1.00 27.63 H new ATOM 0 HE3 TRP A 153 1.002 62.018 -54.247 1.00 23.44 H new ATOM 0 HZ2 TRP A 153 0.521 63.172 -58.795 1.00 25.92 H new ATOM 0 HZ3 TRP A 153 1.842 60.675 -55.946 1.00 24.52 H new ATOM 0 HH2 TRP A 153 1.583 61.232 -58.161 1.00 22.63 H new ATOM 1291 N HIS A 154 1.150 67.777 -53.742 1.00 33.56 N ATOM 1292 CA HIS A 154 0.892 69.137 -54.238 1.00 37.37 C ATOM 1293 C HIS A 154 0.015 69.284 -55.454 1.00 38.28 C ATOM 1294 O HIS A 154 0.324 68.725 -56.501 1.00 38.97 O ATOM 1295 CB HIS A 154 2.196 69.833 -54.501 1.00 37.63 C ATOM 1296 CG HIS A 154 2.923 70.140 -53.247 1.00 46.06 C ATOM 1297 ND1 HIS A 154 3.726 69.212 -52.612 1.00 52.00 N ATOM 1298 CD2 HIS A 154 2.892 71.234 -52.440 1.00 52.00 C ATOM 1299 CE1 HIS A 154 4.200 69.744 -51.493 1.00 54.06 C ATOM 1300 NE2 HIS A 154 3.707 70.966 -51.363 1.00 52.25 N ATOM 0 H HIS A 154 1.942 67.470 -53.878 1.00 33.56 H new ATOM 0 HA HIS A 154 0.379 69.541 -53.521 1.00 37.37 H new ATOM 0 HB2 HIS A 154 2.751 69.275 -55.068 1.00 37.63 H new ATOM 0 HB3 HIS A 154 2.030 70.656 -54.988 1.00 37.63 H new ATOM 0 HD2 HIS A 154 2.411 72.016 -52.588 1.00 52.00 H new ATOM 0 HE1 HIS A 154 4.782 69.328 -50.899 1.00 54.06 H new ATOM 0 HE2 HIS A 154 3.869 71.504 -50.712 1.00 52.25 H new ATOM 1301 N THR A 155 -1.046 70.074 -55.332 1.00 40.76 N ATOM 1302 CA THR A 155 -1.933 70.339 -56.458 1.00 44.11 C ATOM 1303 C THR A 155 -1.318 71.425 -57.322 1.00 47.57 C ATOM 1304 O THR A 155 -0.246 71.972 -57.015 1.00 48.99 O ATOM 1305 CB THR A 155 -3.407 70.682 -56.043 1.00 43.52 C ATOM 1306 OG1 THR A 155 -3.445 71.852 -55.210 1.00 42.98 O ATOM 1307 CG2 THR A 155 -4.003 69.519 -55.318 1.00 40.97 C ATOM 0 H THR A 155 -1.271 70.468 -54.601 1.00 40.76 H new ATOM 0 HA THR A 155 -2.014 69.518 -56.968 1.00 44.11 H new ATOM 0 HB THR A 155 -3.922 70.865 -56.845 1.00 43.52 H new ATOM 0 HG1 THR A 155 -4.172 72.256 -55.328 1.00 42.98 H new ATOM 0 HG21 THR A 155 -4.914 69.730 -55.061 1.00 40.97 H new ATOM 0 HG22 THR A 155 -4.003 68.741 -55.898 1.00 40.97 H new ATOM 0 HG23 THR A 155 -3.479 69.330 -54.524 1.00 40.97 H new ATOM 1308 N SER A 156 -1.966 71.709 -58.436 1.00 50.34 N ATOM 1309 CA SER A 156 -1.443 72.704 -59.360 1.00 53.06 C ATOM 1310 C SER A 156 -2.078 74.027 -58.975 1.00 54.00 C ATOM 1311 O SER A 156 -1.400 75.024 -58.874 1.00 55.32 O ATOM 1312 CB SER A 156 -1.741 72.306 -60.813 1.00 53.07 C ATOM 1313 OG SER A 156 -3.127 72.048 -60.933 1.00 55.18 O ATOM 0 H SER A 156 -2.705 71.342 -58.678 1.00 50.34 H new ATOM 0 HA SER A 156 -0.477 72.774 -59.303 1.00 53.06 H new ATOM 0 HB2 SER A 156 -1.477 73.017 -61.418 1.00 53.07 H new ATOM 0 HB3 SER A 156 -1.229 71.519 -61.059 1.00 53.07 H new ATOM 0 HG SER A 156 -3.304 71.830 -61.725 1.00 55.18 H new ATOM 1314 N LYS A 157 -3.377 74.024 -58.733 1.00 55.14 N ATOM 1315 CA LYS A 157 -4.023 75.088 -57.957 1.00 56.37 C ATOM 1316 C LYS A 157 -3.285 75.445 -56.634 1.00 55.33 C ATOM 1317 O LYS A 157 -3.770 76.265 -55.810 1.00 54.41 O ATOM 1318 CB LYS A 157 -5.462 74.653 -57.625 1.00 58.12 C ATOM 1319 CG LYS A 157 -6.323 74.279 -58.866 1.00 61.88 C ATOM 1320 CD LYS A 157 -7.115 75.477 -59.406 1.00 67.63 C ATOM 1321 CE LYS A 157 -6.964 75.577 -60.933 1.00 70.98 C ATOM 1322 NZ LYS A 157 -5.620 75.095 -61.432 1.00 69.90 N ATOM 0 H LYS A 157 -3.914 73.412 -59.009 1.00 55.14 H new ATOM 0 HA LYS A 157 -4.002 75.886 -58.507 1.00 56.37 H new ATOM 0 HB2 LYS A 157 -5.428 73.890 -57.027 1.00 58.12 H new ATOM 0 HB3 LYS A 157 -5.902 75.371 -57.144 1.00 58.12 H new ATOM 0 HG2 LYS A 157 -5.746 73.933 -59.565 1.00 61.88 H new ATOM 0 HG3 LYS A 157 -6.938 73.568 -58.628 1.00 61.88 H new ATOM 0 HD2 LYS A 157 -8.052 75.384 -59.173 1.00 67.63 H new ATOM 0 HD3 LYS A 157 -6.800 76.294 -58.990 1.00 67.63 H new ATOM 0 HE2 LYS A 157 -7.665 75.057 -61.356 1.00 70.98 H new ATOM 0 HE3 LYS A 157 -7.092 76.499 -61.205 1.00 70.98 H new ATOM 0 HZ1 LYS A 157 -5.486 75.394 -62.260 1.00 69.90 H new ATOM 0 HZ2 LYS A 157 -4.977 75.402 -60.898 1.00 69.90 H new ATOM 0 HZ3 LYS A 157 -5.605 74.205 -61.432 1.00 69.90 H new ATOM 1323 N GLY A 158 -2.136 74.797 -56.408 1.00 54.29 N ATOM 1324 CA GLY A 158 -1.284 75.163 -55.267 1.00 52.27 C ATOM 1325 C GLY A 158 -1.748 74.787 -53.859 1.00 50.82 C ATOM 1326 O GLY A 158 -1.108 75.169 -52.888 1.00 50.89 O ATOM 0 H GLY A 158 -1.835 74.154 -56.893 1.00 54.29 H new ATOM 0 HA2 GLY A 158 -0.413 74.760 -55.408 1.00 52.27 H new ATOM 0 HA3 GLY A 158 -1.158 76.125 -55.289 1.00 52.27 H new ATOM 1327 N ASP A 159 -2.816 73.999 -53.719 1.00 49.12 N ATOM 1328 CA ASP A 159 -3.040 73.349 -52.436 1.00 47.50 C ATOM 1329 C ASP A 159 -2.193 72.062 -52.179 1.00 44.92 C ATOM 1330 O ASP A 159 -1.117 71.848 -52.751 1.00 44.07 O ATOM 1331 CB ASP A 159 -4.529 73.089 -52.202 1.00 48.69 C ATOM 1332 CG ASP A 159 -4.882 73.041 -50.706 1.00 52.28 C ATOM 1333 OD1 ASP A 159 -3.978 73.068 -49.814 1.00 54.97 O ATOM 1334 OD2 ASP A 159 -6.092 72.971 -50.402 1.00 58.17 O ATOM 0 H ASP A 159 -3.399 73.835 -54.330 1.00 49.12 H new ATOM 0 HA ASP A 159 -2.717 73.986 -51.780 1.00 47.50 H new ATOM 0 HB2 ASP A 159 -5.049 73.785 -52.633 1.00 48.69 H new ATOM 0 HB3 ASP A 159 -4.778 72.249 -52.619 1.00 48.69 H new ATOM 1335 N THR A 160 -2.681 71.239 -51.265 1.00 42.35 N ATOM 1336 CA THR A 160 -1.991 70.049 -50.855 1.00 40.45 C ATOM 1337 C THR A 160 -3.019 69.032 -50.410 1.00 38.91 C ATOM 1338 O THR A 160 -3.821 69.321 -49.535 1.00 40.73 O ATOM 1339 CB THR A 160 -1.014 70.400 -49.795 1.00 40.84 C ATOM 1340 OG1 THR A 160 0.263 69.901 -50.184 1.00 41.72 O ATOM 1341 CG2 THR A 160 -1.399 69.907 -48.430 1.00 41.60 C ATOM 0 H THR A 160 -3.432 71.364 -50.865 1.00 42.35 H new ATOM 0 HA THR A 160 -1.486 69.653 -51.583 1.00 40.45 H new ATOM 0 HB THR A 160 -0.994 71.366 -49.712 1.00 40.84 H new ATOM 0 HG1 THR A 160 0.830 70.092 -49.595 1.00 41.72 H new ATOM 0 HG21 THR A 160 -0.721 70.169 -47.788 1.00 41.60 H new ATOM 0 HG22 THR A 160 -2.252 70.293 -48.175 1.00 41.60 H new ATOM 0 HG23 THR A 160 -1.474 68.940 -48.444 1.00 41.60 H new ATOM 1342 N ILE A 161 -3.047 67.878 -51.080 1.00 35.81 N ATOM 1343 CA ILE A 161 -4.002 66.795 -50.806 1.00 32.68 C ATOM 1344 C ILE A 161 -3.471 65.625 -49.923 1.00 29.61 C ATOM 1345 O ILE A 161 -2.381 65.091 -50.174 1.00 29.29 O ATOM 1346 CB ILE A 161 -4.381 66.145 -52.125 1.00 32.60 C ATOM 1347 CG1 ILE A 161 -5.214 67.117 -52.935 1.00 35.35 C ATOM 1348 CG2 ILE A 161 -5.214 64.939 -51.863 1.00 32.82 C ATOM 1349 CD1 ILE A 161 -5.593 66.606 -54.309 1.00 39.89 C ATOM 0 H ILE A 161 -2.501 67.697 -51.720 1.00 35.81 H new ATOM 0 HA ILE A 161 -4.727 67.227 -50.328 1.00 32.68 H new ATOM 0 HB ILE A 161 -3.573 65.901 -52.604 1.00 32.60 H new ATOM 0 HG12 ILE A 161 -6.024 67.324 -52.442 1.00 35.35 H new ATOM 0 HG13 ILE A 161 -4.722 67.947 -53.033 1.00 35.35 H new ATOM 0 HG21 ILE A 161 -5.456 64.524 -52.705 1.00 32.82 H new ATOM 0 HG22 ILE A 161 -4.710 64.308 -51.325 1.00 32.82 H new ATOM 0 HG23 ILE A 161 -6.019 65.198 -51.388 1.00 32.82 H new ATOM 0 HD11 ILE A 161 -6.123 67.276 -54.769 1.00 39.89 H new ATOM 0 HD12 ILE A 161 -4.789 66.423 -54.820 1.00 39.89 H new ATOM 0 HD13 ILE A 161 -6.111 65.791 -54.220 1.00 39.89 H new ATOM 1350 N ASP A 162 -4.282 65.177 -48.980 1.00 25.56 N ATOM 1351 CA ASP A 162 -3.913 64.066 -48.123 1.00 22.64 C ATOM 1352 C ASP A 162 -4.540 62.775 -48.631 1.00 21.16 C ATOM 1353 O ASP A 162 -5.510 62.339 -48.061 1.00 19.41 O ATOM 1354 CB ASP A 162 -4.479 64.362 -46.755 1.00 21.96 C ATOM 1355 CG ASP A 162 -4.155 63.321 -45.719 1.00 22.13 C ATOM 1356 OD1 ASP A 162 -4.591 63.548 -44.603 1.00 26.04 O ATOM 1357 OD2 ASP A 162 -3.540 62.259 -45.946 1.00 26.86 O ATOM 0 H ASP A 162 -5.060 65.507 -48.819 1.00 25.56 H new ATOM 0 HA ASP A 162 -2.949 63.961 -48.106 1.00 22.64 H new ATOM 0 HB2 ASP A 162 -4.141 65.220 -46.454 1.00 21.96 H new ATOM 0 HB3 ASP A 162 -5.443 64.446 -46.825 1.00 21.96 H new ATOM 1358 N GLN A 163 -3.976 62.148 -49.672 1.00 20.52 N ATOM 1359 CA GLN A 163 -4.654 61.035 -50.296 1.00 19.32 C ATOM 1360 C GLN A 163 -4.988 59.967 -49.250 1.00 20.42 C ATOM 1361 O GLN A 163 -6.132 59.490 -49.127 1.00 19.52 O ATOM 1362 CB GLN A 163 -3.756 60.344 -51.335 1.00 19.25 C ATOM 1363 CG GLN A 163 -3.098 61.164 -52.351 1.00 18.11 C ATOM 1364 CD GLN A 163 -2.360 60.241 -53.349 1.00 16.76 C ATOM 1365 OE1 GLN A 163 -2.994 59.509 -54.101 1.00 8.54 O ATOM 1366 NE2 GLN A 163 -1.016 60.260 -53.321 1.00 15.77 N ATOM 0 H GLN A 163 -3.216 62.355 -50.018 1.00 20.52 H new ATOM 0 HA GLN A 163 -5.452 61.394 -50.715 1.00 19.32 H new ATOM 0 HB2 GLN A 163 -3.065 59.863 -50.853 1.00 19.25 H new ATOM 0 HB3 GLN A 163 -4.295 59.682 -51.795 1.00 19.25 H new ATOM 0 HG2 GLN A 163 -3.753 61.706 -52.818 1.00 18.11 H new ATOM 0 HG3 GLN A 163 -2.470 61.774 -51.933 1.00 18.11 H new ATOM 0 HE21 GLN A 163 -0.605 60.787 -52.780 1.00 15.77 H new ATOM 0 HE22 GLN A 163 -0.568 59.745 -53.844 1.00 15.77 H new ATOM 1367 N LEU A 164 -3.971 59.598 -48.467 1.00 21.63 N ATOM 1368 CA LEU A 164 -4.160 58.504 -47.546 1.00 22.68 C ATOM 1369 C LEU A 164 -5.330 58.758 -46.582 1.00 21.34 C ATOM 1370 O LEU A 164 -6.243 57.913 -46.477 1.00 21.34 O ATOM 1371 CB LEU A 164 -2.834 58.170 -46.822 1.00 23.32 C ATOM 1372 CG LEU A 164 -2.539 56.707 -46.524 1.00 21.45 C ATOM 1373 CD1 LEU A 164 -1.526 56.782 -45.403 1.00 23.80 C ATOM 1374 CD2 LEU A 164 -3.769 56.124 -46.015 1.00 23.25 C ATOM 0 H LEU A 164 -3.192 59.961 -48.460 1.00 21.63 H new ATOM 0 HA LEU A 164 -4.412 57.717 -48.054 1.00 22.68 H new ATOM 0 HB2 LEU A 164 -2.105 58.518 -47.359 1.00 23.32 H new ATOM 0 HB3 LEU A 164 -2.823 58.654 -45.981 1.00 23.32 H new ATOM 0 HG LEU A 164 -2.225 56.190 -47.283 1.00 21.45 H new ATOM 0 HD11 LEU A 164 -1.270 55.885 -45.137 1.00 23.80 H new ATOM 0 HD12 LEU A 164 -0.742 57.265 -45.707 1.00 23.80 H new ATOM 0 HD13 LEU A 164 -1.916 57.244 -44.645 1.00 23.80 H new ATOM 0 HD21 LEU A 164 -3.623 55.187 -45.812 1.00 23.25 H new ATOM 0 HD22 LEU A 164 -4.039 56.591 -45.209 1.00 23.25 H new ATOM 0 HD23 LEU A 164 -4.467 56.204 -46.684 1.00 23.25 H new ATOM 1375 N GLY A 165 -5.358 59.914 -45.905 1.00 20.54 N ATOM 1376 CA GLY A 165 -6.534 60.152 -44.940 1.00 18.54 C ATOM 1377 C GLY A 165 -7.868 60.256 -45.734 1.00 17.91 C ATOM 1378 O GLY A 165 -8.897 59.736 -45.307 1.00 15.84 O ATOM 0 H GLY A 165 -4.775 60.544 -45.958 1.00 20.54 H new ATOM 0 HA2 GLY A 165 -6.587 59.426 -44.299 1.00 18.54 H new ATOM 0 HA3 GLY A 165 -6.386 60.967 -44.434 1.00 18.54 H new ATOM 1379 N ASP A 166 -7.878 60.876 -46.910 1.00 16.19 N ATOM 1380 CA ASP A 166 -9.166 60.796 -47.738 1.00 19.70 C ATOM 1381 C ASP A 166 -9.654 59.368 -48.051 1.00 19.29 C ATOM 1382 O ASP A 166 -10.824 59.032 -47.890 1.00 19.17 O ATOM 1383 CB ASP A 166 -9.096 61.572 -49.080 1.00 19.56 C ATOM 1384 CG ASP A 166 -8.802 63.050 -48.891 1.00 22.55 C ATOM 1385 OD1 ASP A 166 -8.576 63.707 -49.926 1.00 31.51 O ATOM 1386 OD2 ASP A 166 -8.834 63.571 -47.747 1.00 18.24 O ATOM 0 H ASP A 166 -7.228 61.321 -47.255 1.00 16.19 H new ATOM 0 HA ASP A 166 -9.806 61.218 -47.144 1.00 19.70 H new ATOM 0 HB2 ASP A 166 -8.409 61.179 -49.641 1.00 19.56 H new ATOM 0 HB3 ASP A 166 -9.938 61.472 -49.551 1.00 19.56 H new ATOM 1387 N VAL A 167 -8.726 58.528 -48.465 1.00 21.76 N ATOM 1388 CA VAL A 167 -9.013 57.126 -48.746 1.00 23.11 C ATOM 1389 C VAL A 167 -9.514 56.399 -47.521 1.00 24.53 C ATOM 1390 O VAL A 167 -10.516 55.645 -47.599 1.00 27.41 O ATOM 1391 CB VAL A 167 -7.799 56.422 -49.350 1.00 22.81 C ATOM 1392 CG1 VAL A 167 -8.044 54.950 -49.456 1.00 23.28 C ATOM 1393 CG2 VAL A 167 -7.612 56.965 -50.702 1.00 23.66 C ATOM 0 H VAL A 167 -7.905 58.751 -48.593 1.00 21.76 H new ATOM 0 HA VAL A 167 -9.726 57.105 -49.404 1.00 23.11 H new ATOM 0 HB VAL A 167 -7.019 56.566 -48.791 1.00 22.81 H new ATOM 0 HG11 VAL A 167 -7.265 54.519 -49.841 1.00 23.28 H new ATOM 0 HG12 VAL A 167 -8.212 54.585 -48.573 1.00 23.28 H new ATOM 0 HG13 VAL A 167 -8.814 54.790 -50.023 1.00 23.28 H new ATOM 0 HG21 VAL A 167 -6.846 56.540 -51.119 1.00 23.66 H new ATOM 0 HG22 VAL A 167 -8.406 56.793 -51.233 1.00 23.66 H new ATOM 0 HG23 VAL A 167 -7.460 57.922 -50.649 1.00 23.66 H new ATOM 1394 N ILE A 168 -8.898 56.617 -46.383 1.00 24.91 N ATOM 1395 CA ILE A 168 -9.358 55.935 -45.201 1.00 26.12 C ATOM 1396 C ILE A 168 -10.766 56.348 -44.911 1.00 28.59 C ATOM 1397 O ILE A 168 -11.559 55.536 -44.476 1.00 29.56 O ATOM 1398 CB ILE A 168 -8.463 56.265 -44.031 1.00 26.18 C ATOM 1399 CG1 ILE A 168 -7.078 55.592 -44.247 1.00 23.60 C ATOM 1400 CG2 ILE A 168 -9.126 55.896 -42.758 1.00 26.36 C ATOM 1401 CD1 ILE A 168 -6.142 55.706 -43.052 1.00 22.26 C ATOM 0 H ILE A 168 -8.227 57.143 -46.273 1.00 24.91 H new ATOM 0 HA ILE A 168 -9.329 54.977 -45.348 1.00 26.12 H new ATOM 0 HB ILE A 168 -8.304 57.220 -43.973 1.00 26.18 H new ATOM 0 HG12 ILE A 168 -7.213 54.654 -44.452 1.00 23.60 H new ATOM 0 HG13 ILE A 168 -6.651 55.993 -45.020 1.00 23.60 H new ATOM 0 HG21 ILE A 168 -8.542 56.112 -42.014 1.00 26.36 H new ATOM 0 HG22 ILE A 168 -9.957 56.389 -42.671 1.00 26.36 H new ATOM 0 HG23 ILE A 168 -9.314 54.944 -42.755 1.00 26.36 H new ATOM 0 HD11 ILE A 168 -5.302 55.267 -43.256 1.00 22.26 H new ATOM 0 HD12 ILE A 168 -5.978 56.642 -42.857 1.00 22.26 H new ATOM 0 HD13 ILE A 168 -6.549 55.282 -42.280 1.00 22.26 H new ATOM 1402 N GLU A 169 -11.145 57.579 -45.215 1.00 30.93 N ATOM 1403 CA GLU A 169 -12.501 57.967 -44.846 1.00 34.12 C ATOM 1404 C GLU A 169 -13.550 57.442 -45.835 1.00 33.10 C ATOM 1405 O GLU A 169 -14.667 57.028 -45.486 1.00 33.21 O ATOM 1406 CB GLU A 169 -12.548 59.455 -44.504 1.00 35.85 C ATOM 1407 CG GLU A 169 -12.587 60.353 -45.637 1.00 44.18 C ATOM 1408 CD GLU A 169 -13.989 60.939 -45.802 1.00 59.38 C ATOM 1409 OE1 GLU A 169 -14.119 61.898 -46.680 1.00 62.74 O ATOM 1410 OE2 GLU A 169 -14.933 60.447 -45.049 1.00 61.45 O ATOM 0 H GLU A 169 -10.668 58.175 -45.611 1.00 30.93 H new ATOM 0 HA GLU A 169 -12.764 57.521 -44.025 1.00 34.12 H new ATOM 0 HB2 GLU A 169 -13.329 59.620 -43.953 1.00 35.85 H new ATOM 0 HB3 GLU A 169 -11.771 59.672 -43.966 1.00 35.85 H new ATOM 0 HG2 GLU A 169 -11.943 61.068 -45.513 1.00 44.18 H new ATOM 0 HG3 GLU A 169 -12.331 59.878 -46.443 1.00 44.18 H new ATOM 1411 N GLN A 170 -13.092 57.281 -47.045 1.00 33.21 N ATOM 1412 CA GLN A 170 -13.774 56.466 -48.054 1.00 33.67 C ATOM 1413 C GLN A 170 -13.958 55.033 -47.714 1.00 33.97 C ATOM 1414 O GLN A 170 -14.935 54.435 -48.123 1.00 34.67 O ATOM 1415 CB GLN A 170 -12.900 56.426 -49.256 1.00 33.95 C ATOM 1416 CG GLN A 170 -12.999 57.634 -49.999 1.00 38.32 C ATOM 1417 CD GLN A 170 -14.328 57.585 -50.618 1.00 49.07 C ATOM 1418 OE1 GLN A 170 -15.331 58.228 -49.953 1.00 54.33 O flip ATOM 1419 NE2 GLN A 170 -14.513 56.881 -51.658 1.00 51.52 N flip ATOM 0 H GLN A 170 -12.364 57.642 -47.325 1.00 33.21 H new ATOM 0 HA GLN A 170 -14.647 56.876 -48.157 1.00 33.67 H new ATOM 0 HB2 GLN A 170 -11.979 56.283 -48.986 1.00 33.95 H new ATOM 0 HB3 GLN A 170 -13.151 55.676 -49.817 1.00 33.95 H new ATOM 0 HG2 GLN A 170 -12.907 58.410 -49.424 1.00 38.32 H new ATOM 0 HG3 GLN A 170 -12.300 57.693 -50.669 1.00 38.32 H new ATOM 0 HE21 GLN A 170 -13.846 56.496 -52.041 1.00 51.52 H new ATOM 0 HE22 GLN A 170 -15.305 56.789 -51.980 1.00 51.52 H new ATOM 1420 N ILE A 171 -12.991 54.421 -47.047 1.00 33.76 N ATOM 1421 CA ILE A 171 -13.209 53.043 -46.653 1.00 33.80 C ATOM 1422 C ILE A 171 -14.327 52.909 -45.610 1.00 34.77 C ATOM 1423 O ILE A 171 -15.004 51.844 -45.545 1.00 36.54 O ATOM 1424 CB ILE A 171 -11.953 52.381 -46.067 1.00 33.34 C ATOM 1425 CG1 ILE A 171 -10.853 52.318 -47.109 1.00 32.45 C ATOM 1426 CG2 ILE A 171 -12.287 50.988 -45.551 1.00 31.67 C ATOM 1427 CD1 ILE A 171 -9.500 51.905 -46.519 1.00 32.30 C ATOM 0 H ILE A 171 -12.236 54.766 -46.822 1.00 33.76 H new ATOM 0 HA ILE A 171 -13.459 52.593 -47.475 1.00 33.80 H new ATOM 0 HB ILE A 171 -11.635 52.917 -45.323 1.00 33.34 H new ATOM 0 HG12 ILE A 171 -11.105 51.688 -47.802 1.00 32.45 H new ATOM 0 HG13 ILE A 171 -10.765 53.186 -47.533 1.00 32.45 H new ATOM 0 HG21 ILE A 171 -11.488 50.579 -45.183 1.00 31.67 H new ATOM 0 HG22 ILE A 171 -12.964 51.053 -44.860 1.00 31.67 H new ATOM 0 HG23 ILE A 171 -12.622 50.444 -46.281 1.00 31.67 H new ATOM 0 HD11 ILE A 171 -8.834 51.880 -47.223 1.00 32.30 H new ATOM 0 HD12 ILE A 171 -9.232 52.547 -45.843 1.00 32.30 H new ATOM 0 HD13 ILE A 171 -9.577 51.026 -46.116 1.00 32.30 H new ATOM 1428 N LYS A 172 -14.504 53.942 -44.771 1.00 34.25 N ATOM 1429 CA LYS A 172 -15.503 53.880 -43.669 1.00 32.39 C ATOM 1430 C LYS A 172 -16.878 54.153 -44.309 1.00 32.58 C ATOM 1431 O LYS A 172 -17.852 53.509 -44.007 1.00 32.84 O ATOM 1432 CB LYS A 172 -15.212 54.930 -42.618 1.00 30.52 C ATOM 1433 CG LYS A 172 -13.803 55.043 -42.270 1.00 28.35 C ATOM 1434 CD LYS A 172 -13.659 55.769 -40.971 1.00 30.50 C ATOM 1435 CE LYS A 172 -12.224 56.198 -40.641 1.00 27.45 C ATOM 1436 NZ LYS A 172 -12.106 56.652 -39.184 1.00 28.03 N ATOM 0 H LYS A 172 -14.066 54.681 -44.816 1.00 34.25 H new ATOM 0 HA LYS A 172 -15.476 53.015 -43.232 1.00 32.39 H new ATOM 0 HB2 LYS A 172 -15.527 55.790 -42.937 1.00 30.52 H new ATOM 0 HB3 LYS A 172 -15.718 54.722 -41.817 1.00 30.52 H new ATOM 0 HG2 LYS A 172 -13.406 54.160 -42.203 1.00 28.35 H new ATOM 0 HG3 LYS A 172 -13.325 55.516 -42.969 1.00 28.35 H new ATOM 0 HD2 LYS A 172 -14.225 56.557 -40.989 1.00 30.50 H new ATOM 0 HD3 LYS A 172 -13.987 55.200 -40.257 1.00 30.50 H new ATOM 0 HE2 LYS A 172 -11.617 55.459 -40.803 1.00 27.45 H new ATOM 0 HE3 LYS A 172 -11.955 56.920 -41.231 1.00 27.45 H new ATOM 0 HZ1 LYS A 172 -11.247 56.715 -38.961 1.00 28.03 H new ATOM 0 HZ2 LYS A 172 -12.496 57.446 -39.088 1.00 28.03 H new ATOM 0 HZ3 LYS A 172 -12.507 56.059 -38.655 1.00 28.03 H new ATOM 1437 N THR A 173 -16.931 55.115 -45.206 1.00 32.65 N ATOM 1438 CA THR A 173 -18.179 55.482 -45.783 1.00 32.65 C ATOM 1439 C THR A 173 -18.465 54.613 -47.021 1.00 33.20 C ATOM 1440 O THR A 173 -19.602 54.252 -47.271 1.00 33.00 O ATOM 1441 CB THR A 173 -18.206 56.967 -46.115 1.00 33.72 C ATOM 1442 OG1 THR A 173 -17.272 57.209 -47.138 1.00 30.63 O ATOM 1443 CG2 THR A 173 -17.779 57.802 -44.898 1.00 33.01 C ATOM 0 H THR A 173 -16.252 55.561 -45.488 1.00 32.65 H new ATOM 0 HA THR A 173 -18.884 55.321 -45.137 1.00 32.65 H new ATOM 0 HB THR A 173 -19.107 57.211 -46.380 1.00 33.72 H new ATOM 0 HG1 THR A 173 -17.632 57.071 -47.884 1.00 30.63 H new ATOM 0 HG21 THR A 173 -17.802 58.744 -45.128 1.00 33.01 H new ATOM 0 HG22 THR A 173 -18.387 57.634 -44.161 1.00 33.01 H new ATOM 0 HG23 THR A 173 -16.878 57.555 -44.636 1.00 33.01 H new ATOM 1444 N HIS A 174 -17.486 54.199 -47.792 1.00 32.82 N ATOM 1445 CA HIS A 174 -17.893 53.415 -48.956 1.00 33.37 C ATOM 1446 C HIS A 174 -16.973 52.255 -49.188 1.00 31.61 C ATOM 1447 O HIS A 174 -16.189 52.306 -50.134 1.00 30.18 O ATOM 1448 CB HIS A 174 -17.854 54.278 -50.215 1.00 35.02 C ATOM 1449 CG HIS A 174 -18.624 55.563 -50.123 1.00 41.65 C ATOM 1450 ND1 HIS A 174 -18.295 56.763 -49.585 1.00 48.69 N flip ATOM 1451 CD2 HIS A 174 -19.869 55.744 -50.709 1.00 48.30 C flip ATOM 1452 CE1 HIS A 174 -19.351 57.625 -49.820 1.00 47.05 C flip ATOM 1453 NE2 HIS A 174 -20.285 56.984 -50.506 1.00 49.93 N flip ATOM 0 H HIS A 174 -16.644 54.339 -47.684 1.00 32.82 H new ATOM 0 HA HIS A 174 -18.791 53.094 -48.777 1.00 33.37 H new ATOM 0 HB2 HIS A 174 -16.929 54.484 -50.422 1.00 35.02 H new ATOM 0 HB3 HIS A 174 -18.202 53.760 -50.958 1.00 35.02 H new ATOM 0 HD2 HIS A 174 -20.340 55.092 -51.175 1.00 48.30 H new ATOM 0 HE1 HIS A 174 -19.398 58.511 -49.541 1.00 47.05 H new ATOM 0 HE2 HIS A 174 -21.032 57.316 -50.773 1.00 49.93 H new ATOM 1454 N PRO A 175 -17.046 51.210 -48.338 1.00 31.33 N ATOM 1455 CA PRO A 175 -16.073 50.124 -48.402 1.00 31.66 C ATOM 1456 C PRO A 175 -16.126 49.349 -49.697 1.00 31.97 C ATOM 1457 O PRO A 175 -15.166 48.653 -50.000 1.00 34.47 O ATOM 1458 CB PRO A 175 -16.500 49.184 -47.253 1.00 30.89 C ATOM 1459 CG PRO A 175 -17.883 49.426 -47.108 1.00 30.88 C ATOM 1460 CD PRO A 175 -18.022 50.926 -47.279 1.00 31.38 C ATOM 0 HA PRO A 175 -15.170 50.473 -48.338 1.00 31.66 H new ATOM 0 HB2 PRO A 175 -16.323 48.255 -47.470 1.00 30.89 H new ATOM 0 HB3 PRO A 175 -16.017 49.381 -46.435 1.00 30.89 H new ATOM 0 HG2 PRO A 175 -18.398 48.945 -47.774 1.00 30.88 H new ATOM 0 HG3 PRO A 175 -18.203 49.138 -46.239 1.00 30.88 H new ATOM 0 HD2 PRO A 175 -18.922 51.179 -47.538 1.00 31.38 H new ATOM 0 HD3 PRO A 175 -17.818 51.404 -46.460 1.00 31.38 H new ATOM 1461 N TYR A 176 -17.192 49.457 -50.478 1.00 30.82 N ATOM 1462 CA TYR A 176 -17.254 48.618 -51.651 1.00 30.77 C ATOM 1463 C TYR A 176 -16.659 49.302 -52.832 1.00 27.94 C ATOM 1464 O TYR A 176 -16.765 48.819 -53.939 1.00 26.77 O ATOM 1465 CB TYR A 176 -18.682 48.099 -51.894 1.00 33.38 C ATOM 1466 CG TYR A 176 -19.026 47.078 -50.832 1.00 39.03 C ATOM 1467 CD1 TYR A 176 -20.239 47.133 -50.095 1.00 43.80 C ATOM 1468 CD2 TYR A 176 -18.083 46.105 -50.473 1.00 41.71 C ATOM 1469 CE1 TYR A 176 -20.505 46.197 -49.077 1.00 43.88 C ATOM 1470 CE2 TYR A 176 -18.345 45.163 -49.482 1.00 43.14 C ATOM 1471 CZ TYR A 176 -19.534 45.210 -48.775 1.00 44.07 C ATOM 1472 OH TYR A 176 -19.715 44.234 -47.767 1.00 44.71 O ATOM 0 H TYR A 176 -17.859 49.985 -50.352 1.00 30.82 H new ATOM 0 HA TYR A 176 -16.710 47.830 -51.496 1.00 30.77 H new ATOM 0 HB2 TYR A 176 -19.314 48.834 -51.868 1.00 33.38 H new ATOM 0 HB3 TYR A 176 -18.747 47.700 -52.776 1.00 33.38 H new ATOM 0 HD1 TYR A 176 -20.864 47.794 -50.287 1.00 43.80 H new ATOM 0 HD2 TYR A 176 -17.261 46.088 -50.908 1.00 41.71 H new ATOM 0 HE1 TYR A 176 -21.308 46.226 -48.609 1.00 43.88 H new ATOM 0 HE2 TYR A 176 -17.720 44.501 -49.295 1.00 43.14 H new ATOM 0 HH TYR A 176 -19.039 43.737 -47.733 1.00 44.71 H new ATOM 1473 N SER A 177 -16.006 50.430 -52.569 1.00 25.93 N ATOM 1474 CA SER A 177 -15.377 51.267 -53.612 1.00 24.52 C ATOM 1475 C SER A 177 -14.302 50.522 -54.316 1.00 22.96 C ATOM 1476 O SER A 177 -13.493 49.847 -53.707 1.00 23.10 O ATOM 1477 CB SER A 177 -14.731 52.548 -53.050 1.00 24.79 C ATOM 1478 OG SER A 177 -14.332 53.405 -54.134 1.00 22.25 O ATOM 0 H SER A 177 -15.910 50.742 -51.773 1.00 25.93 H new ATOM 0 HA SER A 177 -16.100 51.505 -54.213 1.00 24.52 H new ATOM 0 HB2 SER A 177 -15.359 53.011 -52.474 1.00 24.79 H new ATOM 0 HB3 SER A 177 -13.961 52.321 -52.506 1.00 24.79 H new ATOM 0 HG SER A 177 -13.982 54.103 -53.825 1.00 22.25 H new ATOM 1479 N ARG A 178 -14.311 50.664 -55.612 1.00 21.78 N ATOM 1480 CA ARG A 178 -13.278 50.071 -56.448 1.00 21.01 C ATOM 1481 C ARG A 178 -12.207 51.182 -56.726 1.00 18.79 C ATOM 1482 O ARG A 178 -11.333 51.088 -57.586 1.00 17.62 O ATOM 1483 CB ARG A 178 -13.933 49.509 -57.706 1.00 19.42 C ATOM 1484 CG ARG A 178 -14.759 48.255 -57.380 1.00 22.69 C ATOM 1485 CD ARG A 178 -15.246 47.486 -58.639 1.00 21.52 C ATOM 1486 NE ARG A 178 -16.129 48.373 -59.345 1.00 25.73 N ATOM 1487 CZ ARG A 178 -17.423 48.209 -59.505 1.00 27.27 C ATOM 1488 NH1 ARG A 178 -18.104 49.143 -60.151 1.00 25.93 N ATOM 1489 NH2 ARG A 178 -18.021 47.125 -59.059 1.00 30.38 N ATOM 0 H ARG A 178 -14.910 51.104 -56.044 1.00 21.78 H new ATOM 0 HA ARG A 178 -12.824 49.327 -56.023 1.00 21.01 H new ATOM 0 HB2 ARG A 178 -14.505 50.183 -58.106 1.00 19.42 H new ATOM 0 HB3 ARG A 178 -13.251 49.291 -58.360 1.00 19.42 H new ATOM 0 HG2 ARG A 178 -14.225 47.658 -56.832 1.00 22.69 H new ATOM 0 HG3 ARG A 178 -15.529 48.513 -56.850 1.00 22.69 H new ATOM 0 HD2 ARG A 178 -14.496 47.229 -59.198 1.00 21.52 H new ATOM 0 HD3 ARG A 178 -15.706 46.669 -58.388 1.00 21.52 H new ATOM 0 HE ARG A 178 -15.778 49.076 -59.695 1.00 25.73 H new ATOM 0 HH11 ARG A 178 -17.699 49.838 -60.455 1.00 25.93 H new ATOM 0 HH12 ARG A 178 -18.952 49.055 -60.266 1.00 25.93 H new ATOM 0 HH21 ARG A 178 -17.565 46.516 -58.659 1.00 30.38 H new ATOM 0 HH22 ARG A 178 -18.868 47.026 -59.168 1.00 30.38 H new ATOM 1490 N ARG A 179 -12.266 52.231 -55.947 1.00 16.66 N ATOM 1491 CA ARG A 179 -11.449 53.374 -56.285 1.00 17.47 C ATOM 1492 C ARG A 179 -10.452 53.694 -55.164 1.00 17.38 C ATOM 1493 O ARG A 179 -9.854 54.737 -55.181 1.00 18.81 O ATOM 1494 CB ARG A 179 -12.361 54.575 -56.622 1.00 17.74 C ATOM 1495 CG ARG A 179 -13.157 54.479 -58.038 1.00 20.92 C ATOM 1496 CD ARG A 179 -14.406 55.384 -58.071 1.00 17.71 C ATOM 1497 NE ARG A 179 -15.243 55.042 -59.249 1.00 22.62 N ATOM 1498 CZ ARG A 179 -16.182 55.842 -59.762 1.00 24.16 C ATOM 1499 NH1 ARG A 179 -16.857 55.478 -60.868 1.00 26.37 N ATOM 1500 NH2 ARG A 179 -16.420 57.048 -59.176 1.00 25.19 N ATOM 0 H ARG A 179 -12.752 52.308 -55.242 1.00 16.66 H new ATOM 0 HA ARG A 179 -10.917 53.169 -57.070 1.00 17.47 H new ATOM 0 HB2 ARG A 179 -13.012 54.676 -55.910 1.00 17.74 H new ATOM 0 HB3 ARG A 179 -11.820 55.380 -56.628 1.00 17.74 H new ATOM 0 HG2 ARG A 179 -12.560 54.730 -58.760 1.00 20.92 H new ATOM 0 HG3 ARG A 179 -13.422 53.559 -58.196 1.00 20.92 H new ATOM 0 HD2 ARG A 179 -14.919 55.271 -57.255 1.00 17.71 H new ATOM 0 HD3 ARG A 179 -14.140 56.316 -58.112 1.00 17.71 H new ATOM 0 HE ARG A 179 -15.115 54.279 -59.625 1.00 22.62 H new ATOM 0 HH11 ARG A 179 -16.685 54.726 -61.249 1.00 26.37 H new ATOM 0 HH12 ARG A 179 -17.460 55.997 -61.194 1.00 26.37 H new ATOM 0 HH21 ARG A 179 -15.968 57.287 -58.484 1.00 25.19 H new ATOM 0 HH22 ARG A 179 -17.022 57.571 -59.498 1.00 25.19 H new ATOM 1501 N LEU A 180 -10.304 52.829 -54.157 1.00 17.01 N ATOM 1502 CA LEU A 180 -9.409 53.082 -53.019 1.00 16.33 C ATOM 1503 C LEU A 180 -7.898 52.977 -53.350 1.00 15.97 C ATOM 1504 O LEU A 180 -7.213 51.996 -52.958 1.00 19.61 O ATOM 1505 CB LEU A 180 -9.750 52.058 -51.962 1.00 15.80 C ATOM 1506 CG LEU A 180 -11.254 51.990 -51.697 1.00 16.03 C ATOM 1507 CD1 LEU A 180 -11.749 50.567 -51.107 1.00 10.93 C ATOM 1508 CD2 LEU A 180 -11.618 53.155 -50.781 1.00 9.66 C ATOM 0 H LEU A 180 -10.720 52.077 -54.113 1.00 17.01 H new ATOM 0 HA LEU A 180 -9.549 53.998 -52.731 1.00 16.33 H new ATOM 0 HB2 LEU A 180 -9.432 51.186 -52.243 1.00 15.80 H new ATOM 0 HB3 LEU A 180 -9.287 52.277 -51.139 1.00 15.80 H new ATOM 0 HG LEU A 180 -11.723 52.066 -52.542 1.00 16.03 H new ATOM 0 HD11 LEU A 180 -12.708 50.592 -50.963 1.00 10.93 H new ATOM 0 HD12 LEU A 180 -11.536 49.863 -51.739 1.00 10.93 H new ATOM 0 HD13 LEU A 180 -11.300 50.392 -50.265 1.00 10.93 H new ATOM 0 HD21 LEU A 180 -12.570 53.136 -50.596 1.00 9.66 H new ATOM 0 HD22 LEU A 180 -11.126 53.079 -49.949 1.00 9.66 H new ATOM 0 HD23 LEU A 180 -11.390 53.992 -51.215 1.00 9.66 H new ATOM 1509 N ILE A 181 -7.349 54.019 -53.937 1.00 13.91 N ATOM 1510 CA ILE A 181 -6.020 54.031 -54.546 1.00 14.60 C ATOM 1511 C ILE A 181 -5.159 55.174 -54.036 1.00 14.15 C ATOM 1512 O ILE A 181 -5.618 56.336 -53.940 1.00 14.30 O ATOM 1513 CB ILE A 181 -6.190 54.094 -56.062 1.00 13.80 C ATOM 1514 CG1 ILE A 181 -6.701 52.710 -56.470 1.00 15.70 C ATOM 1515 CG2 ILE A 181 -4.876 54.409 -56.739 1.00 18.90 C ATOM 1516 CD1 ILE A 181 -6.765 52.364 -57.888 1.00 17.43 C ATOM 0 H ILE A 181 -7.752 54.776 -53.999 1.00 13.91 H new ATOM 0 HA ILE A 181 -5.551 53.219 -54.297 1.00 14.60 H new ATOM 0 HB ILE A 181 -6.806 54.795 -56.327 1.00 13.80 H new ATOM 0 HG12 ILE A 181 -6.139 52.051 -56.034 1.00 15.70 H new ATOM 0 HG13 ILE A 181 -7.594 52.609 -56.104 1.00 15.70 H new ATOM 0 HG21 ILE A 181 -5.007 54.444 -57.699 1.00 18.90 H new ATOM 0 HG22 ILE A 181 -4.548 55.267 -56.426 1.00 18.90 H new ATOM 0 HG23 ILE A 181 -4.229 53.719 -56.526 1.00 18.90 H new ATOM 0 HD11 ILE A 181 -7.106 51.461 -57.986 1.00 17.43 H new ATOM 0 HD12 ILE A 181 -7.354 52.984 -58.346 1.00 17.43 H new ATOM 0 HD13 ILE A 181 -5.877 52.417 -58.275 1.00 17.43 H new ATOM 1517 N VAL A 182 -3.931 54.857 -53.640 1.00 14.31 N ATOM 1518 CA VAL A 182 -2.992 55.883 -53.234 1.00 13.85 C ATOM 1519 C VAL A 182 -1.819 55.728 -54.201 1.00 17.00 C ATOM 1520 O VAL A 182 -1.289 54.595 -54.385 1.00 16.37 O ATOM 1521 CB VAL A 182 -2.451 55.750 -51.859 1.00 13.63 C ATOM 1522 CG1 VAL A 182 -1.343 56.877 -51.658 1.00 10.45 C ATOM 1523 CG2 VAL A 182 -3.543 55.742 -50.820 1.00 3.94 C ATOM 0 H VAL A 182 -3.626 54.054 -53.601 1.00 14.31 H new ATOM 0 HA VAL A 182 -3.452 56.737 -53.247 1.00 13.85 H new ATOM 0 HB VAL A 182 -2.023 54.888 -51.738 1.00 13.63 H new ATOM 0 HG11 VAL A 182 -0.973 56.811 -50.764 1.00 10.45 H new ATOM 0 HG12 VAL A 182 -0.635 56.755 -52.310 1.00 10.45 H new ATOM 0 HG13 VAL A 182 -1.745 57.752 -51.777 1.00 10.45 H new ATOM 0 HG21 VAL A 182 -3.150 55.654 -49.938 1.00 3.94 H new ATOM 0 HG22 VAL A 182 -4.043 56.572 -50.869 1.00 3.94 H new ATOM 0 HG23 VAL A 182 -4.140 54.995 -50.984 1.00 3.94 H new ATOM 1524 N SER A 183 -1.405 56.841 -54.826 1.00 17.85 N ATOM 1525 CA SER A 183 -0.308 56.715 -55.796 1.00 19.46 C ATOM 1526 C SER A 183 0.885 57.540 -55.317 1.00 19.68 C ATOM 1527 O SER A 183 0.681 58.638 -54.752 1.00 20.77 O ATOM 1528 CB SER A 183 -0.780 57.181 -57.156 1.00 17.61 C ATOM 1529 OG SER A 183 0.382 57.404 -57.904 1.00 22.29 O ATOM 0 H SER A 183 -1.724 57.632 -54.713 1.00 17.85 H new ATOM 0 HA SER A 183 -0.033 55.788 -55.870 1.00 19.46 H new ATOM 0 HB2 SER A 183 -1.343 56.513 -57.577 1.00 17.61 H new ATOM 0 HB3 SER A 183 -1.308 57.991 -57.083 1.00 17.61 H new ATOM 0 HG SER A 183 0.174 57.665 -58.675 1.00 22.29 H new ATOM 1530 N ALA A 184 2.094 57.027 -55.505 1.00 19.93 N ATOM 1531 CA ALA A 184 3.272 57.780 -55.119 1.00 20.74 C ATOM 1532 C ALA A 184 3.923 58.326 -56.326 1.00 19.95 C ATOM 1533 O ALA A 184 4.975 58.990 -56.224 1.00 22.44 O ATOM 1534 CB ALA A 184 4.281 56.978 -54.231 1.00 21.75 C ATOM 0 H ALA A 184 2.251 56.255 -55.850 1.00 19.93 H new ATOM 0 HA ALA A 184 2.971 58.507 -54.551 1.00 20.74 H new ATOM 0 HB1 ALA A 184 5.040 57.542 -54.013 1.00 21.75 H new ATOM 0 HB2 ALA A 184 3.841 56.698 -53.413 1.00 21.75 H new ATOM 0 HB3 ALA A 184 4.589 56.196 -54.716 1.00 21.75 H new ATOM 1535 N TRP A 185 3.258 58.185 -57.462 1.00 18.81 N ATOM 1536 CA TRP A 185 3.922 58.520 -58.723 1.00 18.12 C ATOM 1537 C TRP A 185 3.434 59.785 -59.473 1.00 19.07 C ATOM 1538 O TRP A 185 2.470 59.701 -60.246 1.00 18.74 O ATOM 1539 CB TRP A 185 3.782 57.359 -59.643 1.00 16.78 C ATOM 1540 CG TRP A 185 4.590 57.431 -60.841 1.00 15.84 C ATOM 1541 CD1 TRP A 185 4.232 57.975 -62.066 1.00 14.15 C ATOM 1542 CD2 TRP A 185 5.917 56.897 -61.004 1.00 14.57 C ATOM 1543 NE1 TRP A 185 5.325 57.848 -63.011 1.00 12.48 N ATOM 1544 CE2 TRP A 185 6.352 57.192 -62.368 1.00 12.14 C ATOM 1545 CE3 TRP A 185 6.813 56.267 -60.130 1.00 13.64 C ATOM 1546 CZ2 TRP A 185 7.598 56.814 -62.851 1.00 11.44 C ATOM 1547 CZ3 TRP A 185 8.108 55.898 -60.633 1.00 13.94 C ATOM 1548 CH2 TRP A 185 8.464 56.146 -61.979 1.00 12.22 C ATOM 0 H TRP A 185 2.447 57.906 -57.531 1.00 18.81 H new ATOM 0 HA TRP A 185 4.835 58.724 -58.468 1.00 18.12 H new ATOM 0 HB2 TRP A 185 4.014 56.550 -59.160 1.00 16.78 H new ATOM 0 HB3 TRP A 185 2.850 57.278 -59.901 1.00 16.78 H new ATOM 0 HD1 TRP A 185 3.409 58.365 -62.254 1.00 14.15 H new ATOM 0 HE1 TRP A 185 5.331 58.130 -63.823 1.00 12.48 H new ATOM 0 HE3 TRP A 185 6.576 56.092 -59.248 1.00 13.64 H new ATOM 0 HZ2 TRP A 185 7.849 56.999 -63.727 1.00 11.44 H new ATOM 0 HZ3 TRP A 185 8.721 55.490 -60.065 1.00 13.94 H new ATOM 0 HH2 TRP A 185 9.292 55.859 -62.291 1.00 12.22 H new ATOM 1549 N ASN A 186 4.138 60.921 -59.267 1.00 20.63 N ATOM 1550 CA ASN A 186 3.904 62.186 -59.971 1.00 20.43 C ATOM 1551 C ASN A 186 4.755 62.417 -61.180 1.00 20.90 C ATOM 1552 O ASN A 186 5.991 62.634 -61.093 1.00 20.13 O ATOM 1553 CB ASN A 186 4.121 63.336 -59.057 1.00 21.53 C ATOM 1554 CG ASN A 186 3.370 64.576 -59.515 1.00 22.63 C ATOM 1555 OD1 ASN A 186 3.249 64.885 -60.705 1.00 22.97 O ATOM 1556 ND2 ASN A 186 2.905 65.317 -58.551 1.00 20.64 N ATOM 0 H ASN A 186 4.780 60.968 -58.697 1.00 20.63 H new ATOM 0 HA ASN A 186 2.985 62.116 -60.273 1.00 20.43 H new ATOM 0 HB2 ASN A 186 3.833 63.096 -58.162 1.00 21.53 H new ATOM 0 HB3 ASN A 186 5.069 63.533 -59.006 1.00 21.53 H new ATOM 0 HD21 ASN A 186 2.496 66.052 -58.732 1.00 20.64 H new ATOM 0 HD22 ASN A 186 3.007 65.072 -57.733 1.00 20.64 H new ATOM 1557 N PRO A 187 4.114 62.380 -62.347 1.00 21.21 N ATOM 1558 CA PRO A 187 4.982 62.507 -63.536 1.00 22.47 C ATOM 1559 C PRO A 187 5.692 63.874 -63.708 1.00 24.01 C ATOM 1560 O PRO A 187 6.730 63.974 -64.418 1.00 25.94 O ATOM 1561 CB PRO A 187 4.058 62.190 -64.710 1.00 22.46 C ATOM 1562 CG PRO A 187 2.779 61.787 -64.160 1.00 23.53 C ATOM 1563 CD PRO A 187 2.712 62.158 -62.675 1.00 20.25 C ATOM 0 HA PRO A 187 5.737 61.902 -63.459 1.00 22.47 H new ATOM 0 HB2 PRO A 187 3.954 62.966 -65.282 1.00 22.46 H new ATOM 0 HB3 PRO A 187 4.432 61.482 -65.258 1.00 22.46 H new ATOM 0 HG2 PRO A 187 2.059 62.221 -64.643 1.00 23.53 H new ATOM 0 HG3 PRO A 187 2.658 60.831 -64.269 1.00 23.53 H new ATOM 0 HD2 PRO A 187 2.175 62.952 -62.524 1.00 20.25 H new ATOM 0 HD3 PRO A 187 2.324 61.447 -62.141 1.00 20.25 H new ATOM 1564 N GLU A 188 5.242 64.921 -63.048 1.00 25.23 N ATOM 1565 CA GLU A 188 6.005 66.166 -63.180 1.00 27.73 C ATOM 1566 C GLU A 188 7.242 66.163 -62.318 1.00 27.87 C ATOM 1567 O GLU A 188 8.195 66.807 -62.699 1.00 29.90 O ATOM 1568 CB GLU A 188 5.192 67.437 -63.011 1.00 27.94 C ATOM 1569 CG GLU A 188 4.709 67.630 -61.588 1.00 34.72 C ATOM 1570 CD GLU A 188 3.989 68.959 -61.402 1.00 42.36 C ATOM 1571 OE1 GLU A 188 3.006 69.008 -60.580 1.00 43.31 O ATOM 1572 OE2 GLU A 188 4.446 69.928 -62.076 1.00 41.48 O ATOM 0 H GLU A 188 4.544 64.947 -62.546 1.00 25.23 H new ATOM 0 HA GLU A 188 6.288 66.183 -64.108 1.00 27.73 H new ATOM 0 HB2 GLU A 188 5.731 68.200 -63.273 1.00 27.94 H new ATOM 0 HB3 GLU A 188 4.428 67.411 -63.608 1.00 27.94 H new ATOM 0 HG2 GLU A 188 4.112 66.904 -61.349 1.00 34.72 H new ATOM 0 HG3 GLU A 188 5.465 67.586 -60.982 1.00 34.72 H new ATOM 1573 N ASP A 189 7.288 65.386 -61.237 1.00 28.52 N ATOM 1574 CA ASP A 189 8.535 65.223 -60.445 1.00 29.34 C ATOM 1575 C ASP A 189 9.358 64.108 -60.895 1.00 31.63 C ATOM 1576 O ASP A 189 10.518 64.079 -60.670 1.00 31.95 O ATOM 1577 CB ASP A 189 8.220 64.913 -59.040 1.00 28.46 C ATOM 1578 CG ASP A 189 7.402 65.951 -58.475 1.00 29.86 C ATOM 1579 OD1 ASP A 189 7.575 67.040 -58.997 1.00 30.88 O ATOM 1580 OD2 ASP A 189 6.595 65.735 -57.553 1.00 36.28 O ATOM 0 H ASP A 189 6.616 64.941 -60.937 1.00 28.52 H new ATOM 0 HA ASP A 189 9.008 66.063 -60.554 1.00 29.34 H new ATOM 0 HB2 ASP A 189 7.758 64.062 -58.985 1.00 28.46 H new ATOM 0 HB3 ASP A 189 9.040 64.824 -58.530 1.00 28.46 H new ATOM 1581 N VAL A 190 8.755 63.160 -61.568 1.00 34.94 N ATOM 1582 CA VAL A 190 9.431 61.892 -61.670 1.00 37.35 C ATOM 1583 C VAL A 190 10.795 61.961 -62.387 1.00 38.81 C ATOM 1584 O VAL A 190 11.744 61.283 -61.966 1.00 39.38 O ATOM 1585 CB VAL A 190 8.458 60.849 -62.170 1.00 37.04 C ATOM 1586 CG1 VAL A 190 9.074 59.966 -63.102 1.00 35.27 C ATOM 1587 CG2 VAL A 190 7.990 60.108 -60.953 1.00 38.64 C ATOM 0 H VAL A 190 7.991 63.220 -61.957 1.00 34.94 H new ATOM 0 HA VAL A 190 9.710 61.606 -60.786 1.00 37.35 H new ATOM 0 HB VAL A 190 7.717 61.260 -62.643 1.00 37.04 H new ATOM 0 HG11 VAL A 190 8.426 59.310 -63.404 1.00 35.27 H new ATOM 0 HG12 VAL A 190 9.398 60.473 -63.863 1.00 35.27 H new ATOM 0 HG13 VAL A 190 9.818 59.512 -62.675 1.00 35.27 H new ATOM 0 HG21 VAL A 190 7.358 59.420 -61.216 1.00 38.64 H new ATOM 0 HG22 VAL A 190 8.750 59.697 -60.512 1.00 38.64 H new ATOM 0 HG23 VAL A 190 7.559 60.727 -60.343 1.00 38.64 H new ATOM 1588 N PRO A 191 10.914 62.817 -63.415 1.00 39.96 N ATOM 1589 CA PRO A 191 12.189 62.889 -64.073 1.00 41.14 C ATOM 1590 C PRO A 191 13.294 63.675 -63.320 1.00 42.89 C ATOM 1591 O PRO A 191 14.433 63.720 -63.734 1.00 44.86 O ATOM 1592 CB PRO A 191 11.845 63.553 -65.407 1.00 41.30 C ATOM 1593 CG PRO A 191 10.611 64.294 -65.186 1.00 41.03 C ATOM 1594 CD PRO A 191 9.925 63.736 -64.005 1.00 40.16 C ATOM 0 HA PRO A 191 12.585 62.006 -64.144 1.00 41.14 H new ATOM 0 HB2 PRO A 191 12.558 64.145 -65.693 1.00 41.30 H new ATOM 0 HB3 PRO A 191 11.730 62.889 -66.105 1.00 41.30 H new ATOM 0 HG2 PRO A 191 10.804 65.235 -65.049 1.00 41.03 H new ATOM 0 HG3 PRO A 191 10.038 64.233 -65.967 1.00 41.03 H new ATOM 0 HD2 PRO A 191 9.671 64.433 -63.380 1.00 40.16 H new ATOM 0 HD3 PRO A 191 9.112 63.269 -64.255 1.00 40.16 H new ATOM 1595 N THR A 192 13.020 64.320 -62.223 1.00 43.88 N ATOM 1596 CA THR A 192 14.122 65.010 -61.599 1.00 44.98 C ATOM 1597 C THR A 192 14.131 64.445 -60.207 1.00 45.21 C ATOM 1598 O THR A 192 13.990 65.168 -59.242 1.00 46.87 O ATOM 1599 CB THR A 192 13.850 66.538 -61.582 1.00 45.08 C ATOM 1600 OG1 THR A 192 12.879 66.870 -60.557 1.00 46.23 O ATOM 1601 CG2 THR A 192 13.288 66.963 -62.904 1.00 45.70 C ATOM 0 H THR A 192 12.254 64.376 -61.836 1.00 43.88 H new ATOM 0 HA THR A 192 14.969 64.892 -62.057 1.00 44.98 H new ATOM 0 HB THR A 192 14.688 66.993 -61.402 1.00 45.08 H new ATOM 0 HG1 THR A 192 13.189 66.672 -59.802 1.00 46.23 H new ATOM 0 HG21 THR A 192 13.119 67.918 -62.892 1.00 45.70 H new ATOM 0 HG22 THR A 192 13.923 66.757 -63.607 1.00 45.70 H new ATOM 0 HG23 THR A 192 12.458 66.490 -63.070 1.00 45.70 H new ATOM 1602 N MET A 193 14.160 63.140 -60.052 1.00 45.22 N ATOM 1603 CA MET A 193 14.171 62.677 -58.670 1.00 43.78 C ATOM 1604 C MET A 193 15.352 61.797 -58.641 1.00 44.62 C ATOM 1605 O MET A 193 15.730 61.188 -59.655 1.00 43.69 O ATOM 1606 CB MET A 193 12.908 61.915 -58.282 1.00 45.02 C ATOM 1607 CG MET A 193 11.741 62.780 -57.956 1.00 41.61 C ATOM 1608 SD MET A 193 10.398 61.676 -57.701 1.00 38.88 S ATOM 1609 CE MET A 193 10.548 61.380 -55.947 1.00 36.95 C ATOM 0 H MET A 193 14.173 62.543 -60.670 1.00 45.22 H new ATOM 0 HA MET A 193 14.203 63.410 -58.036 1.00 43.78 H new ATOM 0 HB2 MET A 193 12.664 61.323 -59.011 1.00 45.02 H new ATOM 0 HB3 MET A 193 13.105 61.354 -57.515 1.00 45.02 H new ATOM 0 HG2 MET A 193 11.911 63.312 -57.163 1.00 41.61 H new ATOM 0 HG3 MET A 193 11.552 63.399 -58.678 1.00 41.61 H new ATOM 0 HE1 MET A 193 10.738 60.441 -55.792 1.00 36.95 H new ATOM 0 HE2 MET A 193 11.270 61.919 -55.588 1.00 36.95 H new ATOM 0 HE3 MET A 193 9.718 61.619 -55.506 1.00 36.95 H new ATOM 1610 N ALA A 194 15.993 61.750 -57.494 1.00 45.23 N ATOM 1611 CA ALA A 194 17.143 60.874 -57.457 1.00 45.07 C ATOM 1612 C ALA A 194 16.588 59.440 -57.394 1.00 44.22 C ATOM 1613 O ALA A 194 17.229 58.491 -57.911 1.00 45.56 O ATOM 1614 CB ALA A 194 18.002 61.187 -56.274 1.00 46.24 C ATOM 0 H ALA A 194 15.801 62.180 -56.775 1.00 45.23 H new ATOM 0 HA ALA A 194 17.706 60.987 -58.239 1.00 45.07 H new ATOM 0 HB1 ALA A 194 18.768 60.592 -56.263 1.00 46.24 H new ATOM 0 HB2 ALA A 194 18.308 62.106 -56.330 1.00 46.24 H new ATOM 0 HB3 ALA A 194 17.488 61.067 -55.460 1.00 46.24 H new ATOM 1615 N LEU A 195 15.407 59.284 -56.768 1.00 41.48 N ATOM 1616 CA LEU A 195 14.713 57.957 -56.713 1.00 39.24 C ATOM 1617 C LEU A 195 13.232 58.127 -56.926 1.00 36.28 C ATOM 1618 O LEU A 195 12.471 58.483 -55.998 1.00 36.06 O ATOM 1619 CB LEU A 195 15.054 57.037 -55.479 1.00 40.01 C ATOM 1620 CG LEU A 195 14.509 55.571 -55.583 1.00 41.23 C ATOM 1621 CD1 LEU A 195 15.276 54.672 -56.617 1.00 38.87 C ATOM 1622 CD2 LEU A 195 14.273 54.842 -54.193 1.00 39.81 C ATOM 0 H LEU A 195 14.987 59.921 -56.370 1.00 41.48 H new ATOM 0 HA LEU A 195 15.085 57.450 -57.452 1.00 39.24 H new ATOM 0 HB2 LEU A 195 16.018 57.004 -55.373 1.00 40.01 H new ATOM 0 HB3 LEU A 195 14.694 57.447 -54.677 1.00 40.01 H new ATOM 0 HG LEU A 195 13.620 55.696 -55.950 1.00 41.23 H new ATOM 0 HD11 LEU A 195 14.885 53.784 -56.627 1.00 38.87 H new ATOM 0 HD12 LEU A 195 15.207 55.065 -57.501 1.00 38.87 H new ATOM 0 HD13 LEU A 195 16.210 54.611 -56.363 1.00 38.87 H new ATOM 0 HD21 LEU A 195 13.937 53.946 -54.350 1.00 39.81 H new ATOM 0 HD22 LEU A 195 15.111 54.792 -53.707 1.00 39.81 H new ATOM 0 HD23 LEU A 195 13.626 55.342 -53.671 1.00 39.81 H new ATOM 1623 N PRO A 196 12.833 57.920 -58.176 1.00 32.94 N ATOM 1624 CA PRO A 196 11.482 57.858 -58.483 1.00 30.71 C ATOM 1625 C PRO A 196 10.955 56.669 -57.648 1.00 28.66 C ATOM 1626 O PRO A 196 11.650 55.653 -57.506 1.00 26.29 O ATOM 1627 CB PRO A 196 11.494 57.638 -59.982 1.00 31.06 C ATOM 1628 CG PRO A 196 12.832 58.244 -60.401 1.00 34.38 C ATOM 1629 CD PRO A 196 13.684 57.719 -59.356 1.00 33.84 C ATOM 0 HA PRO A 196 10.919 58.622 -58.283 1.00 30.71 H new ATOM 0 HB2 PRO A 196 11.439 56.696 -60.208 1.00 31.06 H new ATOM 0 HB3 PRO A 196 10.747 58.079 -60.417 1.00 31.06 H new ATOM 0 HG2 PRO A 196 13.109 57.956 -61.285 1.00 34.38 H new ATOM 0 HG3 PRO A 196 12.813 59.214 -60.412 1.00 34.38 H new ATOM 0 HD2 PRO A 196 13.903 56.785 -59.496 1.00 33.84 H new ATOM 0 HD3 PRO A 196 14.523 58.201 -59.290 1.00 33.84 H new ATOM 1630 N PRO A 197 9.806 56.845 -56.964 1.00 27.06 N ATOM 1631 CA PRO A 197 9.465 55.813 -55.934 1.00 26.87 C ATOM 1632 C PRO A 197 9.410 54.350 -56.485 1.00 26.74 C ATOM 1633 O PRO A 197 8.974 54.141 -57.686 1.00 27.04 O ATOM 1634 CB PRO A 197 8.132 56.330 -55.324 1.00 26.22 C ATOM 1635 CG PRO A 197 7.540 57.220 -56.344 1.00 24.20 C ATOM 1636 CD PRO A 197 8.805 57.916 -56.992 1.00 27.51 C ATOM 0 HA PRO A 197 10.157 55.723 -55.260 1.00 26.87 H new ATOM 0 HB2 PRO A 197 7.536 55.594 -55.117 1.00 26.22 H new ATOM 0 HB3 PRO A 197 8.291 56.808 -54.495 1.00 26.22 H new ATOM 0 HG2 PRO A 197 7.029 56.722 -57.001 1.00 24.20 H new ATOM 0 HG3 PRO A 197 6.937 57.869 -55.948 1.00 24.20 H new ATOM 0 HD2 PRO A 197 8.627 58.220 -57.896 1.00 27.51 H new ATOM 0 HD3 PRO A 197 9.091 58.691 -56.483 1.00 27.51 H new ATOM 1637 N CYS A 198 9.922 53.393 -55.686 1.00 24.57 N ATOM 1638 CA CYS A 198 9.796 51.972 -56.002 1.00 25.77 C ATOM 1639 C CYS A 198 8.408 51.471 -55.753 1.00 23.56 C ATOM 1640 O CYS A 198 7.893 50.654 -56.555 1.00 24.03 O ATOM 1641 CB CYS A 198 10.748 51.105 -55.187 1.00 25.82 C ATOM 1642 SG CYS A 198 12.391 51.311 -55.892 1.00 38.05 S ATOM 0 H CYS A 198 10.346 53.556 -54.956 1.00 24.57 H new ATOM 0 HA CYS A 198 10.018 51.901 -56.944 1.00 25.77 H new ATOM 0 HB2 CYS A 198 10.740 51.371 -54.254 1.00 25.82 H new ATOM 0 HB3 CYS A 198 10.476 50.174 -55.219 1.00 25.82 H new ATOM 0 HG CYS A 198 13.025 50.305 -55.730 1.00 38.05 H new ATOM 1643 N HIS A 199 7.787 51.927 -54.673 1.00 19.83 N ATOM 1644 CA HIS A 199 6.400 51.503 -54.399 1.00 19.06 C ATOM 1645 C HIS A 199 5.385 52.466 -54.949 1.00 20.67 C ATOM 1646 O HIS A 199 4.994 53.466 -54.282 1.00 22.36 O ATOM 1647 CB HIS A 199 6.200 51.297 -52.927 1.00 18.74 C ATOM 1648 CG HIS A 199 7.318 50.532 -52.312 1.00 17.98 C ATOM 1649 ND1 HIS A 199 8.093 51.039 -51.305 1.00 14.80 N ATOM 1650 CD2 HIS A 199 7.879 49.349 -52.662 1.00 21.49 C ATOM 1651 CE1 HIS A 199 9.074 50.204 -51.037 1.00 20.97 C ATOM 1652 NE2 HIS A 199 8.954 49.153 -51.827 1.00 26.50 N ATOM 0 H HIS A 199 8.129 52.466 -54.097 1.00 19.83 H new ATOM 0 HA HIS A 199 6.260 50.660 -54.858 1.00 19.06 H new ATOM 0 HB2 HIS A 199 6.120 52.159 -52.489 1.00 18.74 H new ATOM 0 HB3 HIS A 199 5.366 50.825 -52.778 1.00 18.74 H new ATOM 0 HD2 HIS A 199 7.592 48.779 -53.338 1.00 21.49 H new ATOM 0 HE1 HIS A 199 9.739 50.332 -50.399 1.00 20.97 H new ATOM 0 HE2 HIS A 199 9.464 48.460 -51.821 1.00 26.50 H new ATOM 1653 N THR A 200 4.939 52.145 -56.165 1.00 19.89 N ATOM 1654 CA THR A 200 4.326 53.052 -57.090 1.00 17.83 C ATOM 1655 C THR A 200 2.907 53.445 -56.713 1.00 17.99 C ATOM 1656 O THR A 200 2.539 54.630 -56.794 1.00 16.97 O ATOM 1657 CB THR A 200 4.305 52.469 -58.474 1.00 16.27 C ATOM 1658 OG1 THR A 200 5.643 52.209 -58.895 1.00 23.62 O ATOM 1659 CG2 THR A 200 3.903 53.499 -59.402 1.00 18.68 C ATOM 0 H THR A 200 4.996 51.345 -56.475 1.00 19.89 H new ATOM 0 HA THR A 200 4.872 53.853 -57.061 1.00 17.83 H new ATOM 0 HB THR A 200 3.732 51.687 -58.460 1.00 16.27 H new ATOM 0 HG1 THR A 200 5.666 52.147 -59.732 1.00 23.62 H new ATOM 0 HG21 THR A 200 3.885 53.136 -60.301 1.00 18.68 H new ATOM 0 HG22 THR A 200 3.019 53.820 -59.166 1.00 18.68 H new ATOM 0 HG23 THR A 200 4.535 54.234 -59.363 1.00 18.68 H new ATOM 1660 N LEU A 201 2.102 52.482 -56.340 1.00 18.20 N ATOM 1661 CA LEU A 201 0.740 52.763 -55.858 1.00 19.75 C ATOM 1662 C LEU A 201 0.166 51.580 -55.138 1.00 20.22 C ATOM 1663 O LEU A 201 0.699 50.505 -55.323 1.00 22.19 O ATOM 1664 CB LEU A 201 -0.215 53.106 -56.993 1.00 20.17 C ATOM 1665 CG LEU A 201 -0.737 52.195 -58.084 1.00 22.34 C ATOM 1666 CD1 LEU A 201 -1.561 51.115 -57.445 1.00 23.42 C ATOM 1667 CD2 LEU A 201 -1.651 53.087 -58.907 1.00 17.03 C ATOM 0 H LEU A 201 2.311 51.648 -56.352 1.00 18.20 H new ATOM 0 HA LEU A 201 0.825 53.523 -55.261 1.00 19.75 H new ATOM 0 HB2 LEU A 201 -1.007 53.458 -56.558 1.00 20.17 H new ATOM 0 HB3 LEU A 201 0.204 53.845 -57.461 1.00 20.17 H new ATOM 0 HG LEU A 201 -0.034 51.785 -58.612 1.00 22.34 H new ATOM 0 HD11 LEU A 201 -1.904 50.521 -58.131 1.00 23.42 H new ATOM 0 HD12 LEU A 201 -1.010 50.610 -56.827 1.00 23.42 H new ATOM 0 HD13 LEU A 201 -2.302 51.515 -56.964 1.00 23.42 H new ATOM 0 HD21 LEU A 201 -2.032 52.574 -59.637 1.00 17.03 H new ATOM 0 HD22 LEU A 201 -2.364 53.427 -58.344 1.00 17.03 H new ATOM 0 HD23 LEU A 201 -1.141 53.830 -59.266 1.00 17.03 H new ATOM 1668 N TYR A 202 -0.905 51.743 -54.338 1.00 18.38 N ATOM 1669 CA TYR A 202 -1.559 50.560 -53.775 1.00 17.90 C ATOM 1670 C TYR A 202 -3.076 50.734 -53.742 1.00 17.83 C ATOM 1671 O TYR A 202 -3.616 51.831 -53.964 1.00 19.65 O ATOM 1672 CB TYR A 202 -0.960 50.123 -52.428 1.00 16.43 C ATOM 1673 CG TYR A 202 -0.743 51.305 -51.492 1.00 16.19 C ATOM 1674 CD1 TYR A 202 -1.713 51.635 -50.516 1.00 17.13 C ATOM 1675 CD2 TYR A 202 0.393 52.156 -51.614 1.00 17.00 C ATOM 1676 CE1 TYR A 202 -1.558 52.725 -49.618 1.00 14.34 C ATOM 1677 CE2 TYR A 202 0.527 53.345 -50.718 1.00 13.17 C ATOM 1678 CZ TYR A 202 -0.467 53.565 -49.742 1.00 11.19 C ATOM 1679 OH TYR A 202 -0.432 54.607 -48.862 1.00 18.41 O ATOM 0 H TYR A 202 -1.252 52.499 -54.120 1.00 18.38 H new ATOM 0 HA TYR A 202 -1.376 49.818 -54.372 1.00 17.90 H new ATOM 0 HB2 TYR A 202 -1.551 49.480 -52.005 1.00 16.43 H new ATOM 0 HB3 TYR A 202 -0.115 49.673 -52.581 1.00 16.43 H new ATOM 0 HD1 TYR A 202 -2.483 51.117 -50.460 1.00 17.13 H new ATOM 0 HD2 TYR A 202 1.048 51.973 -52.248 1.00 17.00 H new ATOM 0 HE1 TYR A 202 -2.188 52.873 -48.950 1.00 14.34 H new ATOM 0 HE2 TYR A 202 1.249 53.926 -50.802 1.00 13.17 H new ATOM 0 HH TYR A 202 0.355 54.894 -48.798 1.00 18.41 H new ATOM 1680 N GLN A 203 -3.764 49.629 -53.600 1.00 16.72 N ATOM 1681 CA GLN A 203 -5.167 49.626 -53.709 1.00 16.76 C ATOM 1682 C GLN A 203 -5.697 48.843 -52.571 1.00 17.17 C ATOM 1683 O GLN A 203 -5.204 47.738 -52.292 1.00 16.88 O ATOM 1684 CB GLN A 203 -5.596 48.935 -54.970 1.00 15.96 C ATOM 1685 CG GLN A 203 -7.045 49.144 -55.127 1.00 17.19 C ATOM 1686 CD GLN A 203 -7.576 48.733 -56.472 1.00 15.35 C ATOM 1687 OE1 GLN A 203 -6.797 48.270 -57.350 1.00 11.94 O ATOM 1688 NE2 GLN A 203 -8.919 48.732 -56.586 1.00 3.14 N ATOM 0 H GLN A 203 -3.415 48.860 -53.437 1.00 16.72 H new ATOM 0 HA GLN A 203 -5.493 50.539 -53.715 1.00 16.76 H new ATOM 0 HB2 GLN A 203 -5.116 49.292 -55.734 1.00 15.96 H new ATOM 0 HB3 GLN A 203 -5.392 47.988 -54.925 1.00 15.96 H new ATOM 0 HG2 GLN A 203 -7.512 48.645 -54.438 1.00 17.19 H new ATOM 0 HG3 GLN A 203 -7.245 50.082 -54.983 1.00 17.19 H new ATOM 0 HE21 GLN A 203 -9.404 49.061 -55.957 1.00 3.14 H new ATOM 0 HE22 GLN A 203 -9.291 48.402 -57.288 1.00 3.14 H new ATOM 1689 N PHE A 204 -6.681 49.415 -51.878 1.00 17.55 N ATOM 1690 CA PHE A 204 -7.415 48.635 -50.890 1.00 17.60 C ATOM 1691 C PHE A 204 -8.657 48.028 -51.504 1.00 20.32 C ATOM 1692 O PHE A 204 -9.087 48.456 -52.604 1.00 21.21 O ATOM 1693 CB PHE A 204 -7.820 49.505 -49.747 1.00 16.29 C ATOM 1694 CG PHE A 204 -6.681 50.063 -48.982 1.00 14.00 C ATOM 1695 CD1 PHE A 204 -6.091 49.339 -47.947 1.00 16.83 C ATOM 1696 CD2 PHE A 204 -6.211 51.306 -49.252 1.00 13.81 C ATOM 1697 CE1 PHE A 204 -5.033 49.859 -47.195 1.00 11.73 C ATOM 1698 CE2 PHE A 204 -5.208 51.848 -48.488 1.00 15.46 C ATOM 1699 CZ PHE A 204 -4.632 51.104 -47.433 1.00 14.62 C ATOM 0 H PHE A 204 -6.933 50.233 -51.963 1.00 17.55 H new ATOM 0 HA PHE A 204 -6.833 47.926 -50.575 1.00 17.60 H new ATOM 0 HB2 PHE A 204 -8.360 50.236 -50.085 1.00 16.29 H new ATOM 0 HB3 PHE A 204 -8.382 48.992 -49.145 1.00 16.29 H new ATOM 0 HD1 PHE A 204 -6.410 48.487 -47.751 1.00 16.83 H new ATOM 0 HD2 PHE A 204 -6.570 51.793 -49.958 1.00 13.81 H new ATOM 0 HE1 PHE A 204 -4.618 49.344 -46.541 1.00 11.73 H new ATOM 0 HE2 PHE A 204 -4.906 52.709 -48.665 1.00 15.46 H new ATOM 0 HZ PHE A 204 -3.970 51.487 -46.904 1.00 14.62 H new ATOM 1700 N TYR A 205 -9.214 47.033 -50.816 1.00 23.55 N ATOM 1701 CA TYR A 205 -10.444 46.321 -51.195 1.00 27.21 C ATOM 1702 C TYR A 205 -10.986 45.685 -49.919 1.00 28.80 C ATOM 1703 O TYR A 205 -10.213 45.261 -49.042 1.00 28.88 O ATOM 1704 CB TYR A 205 -10.089 45.232 -52.195 1.00 28.74 C ATOM 1705 CG TYR A 205 -11.120 44.229 -52.624 1.00 29.88 C ATOM 1706 CD1 TYR A 205 -11.765 44.344 -53.871 1.00 32.46 C ATOM 1707 CD2 TYR A 205 -11.399 43.119 -51.831 1.00 33.39 C ATOM 1708 CE1 TYR A 205 -12.690 43.389 -54.311 1.00 32.79 C ATOM 1709 CE2 TYR A 205 -12.323 42.112 -52.246 1.00 34.21 C ATOM 1710 CZ TYR A 205 -12.960 42.250 -53.495 1.00 35.01 C ATOM 1711 OH TYR A 205 -13.851 41.252 -53.916 1.00 35.39 O ATOM 0 H TYR A 205 -8.874 46.739 -50.083 1.00 23.55 H new ATOM 0 HA TYR A 205 -11.098 46.915 -51.595 1.00 27.21 H new ATOM 0 HB2 TYR A 205 -9.767 45.673 -52.997 1.00 28.74 H new ATOM 0 HB3 TYR A 205 -9.342 44.735 -51.825 1.00 28.74 H new ATOM 0 HD1 TYR A 205 -11.572 45.072 -54.416 1.00 32.46 H new ATOM 0 HD2 TYR A 205 -10.972 43.031 -51.009 1.00 33.39 H new ATOM 0 HE1 TYR A 205 -13.124 43.496 -55.127 1.00 32.79 H new ATOM 0 HE2 TYR A 205 -12.501 41.379 -51.702 1.00 34.21 H new ATOM 0 HH TYR A 205 -13.900 40.654 -53.328 1.00 35.39 H new ATOM 1712 N VAL A 206 -12.315 45.651 -49.813 1.00 30.36 N ATOM 1713 CA VAL A 206 -13.031 45.073 -48.670 1.00 30.71 C ATOM 1714 C VAL A 206 -14.096 44.157 -49.192 1.00 32.44 C ATOM 1715 O VAL A 206 -14.816 44.444 -50.179 1.00 32.29 O ATOM 1716 CB VAL A 206 -13.767 46.137 -47.880 1.00 30.48 C ATOM 1717 CG1 VAL A 206 -14.807 45.520 -46.959 1.00 27.24 C ATOM 1718 CG2 VAL A 206 -12.785 46.922 -47.132 1.00 29.24 C ATOM 0 H VAL A 206 -12.838 45.970 -50.416 1.00 30.36 H new ATOM 0 HA VAL A 206 -12.377 44.626 -48.110 1.00 30.71 H new ATOM 0 HB VAL A 206 -14.249 46.719 -48.488 1.00 30.48 H new ATOM 0 HG11 VAL A 206 -15.261 46.222 -46.467 1.00 27.24 H new ATOM 0 HG12 VAL A 206 -15.453 45.025 -47.486 1.00 27.24 H new ATOM 0 HG13 VAL A 206 -14.371 44.919 -46.335 1.00 27.24 H new ATOM 0 HG21 VAL A 206 -13.241 47.608 -46.620 1.00 29.24 H new ATOM 0 HG22 VAL A 206 -12.297 46.340 -46.529 1.00 29.24 H new ATOM 0 HG23 VAL A 206 -12.165 47.339 -47.750 1.00 29.24 H new ATOM 1719 N ASN A 207 -14.205 43.051 -48.493 1.00 34.06 N ATOM 1720 CA ASN A 207 -15.244 42.159 -48.698 1.00 35.86 C ATOM 1721 C ASN A 207 -15.365 41.299 -47.437 1.00 35.84 C ATOM 1722 O ASN A 207 -14.389 41.085 -46.755 1.00 35.10 O ATOM 1723 CB ASN A 207 -14.949 41.349 -49.944 1.00 36.66 C ATOM 1724 CG ASN A 207 -16.124 40.464 -50.328 1.00 45.55 C ATOM 1725 OD1 ASN A 207 -15.995 39.179 -49.934 1.00 49.12 O flip ATOM 1726 ND2 ASN A 207 -17.170 40.904 -50.929 1.00 55.76 N flip ATOM 0 H ASN A 207 -13.652 42.816 -47.878 1.00 34.06 H new ATOM 0 HA ASN A 207 -16.094 42.603 -48.844 1.00 35.86 H new ATOM 0 HB2 ASN A 207 -14.741 41.948 -50.678 1.00 36.66 H new ATOM 0 HB3 ASN A 207 -14.164 40.799 -49.795 1.00 36.66 H new ATOM 0 HD21 ASN A 207 -17.215 41.730 -51.165 1.00 55.76 H new ATOM 0 HD22 ASN A 207 -17.825 40.373 -51.096 1.00 55.76 H new ATOM 1727 N ASP A 208 -16.586 40.842 -47.137 1.00 36.59 N ATOM 1728 CA ASP A 208 -16.945 40.127 -45.904 1.00 36.92 C ATOM 1729 C ASP A 208 -16.310 40.727 -44.664 1.00 35.90 C ATOM 1730 O ASP A 208 -15.954 40.023 -43.748 1.00 36.20 O ATOM 1731 CB ASP A 208 -16.609 38.654 -46.045 1.00 37.91 C ATOM 1732 CG ASP A 208 -17.140 38.096 -47.349 1.00 41.69 C ATOM 1733 OD1 ASP A 208 -16.439 37.326 -48.034 1.00 44.03 O ATOM 1734 OD2 ASP A 208 -18.259 38.498 -47.753 1.00 46.35 O ATOM 0 H ASP A 208 -17.255 40.944 -47.668 1.00 36.59 H new ATOM 0 HA ASP A 208 -17.902 40.223 -45.780 1.00 36.92 H new ATOM 0 HB2 ASP A 208 -15.647 38.533 -46.006 1.00 37.91 H new ATOM 0 HB3 ASP A 208 -16.987 38.160 -45.301 1.00 37.91 H new ATOM 1735 N GLY A 209 -16.198 42.046 -44.633 1.00 34.45 N ATOM 1736 CA GLY A 209 -15.658 42.720 -43.472 1.00 32.48 C ATOM 1737 C GLY A 209 -14.209 42.451 -43.269 1.00 30.96 C ATOM 1738 O GLY A 209 -13.742 42.522 -42.166 1.00 32.22 O ATOM 0 H GLY A 209 -16.430 42.567 -45.276 1.00 34.45 H new ATOM 0 HA2 GLY A 209 -15.795 43.676 -43.566 1.00 32.48 H new ATOM 0 HA3 GLY A 209 -16.148 42.439 -42.683 1.00 32.48 H new ATOM 1739 N LYS A 210 -13.500 42.181 -44.350 1.00 29.76 N ATOM 1740 CA LYS A 210 -12.041 42.003 -44.340 1.00 28.49 C ATOM 1741 C LYS A 210 -11.376 42.963 -45.285 1.00 25.69 C ATOM 1742 O LYS A 210 -11.866 43.225 -46.380 1.00 25.01 O ATOM 1743 CB LYS A 210 -11.611 40.584 -44.733 1.00 29.24 C ATOM 1744 CG LYS A 210 -12.084 39.525 -43.827 1.00 31.18 C ATOM 1745 CD LYS A 210 -11.042 38.448 -43.880 1.00 40.53 C ATOM 1746 CE LYS A 210 -11.564 37.127 -43.395 1.00 46.37 C ATOM 1747 NZ LYS A 210 -12.901 36.901 -44.073 1.00 51.68 N ATOM 0 H LYS A 210 -13.851 42.092 -45.130 1.00 29.76 H new ATOM 0 HA LYS A 210 -11.765 42.172 -43.426 1.00 28.49 H new ATOM 0 HB2 LYS A 210 -11.936 40.397 -45.627 1.00 29.24 H new ATOM 0 HB3 LYS A 210 -10.642 40.552 -44.771 1.00 29.24 H new ATOM 0 HG2 LYS A 210 -12.191 39.862 -42.924 1.00 31.18 H new ATOM 0 HG3 LYS A 210 -12.949 39.187 -44.108 1.00 31.18 H new ATOM 0 HD2 LYS A 210 -10.724 38.353 -44.791 1.00 40.53 H new ATOM 0 HD3 LYS A 210 -10.280 38.711 -43.340 1.00 40.53 H new ATOM 0 HE2 LYS A 210 -10.944 36.413 -43.612 1.00 46.37 H new ATOM 0 HE3 LYS A 210 -11.665 37.131 -42.430 1.00 46.37 H new ATOM 0 HZ1 LYS A 210 -13.050 36.027 -44.152 1.00 51.68 H new ATOM 0 HZ2 LYS A 210 -13.548 37.269 -43.585 1.00 51.68 H new ATOM 0 HZ3 LYS A 210 -12.891 37.274 -44.881 1.00 51.68 H new ATOM 1748 N LEU A 211 -10.261 43.509 -44.839 1.00 23.46 N ATOM 1749 CA LEU A 211 -9.501 44.433 -45.642 1.00 22.63 C ATOM 1750 C LEU A 211 -8.302 43.749 -46.367 1.00 21.95 C ATOM 1751 O LEU A 211 -7.543 43.010 -45.722 1.00 24.61 O ATOM 1752 CB LEU A 211 -9.025 45.536 -44.721 1.00 22.23 C ATOM 1753 CG LEU A 211 -8.329 46.663 -45.466 1.00 21.34 C ATOM 1754 CD1 LEU A 211 -9.343 47.429 -46.336 1.00 18.12 C ATOM 1755 CD2 LEU A 211 -7.697 47.575 -44.495 1.00 9.28 C ATOM 0 H LEU A 211 -9.926 43.353 -44.063 1.00 23.46 H new ATOM 0 HA LEU A 211 -10.062 44.788 -46.349 1.00 22.63 H new ATOM 0 HB2 LEU A 211 -9.783 45.895 -44.234 1.00 22.23 H new ATOM 0 HB3 LEU A 211 -8.416 45.163 -44.064 1.00 22.23 H new ATOM 0 HG LEU A 211 -7.646 46.291 -46.046 1.00 21.34 H new ATOM 0 HD11 LEU A 211 -8.889 48.146 -46.807 1.00 18.12 H new ATOM 0 HD12 LEU A 211 -9.742 46.822 -46.979 1.00 18.12 H new ATOM 0 HD13 LEU A 211 -10.037 47.803 -45.771 1.00 18.12 H new ATOM 0 HD21 LEU A 211 -7.252 48.295 -44.969 1.00 9.28 H new ATOM 0 HD22 LEU A 211 -8.376 47.945 -43.909 1.00 9.28 H new ATOM 0 HD23 LEU A 211 -7.047 47.086 -43.967 1.00 9.28 H new ATOM 1756 N SER A 212 -8.154 43.941 -47.677 1.00 18.33 N ATOM 1757 CA SER A 212 -6.971 43.533 -48.380 1.00 14.75 C ATOM 1758 C SER A 212 -6.270 44.698 -49.001 1.00 14.70 C ATOM 1759 O SER A 212 -6.874 45.745 -49.225 1.00 15.84 O ATOM 1760 CB SER A 212 -7.352 42.633 -49.495 1.00 16.29 C ATOM 1761 OG SER A 212 -7.692 41.344 -49.009 1.00 16.30 O ATOM 0 H SER A 212 -8.748 44.315 -48.174 1.00 18.33 H new ATOM 0 HA SER A 212 -6.389 43.099 -47.736 1.00 14.75 H new ATOM 0 HB2 SER A 212 -8.104 43.010 -49.978 1.00 16.29 H new ATOM 0 HB3 SER A 212 -6.617 42.562 -50.125 1.00 16.29 H new ATOM 0 HG SER A 212 -8.491 41.344 -48.750 1.00 16.30 H new ATOM 1762 N LEU A 213 -5.000 44.529 -49.341 1.00 13.05 N ATOM 1763 CA LEU A 213 -4.266 45.542 -50.007 1.00 12.80 C ATOM 1764 C LEU A 213 -3.392 44.905 -51.095 1.00 12.55 C ATOM 1765 O LEU A 213 -2.773 43.852 -50.897 1.00 13.87 O ATOM 1766 CB LEU A 213 -3.373 46.264 -48.989 1.00 13.82 C ATOM 1767 CG LEU A 213 -2.546 47.462 -49.495 1.00 13.72 C ATOM 1768 CD1 LEU A 213 -1.809 48.138 -48.411 1.00 12.51 C ATOM 1769 CD2 LEU A 213 -1.535 47.025 -50.491 1.00 20.70 C ATOM 0 H LEU A 213 -4.552 43.812 -49.183 1.00 13.05 H new ATOM 0 HA LEU A 213 -4.876 46.177 -50.415 1.00 12.80 H new ATOM 0 HB2 LEU A 213 -3.936 46.574 -48.263 1.00 13.82 H new ATOM 0 HB3 LEU A 213 -2.759 45.613 -48.614 1.00 13.82 H new ATOM 0 HG LEU A 213 -3.189 48.074 -49.887 1.00 13.72 H new ATOM 0 HD11 LEU A 213 -1.306 48.882 -48.777 1.00 12.51 H new ATOM 0 HD12 LEU A 213 -2.437 48.467 -47.749 1.00 12.51 H new ATOM 0 HD13 LEU A 213 -1.199 47.510 -47.993 1.00 12.51 H new ATOM 0 HD21 LEU A 213 -1.027 47.793 -50.795 1.00 20.70 H new ATOM 0 HD22 LEU A 213 -0.934 46.382 -50.082 1.00 20.70 H new ATOM 0 HD23 LEU A 213 -1.982 46.614 -51.247 1.00 20.70 H new ATOM 1770 N GLN A 214 -3.298 45.575 -52.227 1.00 11.45 N ATOM 1771 CA GLN A 214 -2.439 45.111 -53.286 1.00 12.13 C ATOM 1772 C GLN A 214 -1.439 46.244 -53.624 1.00 11.61 C ATOM 1773 O GLN A 214 -1.874 47.392 -53.818 1.00 9.38 O ATOM 1774 CB GLN A 214 -3.251 44.792 -54.561 1.00 11.48 C ATOM 1775 CG GLN A 214 -2.272 44.383 -55.599 1.00 13.34 C ATOM 1776 CD GLN A 214 -2.845 43.872 -56.917 1.00 18.43 C ATOM 1777 OE1 GLN A 214 -2.082 43.369 -57.775 1.00 16.48 O ATOM 1778 NE2 GLN A 214 -4.148 44.046 -57.117 1.00 17.26 N ATOM 0 H GLN A 214 -3.725 46.301 -52.399 1.00 11.45 H new ATOM 0 HA GLN A 214 -1.986 44.305 -52.993 1.00 12.13 H new ATOM 0 HB2 GLN A 214 -3.891 44.083 -54.393 1.00 11.48 H new ATOM 0 HB3 GLN A 214 -3.756 45.568 -54.851 1.00 11.48 H new ATOM 0 HG2 GLN A 214 -1.700 45.142 -55.792 1.00 13.34 H new ATOM 0 HG3 GLN A 214 -1.706 43.689 -55.225 1.00 13.34 H new ATOM 0 HE21 GLN A 214 -4.635 44.395 -56.500 1.00 17.26 H new ATOM 0 HE22 GLN A 214 -4.504 43.809 -57.863 1.00 17.26 H new ATOM 1779 N LEU A 215 -0.144 45.909 -53.711 1.00 11.44 N ATOM 1780 CA LEU A 215 0.974 46.873 -53.980 1.00 11.29 C ATOM 1781 C LEU A 215 1.592 46.622 -55.350 1.00 10.99 C ATOM 1782 O LEU A 215 1.916 45.459 -55.689 1.00 11.39 O ATOM 1783 CB LEU A 215 2.053 46.639 -52.935 1.00 8.98 C ATOM 1784 CG LEU A 215 3.155 47.628 -52.676 1.00 13.18 C ATOM 1785 CD1 LEU A 215 4.541 46.794 -52.307 1.00 9.01 C ATOM 1786 CD2 LEU A 215 3.360 48.445 -53.864 1.00 6.22 C ATOM 0 H LEU A 215 0.129 45.099 -53.615 1.00 11.44 H new ATOM 0 HA LEU A 215 0.625 47.778 -53.949 1.00 11.29 H new ATOM 0 HB2 LEU A 215 1.596 46.505 -52.090 1.00 8.98 H new ATOM 0 HB3 LEU A 215 2.482 45.799 -53.162 1.00 8.98 H new ATOM 0 HG LEU A 215 2.920 48.208 -51.935 1.00 13.18 H new ATOM 0 HD11 LEU A 215 5.261 47.421 -52.137 1.00 9.01 H new ATOM 0 HD12 LEU A 215 4.392 46.252 -51.516 1.00 9.01 H new ATOM 0 HD13 LEU A 215 4.781 46.220 -53.051 1.00 9.01 H new ATOM 0 HD21 LEU A 215 4.071 49.084 -53.699 1.00 6.22 H new ATOM 0 HD22 LEU A 215 3.605 47.876 -54.610 1.00 6.22 H new ATOM 0 HD23 LEU A 215 2.541 48.920 -54.075 1.00 6.22 H new ATOM 1787 N TYR A 216 1.695 47.659 -56.161 1.00 9.03 N ATOM 1788 CA TYR A 216 2.425 47.537 -57.361 1.00 8.61 C ATOM 1789 C TYR A 216 3.797 48.154 -57.162 1.00 10.00 C ATOM 1790 O TYR A 216 3.937 49.405 -57.022 1.00 6.56 O ATOM 1791 CB TYR A 216 1.705 48.201 -58.522 1.00 10.03 C ATOM 1792 CG TYR A 216 2.452 47.964 -59.831 1.00 8.07 C ATOM 1793 CD1 TYR A 216 2.072 46.910 -60.703 1.00 5.67 C ATOM 1794 CD2 TYR A 216 3.527 48.757 -60.191 1.00 10.57 C ATOM 1795 CE1 TYR A 216 2.731 46.666 -61.849 1.00 6.84 C ATOM 1796 CE2 TYR A 216 4.236 48.537 -61.471 1.00 12.72 C ATOM 1797 CZ TYR A 216 3.803 47.480 -62.276 1.00 9.40 C ATOM 1798 OH TYR A 216 4.438 47.187 -63.483 1.00 11.19 O ATOM 0 H TYR A 216 1.345 48.432 -56.020 1.00 9.03 H new ATOM 0 HA TYR A 216 2.514 46.597 -57.581 1.00 8.61 H new ATOM 0 HB2 TYR A 216 0.803 47.851 -58.592 1.00 10.03 H new ATOM 0 HB3 TYR A 216 1.627 49.154 -58.357 1.00 10.03 H new ATOM 0 HD1 TYR A 216 1.347 46.374 -60.475 1.00 5.67 H new ATOM 0 HD2 TYR A 216 3.807 49.437 -59.622 1.00 10.57 H new ATOM 0 HE1 TYR A 216 2.474 45.943 -62.374 1.00 6.84 H new ATOM 0 HE2 TYR A 216 4.944 49.082 -61.730 1.00 12.72 H new ATOM 0 HH TYR A 216 5.052 47.743 -63.619 1.00 11.19 H new ATOM 1799 N GLN A 217 4.818 47.269 -57.122 1.00 10.93 N ATOM 1800 CA GLN A 217 6.184 47.693 -56.855 1.00 10.67 C ATOM 1801 C GLN A 217 6.902 47.553 -58.187 1.00 12.94 C ATOM 1802 O GLN A 217 7.025 46.396 -58.762 1.00 13.29 O ATOM 1803 CB GLN A 217 6.865 46.845 -55.787 1.00 8.84 C ATOM 1804 CG GLN A 217 8.286 47.310 -55.597 1.00 10.98 C ATOM 1805 CD GLN A 217 8.933 46.667 -54.417 1.00 12.66 C ATOM 1806 OE1 GLN A 217 8.269 46.016 -53.596 1.00 9.03 O ATOM 1807 NE2 GLN A 217 10.273 46.804 -54.334 1.00 13.00 N ATOM 0 H GLN A 217 4.726 46.423 -57.248 1.00 10.93 H new ATOM 0 HA GLN A 217 6.203 48.599 -56.509 1.00 10.67 H new ATOM 0 HB2 GLN A 217 6.379 46.912 -54.950 1.00 8.84 H new ATOM 0 HB3 GLN A 217 6.853 45.911 -56.048 1.00 8.84 H new ATOM 0 HG2 GLN A 217 8.800 47.110 -56.395 1.00 10.98 H new ATOM 0 HG3 GLN A 217 8.298 48.274 -55.486 1.00 10.98 H new ATOM 0 HE21 GLN A 217 10.696 47.264 -54.925 1.00 13.00 H new ATOM 0 HE22 GLN A 217 10.704 46.431 -53.690 1.00 13.00 H new ATOM 1808 N ARG A 218 7.418 48.683 -58.655 1.00 13.35 N ATOM 1809 CA ARG A 218 7.998 48.762 -60.035 1.00 15.29 C ATOM 1810 C ARG A 218 9.345 48.050 -60.208 1.00 17.37 C ATOM 1811 O ARG A 218 9.780 47.682 -61.334 1.00 19.07 O ATOM 1812 CB ARG A 218 8.095 50.224 -60.550 1.00 13.66 C ATOM 1813 CG ARG A 218 9.068 51.039 -59.897 1.00 12.74 C ATOM 1814 CD ARG A 218 9.404 52.330 -60.665 1.00 13.02 C ATOM 1815 NE ARG A 218 10.387 53.061 -59.841 1.00 14.42 N ATOM 1816 CZ ARG A 218 11.699 52.825 -59.907 1.00 18.21 C ATOM 1817 NH1 ARG A 218 12.546 53.516 -59.120 1.00 15.01 N ATOM 1818 NH2 ARG A 218 12.163 51.895 -60.789 1.00 16.98 N ATOM 0 H ARG A 218 7.451 49.418 -58.211 1.00 13.35 H new ATOM 0 HA ARG A 218 7.362 48.275 -60.582 1.00 15.29 H new ATOM 0 HB2 ARG A 218 8.296 50.204 -61.499 1.00 13.66 H new ATOM 0 HB3 ARG A 218 7.226 50.644 -60.453 1.00 13.66 H new ATOM 0 HG2 ARG A 218 8.743 51.272 -59.013 1.00 12.74 H new ATOM 0 HG3 ARG A 218 9.881 50.524 -59.774 1.00 12.74 H new ATOM 0 HD2 ARG A 218 9.770 52.126 -61.540 1.00 13.02 H new ATOM 0 HD3 ARG A 218 8.607 52.864 -60.808 1.00 13.02 H new ATOM 0 HE ARG A 218 10.103 53.663 -59.297 1.00 14.42 H new ATOM 0 HH11 ARG A 218 12.241 54.108 -58.576 1.00 15.01 H new ATOM 0 HH12 ARG A 218 13.392 53.365 -59.161 1.00 15.01 H new ATOM 0 HH21 ARG A 218 11.612 51.469 -61.294 1.00 16.98 H new ATOM 0 HH22 ARG A 218 13.006 51.734 -60.841 1.00 16.98 H new ATOM 1819 N SER A 219 10.025 47.898 -59.093 1.00 16.57 N ATOM 1820 CA SER A 219 11.371 47.485 -59.171 1.00 16.89 C ATOM 1821 C SER A 219 11.749 47.022 -57.795 1.00 16.38 C ATOM 1822 O SER A 219 11.336 47.603 -56.796 1.00 15.80 O ATOM 1823 CB SER A 219 12.226 48.599 -59.694 1.00 15.68 C ATOM 1824 OG SER A 219 13.589 48.422 -59.340 1.00 21.53 O ATOM 0 H SER A 219 9.719 48.030 -58.300 1.00 16.57 H new ATOM 0 HA SER A 219 11.503 46.755 -59.796 1.00 16.89 H new ATOM 0 HB2 SER A 219 12.145 48.644 -60.660 1.00 15.68 H new ATOM 0 HB3 SER A 219 11.907 49.445 -59.343 1.00 15.68 H new ATOM 0 HG SER A 219 14.036 49.082 -59.606 1.00 21.53 H new ATOM 1825 N ALA A 220 12.414 45.897 -57.746 1.00 16.56 N ATOM 1826 CA ALA A 220 12.531 45.172 -56.453 1.00 20.57 C ATOM 1827 C ALA A 220 13.825 44.371 -56.320 1.00 21.85 C ATOM 1828 O ALA A 220 14.208 43.602 -57.219 1.00 22.45 O ATOM 1829 CB ALA A 220 11.323 44.214 -56.232 1.00 20.33 C ATOM 0 H ALA A 220 12.804 45.524 -58.416 1.00 16.56 H new ATOM 0 HA ALA A 220 12.539 45.864 -55.773 1.00 20.57 H new ATOM 0 HB1 ALA A 220 11.425 43.755 -55.383 1.00 20.33 H new ATOM 0 HB2 ALA A 220 10.500 44.727 -56.225 1.00 20.33 H new ATOM 0 HB3 ALA A 220 11.291 43.562 -56.950 1.00 20.33 H new ATOM 1830 N ASP A 221 14.467 44.549 -55.174 1.00 22.75 N ATOM 1831 CA ASP A 221 15.711 43.871 -54.840 1.00 22.42 C ATOM 1832 C ASP A 221 15.249 42.683 -54.054 1.00 21.31 C ATOM 1833 O ASP A 221 14.893 42.792 -52.859 1.00 22.29 O ATOM 1834 CB ASP A 221 16.578 44.797 -53.958 1.00 22.57 C ATOM 1835 CG ASP A 221 17.905 44.202 -53.627 1.00 24.09 C ATOM 1836 OD1 ASP A 221 17.943 43.002 -53.347 1.00 28.67 O ATOM 1837 OD2 ASP A 221 18.919 44.913 -53.653 1.00 21.92 O ATOM 0 H ASP A 221 14.187 45.078 -54.556 1.00 22.75 H new ATOM 0 HA ASP A 221 16.247 43.629 -55.611 1.00 22.42 H new ATOM 0 HB2 ASP A 221 16.712 45.641 -54.416 1.00 22.57 H new ATOM 0 HB3 ASP A 221 16.102 44.993 -53.136 1.00 22.57 H new ATOM 1838 N ILE A 222 15.260 41.529 -54.700 1.00 21.36 N ATOM 1839 CA ILE A 222 14.707 40.351 -54.057 1.00 19.93 C ATOM 1840 C ILE A 222 15.386 40.029 -52.699 1.00 21.54 C ATOM 1841 O ILE A 222 14.714 39.603 -51.775 1.00 20.72 O ATOM 1842 CB ILE A 222 14.738 39.113 -55.013 1.00 20.70 C ATOM 1843 CG1 ILE A 222 13.646 39.235 -56.122 1.00 20.83 C ATOM 1844 CG2 ILE A 222 14.522 37.809 -54.243 1.00 14.57 C ATOM 1845 CD1 ILE A 222 14.256 39.011 -57.549 1.00 17.63 C ATOM 0 H ILE A 222 15.574 41.407 -55.491 1.00 21.36 H new ATOM 0 HA ILE A 222 13.780 40.558 -53.859 1.00 19.93 H new ATOM 0 HB ILE A 222 15.616 39.096 -55.425 1.00 20.70 H new ATOM 0 HG12 ILE A 222 12.945 38.584 -55.962 1.00 20.83 H new ATOM 0 HG13 ILE A 222 13.234 40.112 -56.078 1.00 20.83 H new ATOM 0 HG21 ILE A 222 14.546 37.061 -54.860 1.00 14.57 H new ATOM 0 HG22 ILE A 222 15.223 37.704 -53.581 1.00 14.57 H new ATOM 0 HG23 ILE A 222 13.660 37.834 -53.799 1.00 14.57 H new ATOM 0 HD11 ILE A 222 13.557 39.092 -58.216 1.00 17.63 H new ATOM 0 HD12 ILE A 222 14.941 39.677 -57.716 1.00 17.63 H new ATOM 0 HD13 ILE A 222 14.648 38.125 -57.598 1.00 17.63 H new ATOM 1846 N PHE A 223 16.713 40.203 -52.608 1.00 21.96 N ATOM 1847 CA PHE A 223 17.483 39.797 -51.412 1.00 23.38 C ATOM 1848 C PHE A 223 17.451 40.845 -50.286 1.00 24.36 C ATOM 1849 O PHE A 223 16.949 40.563 -49.203 1.00 26.28 O ATOM 1850 CB PHE A 223 18.931 39.329 -51.754 1.00 22.68 C ATOM 1851 CG PHE A 223 19.735 38.919 -50.527 1.00 22.41 C ATOM 1852 CD1 PHE A 223 20.872 39.621 -50.164 1.00 20.64 C ATOM 1853 CD2 PHE A 223 19.308 37.861 -49.709 1.00 24.58 C ATOM 1854 CE1 PHE A 223 21.539 39.314 -49.021 1.00 23.07 C ATOM 1855 CE2 PHE A 223 19.969 37.534 -48.541 1.00 21.32 C ATOM 1856 CZ PHE A 223 21.078 38.247 -48.172 1.00 23.75 C ATOM 0 H PHE A 223 17.191 40.556 -53.230 1.00 21.96 H new ATOM 0 HA PHE A 223 17.023 39.018 -51.061 1.00 23.38 H new ATOM 0 HB2 PHE A 223 18.886 38.580 -52.369 1.00 22.68 H new ATOM 0 HB3 PHE A 223 19.396 40.046 -52.214 1.00 22.68 H new ATOM 0 HD1 PHE A 223 21.182 40.309 -50.708 1.00 20.64 H new ATOM 0 HD2 PHE A 223 18.561 37.367 -49.960 1.00 24.58 H new ATOM 0 HE1 PHE A 223 22.298 39.796 -48.786 1.00 23.07 H new ATOM 0 HE2 PHE A 223 19.663 36.835 -48.009 1.00 21.32 H new ATOM 0 HZ PHE A 223 21.527 38.045 -47.383 1.00 23.75 H new ATOM 1857 N LEU A 224 17.886 42.077 -50.546 1.00 24.31 N ATOM 1858 CA LEU A 224 17.864 43.031 -49.487 1.00 24.56 C ATOM 1859 C LEU A 224 16.550 43.732 -49.333 1.00 24.73 C ATOM 1860 O LEU A 224 16.225 44.149 -48.215 1.00 24.18 O ATOM 1861 CB LEU A 224 18.915 44.087 -49.689 1.00 24.12 C ATOM 1862 CG LEU A 224 20.311 43.512 -49.707 1.00 28.62 C ATOM 1863 CD1 LEU A 224 21.301 44.514 -50.407 1.00 33.81 C ATOM 1864 CD2 LEU A 224 20.725 43.165 -48.291 1.00 27.16 C ATOM 0 H LEU A 224 18.184 42.357 -51.303 1.00 24.31 H new ATOM 0 HA LEU A 224 18.033 42.512 -48.685 1.00 24.56 H new ATOM 0 HB2 LEU A 224 18.748 44.551 -50.524 1.00 24.12 H new ATOM 0 HB3 LEU A 224 18.848 44.746 -48.980 1.00 24.12 H new ATOM 0 HG LEU A 224 20.334 42.693 -50.227 1.00 28.62 H new ATOM 0 HD11 LEU A 224 22.194 44.135 -50.413 1.00 33.81 H new ATOM 0 HD12 LEU A 224 21.011 44.672 -51.319 1.00 33.81 H new ATOM 0 HD13 LEU A 224 21.310 45.353 -49.921 1.00 33.81 H new ATOM 0 HD21 LEU A 224 21.622 42.795 -48.297 1.00 27.16 H new ATOM 0 HD22 LEU A 224 20.710 43.966 -47.744 1.00 27.16 H new ATOM 0 HD23 LEU A 224 20.109 42.512 -47.924 1.00 27.16 H new ATOM 1865 N GLY A 225 15.814 43.967 -50.436 1.00 24.70 N ATOM 1866 CA GLY A 225 14.798 45.023 -50.347 1.00 21.47 C ATOM 1867 C GLY A 225 13.478 44.404 -50.002 1.00 21.07 C ATOM 1868 O GLY A 225 12.784 44.840 -49.040 1.00 21.24 O ATOM 0 H GLY A 225 15.880 43.558 -51.190 1.00 24.70 H new ATOM 0 HA2 GLY A 225 15.049 45.673 -49.673 1.00 21.47 H new ATOM 0 HA3 GLY A 225 14.735 45.499 -51.190 1.00 21.47 H new ATOM 1869 N VAL A 226 13.090 43.428 -50.831 1.00 18.63 N ATOM 1870 CA VAL A 226 11.771 42.815 -50.683 1.00 16.82 C ATOM 1871 C VAL A 226 11.436 42.264 -49.209 1.00 18.81 C ATOM 1872 O VAL A 226 10.292 42.252 -48.791 1.00 18.77 O ATOM 1873 CB VAL A 226 11.560 41.672 -51.756 1.00 15.29 C ATOM 1874 CG1 VAL A 226 10.252 40.930 -51.464 1.00 14.95 C ATOM 1875 CG2 VAL A 226 11.529 42.213 -53.122 1.00 6.77 C ATOM 0 H VAL A 226 13.568 43.113 -51.473 1.00 18.63 H new ATOM 0 HA VAL A 226 11.143 43.538 -50.836 1.00 16.82 H new ATOM 0 HB VAL A 226 12.309 41.059 -51.695 1.00 15.29 H new ATOM 0 HG11 VAL A 226 10.123 40.229 -52.122 1.00 14.95 H new ATOM 0 HG12 VAL A 226 10.293 40.537 -50.578 1.00 14.95 H new ATOM 0 HG13 VAL A 226 9.510 41.553 -51.506 1.00 14.95 H new ATOM 0 HG21 VAL A 226 11.399 41.489 -53.754 1.00 6.77 H new ATOM 0 HG22 VAL A 226 10.800 42.847 -53.203 1.00 6.77 H new ATOM 0 HG23 VAL A 226 12.368 42.660 -53.312 1.00 6.77 H new ATOM 1876 N PRO A 227 12.407 41.685 -48.478 1.00 19.61 N ATOM 1877 CA PRO A 227 12.023 41.304 -47.127 1.00 20.18 C ATOM 1878 C PRO A 227 11.371 42.400 -46.287 1.00 20.15 C ATOM 1879 O PRO A 227 10.475 42.061 -45.483 1.00 22.26 O ATOM 1880 CB PRO A 227 13.330 40.781 -46.504 1.00 18.69 C ATOM 1881 CG PRO A 227 13.995 40.155 -47.599 1.00 19.81 C ATOM 1882 CD PRO A 227 13.709 41.098 -48.842 1.00 21.11 C ATOM 0 HA PRO A 227 11.314 40.643 -47.154 1.00 20.18 H new ATOM 0 HB2 PRO A 227 13.860 41.502 -46.129 1.00 18.69 H new ATOM 0 HB3 PRO A 227 13.157 40.153 -45.785 1.00 18.69 H new ATOM 0 HG2 PRO A 227 14.947 40.073 -47.432 1.00 19.81 H new ATOM 0 HG3 PRO A 227 13.655 39.259 -47.751 1.00 19.81 H new ATOM 0 HD2 PRO A 227 14.396 41.774 -48.952 1.00 21.11 H new ATOM 0 HD3 PRO A 227 13.665 40.601 -49.674 1.00 21.11 H new ATOM 1883 N PHE A 228 11.810 43.641 -46.469 1.00 20.06 N ATOM 1884 CA PHE A 228 11.396 44.818 -45.727 1.00 19.61 C ATOM 1885 C PHE A 228 10.128 45.228 -46.332 1.00 19.49 C ATOM 1886 O PHE A 228 9.173 45.533 -45.606 1.00 17.92 O ATOM 1887 CB PHE A 228 12.359 45.983 -45.937 1.00 21.78 C ATOM 1888 CG PHE A 228 13.569 45.961 -45.016 1.00 29.74 C ATOM 1889 CD1 PHE A 228 13.502 46.506 -43.715 1.00 35.30 C ATOM 1890 CD2 PHE A 228 14.775 45.407 -45.422 1.00 33.61 C ATOM 1891 CE1 PHE A 228 14.615 46.467 -42.829 1.00 35.34 C ATOM 1892 CE2 PHE A 228 15.907 45.346 -44.537 1.00 36.23 C ATOM 1893 CZ PHE A 228 15.816 45.862 -43.245 1.00 33.69 C ATOM 0 H PHE A 228 12.397 43.826 -47.070 1.00 20.06 H new ATOM 0 HA PHE A 228 11.352 44.611 -44.780 1.00 19.61 H new ATOM 0 HB2 PHE A 228 12.665 45.975 -46.857 1.00 21.78 H new ATOM 0 HB3 PHE A 228 11.879 46.815 -45.804 1.00 21.78 H new ATOM 0 HD1 PHE A 228 12.710 46.901 -43.430 1.00 35.30 H new ATOM 0 HD2 PHE A 228 14.853 45.068 -46.285 1.00 33.61 H new ATOM 0 HE1 PHE A 228 14.549 46.839 -41.979 1.00 35.34 H new ATOM 0 HE2 PHE A 228 16.702 44.961 -44.827 1.00 36.23 H new ATOM 0 HZ PHE A 228 16.541 45.807 -42.665 1.00 33.69 H new ATOM 1894 N ASN A 229 10.091 45.297 -47.680 1.00 20.01 N ATOM 1895 CA ASN A 229 8.880 45.829 -48.349 1.00 19.46 C ATOM 1896 C ASN A 229 7.691 45.083 -47.920 1.00 19.74 C ATOM 1897 O ASN A 229 6.632 45.655 -47.645 1.00 21.79 O ATOM 1898 CB ASN A 229 8.964 45.733 -49.826 1.00 18.93 C ATOM 1899 CG ASN A 229 10.207 46.446 -50.367 1.00 25.13 C ATOM 1900 OD1 ASN A 229 10.771 46.103 -51.461 1.00 19.24 O ATOM 1901 ND2 ASN A 229 10.671 47.438 -49.574 1.00 26.74 N ATOM 0 H ASN A 229 10.727 45.053 -48.205 1.00 20.01 H new ATOM 0 HA ASN A 229 8.816 46.763 -48.096 1.00 19.46 H new ATOM 0 HB2 ASN A 229 8.985 44.800 -50.090 1.00 18.93 H new ATOM 0 HB3 ASN A 229 8.169 46.122 -50.222 1.00 18.93 H new ATOM 0 HD21 ASN A 229 11.379 47.872 -49.798 1.00 26.74 H new ATOM 0 HD22 ASN A 229 10.258 47.635 -48.846 1.00 26.74 H new ATOM 1902 N ILE A 230 7.846 43.785 -47.820 1.00 19.35 N ATOM 1903 CA ILE A 230 6.719 42.973 -47.399 1.00 19.75 C ATOM 1904 C ILE A 230 6.198 43.356 -46.017 1.00 18.92 C ATOM 1905 O ILE A 230 5.022 43.515 -45.877 1.00 21.95 O ATOM 1906 CB ILE A 230 7.029 41.397 -47.424 1.00 18.94 C ATOM 1907 CG1 ILE A 230 7.191 40.899 -48.866 1.00 17.23 C ATOM 1908 CG2 ILE A 230 5.919 40.635 -46.709 1.00 18.56 C ATOM 1909 CD1 ILE A 230 7.990 39.699 -48.923 1.00 9.03 C ATOM 0 H ILE A 230 8.573 43.357 -47.985 1.00 19.35 H new ATOM 0 HA ILE A 230 6.031 43.160 -48.057 1.00 19.75 H new ATOM 0 HB ILE A 230 7.864 41.237 -46.958 1.00 18.94 H new ATOM 0 HG12 ILE A 230 6.317 40.726 -49.250 1.00 17.23 H new ATOM 0 HG13 ILE A 230 7.606 41.591 -49.404 1.00 17.23 H new ATOM 0 HG21 ILE A 230 6.114 39.685 -46.729 1.00 18.56 H new ATOM 0 HG22 ILE A 230 5.862 40.934 -45.788 1.00 18.56 H new ATOM 0 HG23 ILE A 230 5.074 40.801 -47.155 1.00 18.56 H new ATOM 0 HD11 ILE A 230 8.074 39.410 -49.845 1.00 9.03 H new ATOM 0 HD12 ILE A 230 8.871 39.879 -48.559 1.00 9.03 H new ATOM 0 HD13 ILE A 230 7.563 39.000 -48.403 1.00 9.03 H new ATOM 1910 N ALA A 231 7.028 43.415 -44.990 1.00 17.05 N ATOM 1911 CA ALA A 231 6.493 43.674 -43.657 1.00 16.03 C ATOM 1912 C ALA A 231 5.914 45.104 -43.614 1.00 15.13 C ATOM 1913 O ALA A 231 5.014 45.420 -42.780 1.00 13.86 O ATOM 1914 CB ALA A 231 7.614 43.562 -42.668 1.00 17.52 C ATOM 0 H ALA A 231 7.881 43.312 -45.035 1.00 17.05 H new ATOM 0 HA ALA A 231 5.794 43.036 -43.444 1.00 16.03 H new ATOM 0 HB1 ALA A 231 7.276 43.731 -41.775 1.00 17.52 H new ATOM 0 HB2 ALA A 231 7.992 42.669 -42.706 1.00 17.52 H new ATOM 0 HB3 ALA A 231 8.301 44.213 -42.882 1.00 17.52 H new ATOM 1915 N SER A 232 6.428 45.982 -44.483 1.00 13.35 N ATOM 1916 CA SER A 232 6.016 47.388 -44.427 1.00 14.71 C ATOM 1917 C SER A 232 4.500 47.526 -44.841 1.00 15.63 C ATOM 1918 O SER A 232 3.570 47.886 -44.040 1.00 15.63 O ATOM 1919 CB SER A 232 6.890 48.177 -45.369 1.00 15.37 C ATOM 1920 OG SER A 232 7.884 48.924 -44.707 1.00 18.09 O ATOM 0 H SER A 232 7.000 45.791 -45.096 1.00 13.35 H new ATOM 0 HA SER A 232 6.114 47.728 -43.524 1.00 14.71 H new ATOM 0 HB2 SER A 232 7.313 47.569 -45.995 1.00 15.37 H new ATOM 0 HB3 SER A 232 6.335 48.778 -45.890 1.00 15.37 H new ATOM 0 HG SER A 232 7.540 49.341 -44.064 1.00 18.09 H new ATOM 1921 N TYR A 233 4.207 47.127 -46.063 1.00 15.45 N ATOM 1922 CA TYR A 233 2.823 47.002 -46.437 1.00 15.01 C ATOM 1923 C TYR A 233 1.908 46.019 -45.668 1.00 16.81 C ATOM 1924 O TYR A 233 0.714 46.321 -45.460 1.00 17.78 O ATOM 1925 CB TYR A 233 2.781 46.854 -47.897 1.00 15.44 C ATOM 1926 CG TYR A 233 3.371 48.056 -48.463 1.00 14.14 C ATOM 1927 CD1 TYR A 233 2.553 49.179 -48.837 1.00 18.54 C ATOM 1928 CD2 TYR A 233 4.747 48.192 -48.521 1.00 17.92 C ATOM 1929 CE1 TYR A 233 3.099 50.358 -49.309 1.00 13.32 C ATOM 1930 CE2 TYR A 233 5.291 49.399 -49.005 1.00 18.32 C ATOM 1931 CZ TYR A 233 4.473 50.468 -49.413 1.00 16.37 C ATOM 1932 OH TYR A 233 5.110 51.658 -49.874 1.00 19.23 O ATOM 0 H TYR A 233 4.779 46.929 -46.674 1.00 15.45 H new ATOM 0 HA TYR A 233 2.393 47.818 -46.138 1.00 15.01 H new ATOM 0 HB2 TYR A 233 3.273 46.066 -48.176 1.00 15.44 H new ATOM 0 HB3 TYR A 233 1.868 46.742 -48.205 1.00 15.44 H new ATOM 0 HD1 TYR A 233 1.629 49.110 -48.759 1.00 18.54 H new ATOM 0 HD2 TYR A 233 5.303 47.499 -48.246 1.00 17.92 H new ATOM 0 HE1 TYR A 233 2.549 51.067 -49.553 1.00 13.32 H new ATOM 0 HE2 TYR A 233 6.215 49.491 -49.056 1.00 18.32 H new ATOM 0 HH TYR A 233 4.528 52.239 -50.045 1.00 19.23 H new ATOM 1933 N ALA A 234 2.409 44.904 -45.148 1.00 17.66 N ATOM 1934 CA ALA A 234 1.469 44.067 -44.403 1.00 18.71 C ATOM 1935 C ALA A 234 1.139 44.857 -43.120 1.00 20.29 C ATOM 1936 O ALA A 234 0.037 44.759 -42.642 1.00 21.84 O ATOM 1937 CB ALA A 234 2.071 42.717 -44.075 1.00 18.74 C ATOM 0 H ALA A 234 3.221 44.627 -45.204 1.00 17.66 H new ATOM 0 HA ALA A 234 0.672 43.881 -44.923 1.00 18.71 H new ATOM 0 HB1 ALA A 234 1.426 42.186 -43.582 1.00 18.74 H new ATOM 0 HB2 ALA A 234 2.306 42.259 -44.897 1.00 18.74 H new ATOM 0 HB3 ALA A 234 2.867 42.840 -43.535 1.00 18.74 H new ATOM 1938 N LEU A 235 2.104 45.589 -42.527 1.00 20.36 N ATOM 1939 CA LEU A 235 1.827 46.456 -41.379 1.00 19.50 C ATOM 1940 C LEU A 235 0.789 47.582 -41.729 1.00 20.38 C ATOM 1941 O LEU A 235 -0.230 47.781 -41.033 1.00 19.80 O ATOM 1942 CB LEU A 235 3.079 47.122 -40.975 1.00 18.61 C ATOM 1943 CG LEU A 235 3.449 47.365 -39.499 1.00 20.34 C ATOM 1944 CD1 LEU A 235 4.366 48.589 -39.442 1.00 11.37 C ATOM 1945 CD2 LEU A 235 2.249 47.447 -38.568 1.00 20.49 C ATOM 0 H LEU A 235 2.926 45.592 -42.781 1.00 20.36 H new ATOM 0 HA LEU A 235 1.463 45.900 -40.673 1.00 19.50 H new ATOM 0 HB2 LEU A 235 3.804 46.607 -41.362 1.00 18.61 H new ATOM 0 HB3 LEU A 235 3.084 47.990 -41.409 1.00 18.61 H new ATOM 0 HG LEU A 235 3.926 46.593 -39.157 1.00 20.34 H new ATOM 0 HD11 LEU A 235 4.615 48.765 -38.521 1.00 11.37 H new ATOM 0 HD12 LEU A 235 5.165 48.420 -39.966 1.00 11.37 H new ATOM 0 HD13 LEU A 235 3.900 49.359 -39.803 1.00 11.37 H new ATOM 0 HD21 LEU A 235 2.554 47.600 -37.660 1.00 20.49 H new ATOM 0 HD22 LEU A 235 1.675 48.178 -38.844 1.00 20.49 H new ATOM 0 HD23 LEU A 235 1.752 46.615 -38.606 1.00 20.49 H new ATOM 1946 N LEU A 236 1.035 48.313 -42.801 1.00 19.27 N ATOM 1947 CA LEU A 236 0.073 49.288 -43.188 1.00 19.57 C ATOM 1948 C LEU A 236 -1.327 48.620 -43.211 1.00 20.67 C ATOM 1949 O LEU A 236 -2.313 49.188 -42.713 1.00 20.63 O ATOM 1950 CB LEU A 236 0.431 49.843 -44.539 1.00 19.29 C ATOM 1951 CG LEU A 236 0.101 51.265 -45.005 1.00 19.49 C ATOM 1952 CD1 LEU A 236 -0.073 51.322 -46.588 1.00 15.55 C ATOM 1953 CD2 LEU A 236 -1.038 51.814 -44.311 1.00 18.89 C ATOM 0 H LEU A 236 1.735 48.255 -43.298 1.00 19.27 H new ATOM 0 HA LEU A 236 0.062 50.024 -42.556 1.00 19.57 H new ATOM 0 HB2 LEU A 236 1.393 49.749 -44.623 1.00 19.29 H new ATOM 0 HB3 LEU A 236 0.030 49.246 -45.190 1.00 19.29 H new ATOM 0 HG LEU A 236 0.855 51.830 -44.775 1.00 19.49 H new ATOM 0 HD11 LEU A 236 -0.281 52.230 -46.858 1.00 15.55 H new ATOM 0 HD12 LEU A 236 0.751 51.039 -47.015 1.00 15.55 H new ATOM 0 HD13 LEU A 236 -0.795 50.732 -46.856 1.00 15.55 H new ATOM 0 HD21 LEU A 236 -1.212 52.712 -44.634 1.00 18.89 H new ATOM 0 HD22 LEU A 236 -1.815 51.256 -44.472 1.00 18.89 H new ATOM 0 HD23 LEU A 236 -0.854 51.844 -43.359 1.00 18.89 H new ATOM 1954 N THR A 237 -1.405 47.406 -43.757 1.00 21.15 N ATOM 1955 CA THR A 237 -2.696 46.793 -43.955 1.00 20.59 C ATOM 1956 C THR A 237 -3.329 46.546 -42.580 1.00 22.79 C ATOM 1957 O THR A 237 -4.522 46.705 -42.433 1.00 23.42 O ATOM 1958 CB THR A 237 -2.641 45.436 -44.716 1.00 20.68 C ATOM 1959 OG1 THR A 237 -2.190 45.632 -46.066 1.00 15.47 O ATOM 1960 CG2 THR A 237 -4.042 44.791 -44.737 1.00 11.17 C ATOM 0 H THR A 237 -0.731 46.936 -44.012 1.00 21.15 H new ATOM 0 HA THR A 237 -3.215 47.403 -44.502 1.00 20.59 H new ATOM 0 HB THR A 237 -2.018 44.852 -44.256 1.00 20.68 H new ATOM 0 HG1 THR A 237 -1.379 45.850 -46.062 1.00 15.47 H new ATOM 0 HG21 THR A 237 -4.002 43.946 -45.212 1.00 11.17 H new ATOM 0 HG22 THR A 237 -4.341 44.636 -43.827 1.00 11.17 H new ATOM 0 HG23 THR A 237 -4.665 45.384 -45.185 1.00 11.17 H new ATOM 1961 N HIS A 238 -2.541 46.140 -41.583 1.00 22.59 N ATOM 1962 CA HIS A 238 -3.053 46.028 -40.243 1.00 21.98 C ATOM 1963 C HIS A 238 -3.467 47.345 -39.643 1.00 22.29 C ATOM 1964 O HIS A 238 -4.528 47.412 -39.054 1.00 22.87 O ATOM 1965 CB HIS A 238 -2.028 45.421 -39.341 1.00 22.69 C ATOM 1966 CG HIS A 238 -2.126 43.931 -39.243 1.00 25.10 C ATOM 1967 ND1 HIS A 238 -1.310 43.091 -39.956 1.00 24.11 N ATOM 1968 CD2 HIS A 238 -2.941 43.138 -38.511 1.00 21.85 C ATOM 1969 CE1 HIS A 238 -1.588 41.837 -39.644 1.00 21.62 C ATOM 1970 NE2 HIS A 238 -2.598 41.842 -38.800 1.00 25.97 N ATOM 0 H HIS A 238 -1.712 45.928 -41.673 1.00 22.59 H new ATOM 0 HA HIS A 238 -3.841 45.467 -40.316 1.00 21.98 H new ATOM 0 HB2 HIS A 238 -1.144 45.659 -39.661 1.00 22.69 H new ATOM 0 HB3 HIS A 238 -2.121 45.803 -38.454 1.00 22.69 H new ATOM 0 HD2 HIS A 238 -3.606 43.418 -37.924 1.00 21.85 H new ATOM 0 HE1 HIS A 238 -1.147 41.083 -39.965 1.00 21.62 H new ATOM 0 HE2 HIS A 238 -2.982 41.142 -38.480 1.00 25.97 H new ATOM 1971 N LEU A 239 -2.666 48.389 -39.791 1.00 21.36 N ATOM 1972 CA LEU A 239 -3.050 49.696 -39.189 1.00 22.63 C ATOM 1973 C LEU A 239 -4.443 50.195 -39.724 1.00 22.95 C ATOM 1974 O LEU A 239 -5.442 50.325 -38.952 1.00 23.17 O ATOM 1975 CB LEU A 239 -1.896 50.723 -39.375 1.00 21.99 C ATOM 1976 CG LEU A 239 -0.576 50.418 -38.638 1.00 19.12 C ATOM 1977 CD1 LEU A 239 0.629 51.232 -39.085 1.00 19.51 C ATOM 1978 CD2 LEU A 239 -0.779 50.531 -37.137 1.00 14.49 C ATOM 0 H LEU A 239 -1.919 48.383 -40.217 1.00 21.36 H new ATOM 0 HA LEU A 239 -3.176 49.586 -38.234 1.00 22.63 H new ATOM 0 HB2 LEU A 239 -1.704 50.795 -40.323 1.00 21.99 H new ATOM 0 HB3 LEU A 239 -2.213 51.592 -39.082 1.00 21.99 H new ATOM 0 HG LEU A 239 -0.353 49.506 -38.883 1.00 19.12 H new ATOM 0 HD11 LEU A 239 1.406 50.971 -38.567 1.00 19.51 H new ATOM 0 HD12 LEU A 239 0.798 51.070 -40.026 1.00 19.51 H new ATOM 0 HD13 LEU A 239 0.452 52.176 -38.947 1.00 19.51 H new ATOM 0 HD21 LEU A 239 0.056 50.338 -36.682 1.00 14.49 H new ATOM 0 HD22 LEU A 239 -1.066 51.431 -36.916 1.00 14.49 H new ATOM 0 HD23 LEU A 239 -1.456 49.897 -36.853 1.00 14.49 H new ATOM 1979 N VAL A 240 -4.532 50.341 -41.056 1.00 21.99 N ATOM 1980 CA VAL A 240 -5.738 50.729 -41.698 1.00 20.65 C ATOM 1981 C VAL A 240 -6.875 49.827 -41.264 1.00 24.54 C ATOM 1982 O VAL A 240 -7.932 50.321 -40.816 1.00 26.36 O ATOM 1983 CB VAL A 240 -5.645 50.781 -43.234 1.00 21.16 C ATOM 1984 CG1 VAL A 240 -7.042 51.211 -43.806 1.00 13.50 C ATOM 1985 CG2 VAL A 240 -4.550 51.755 -43.646 1.00 11.10 C ATOM 0 H VAL A 240 -3.874 50.210 -41.594 1.00 21.99 H new ATOM 0 HA VAL A 240 -5.912 51.640 -41.415 1.00 20.65 H new ATOM 0 HB VAL A 240 -5.416 49.909 -43.593 1.00 21.16 H new ATOM 0 HG11 VAL A 240 -6.998 51.248 -44.774 1.00 13.50 H new ATOM 0 HG12 VAL A 240 -7.714 50.565 -43.538 1.00 13.50 H new ATOM 0 HG13 VAL A 240 -7.278 52.086 -43.460 1.00 13.50 H new ATOM 0 HG21 VAL A 240 -4.492 51.787 -44.614 1.00 11.10 H new ATOM 0 HG22 VAL A 240 -4.758 52.639 -43.306 1.00 11.10 H new ATOM 0 HG23 VAL A 240 -3.701 51.460 -43.282 1.00 11.10 H new ATOM 1986 N ALA A 241 -6.678 48.518 -41.284 1.00 25.70 N ATOM 1987 CA ALA A 241 -7.770 47.662 -40.846 1.00 26.28 C ATOM 1988 C ALA A 241 -8.185 48.046 -39.454 1.00 28.16 C ATOM 1989 O ALA A 241 -9.352 47.983 -39.117 1.00 29.19 O ATOM 1990 CB ALA A 241 -7.394 46.257 -40.885 1.00 24.94 C ATOM 0 H ALA A 241 -5.958 48.119 -41.534 1.00 25.70 H new ATOM 0 HA ALA A 241 -8.515 47.786 -41.455 1.00 26.28 H new ATOM 0 HB1 ALA A 241 -8.141 45.714 -40.588 1.00 24.94 H new ATOM 0 HB2 ALA A 241 -7.156 46.011 -41.792 1.00 24.94 H new ATOM 0 HB3 ALA A 241 -6.634 46.109 -40.300 1.00 24.94 H new ATOM 1991 N HIS A 242 -7.230 48.420 -38.622 1.00 29.67 N ATOM 1992 CA HIS A 242 -7.496 48.559 -37.195 1.00 31.52 C ATOM 1993 C HIS A 242 -8.239 49.862 -37.089 1.00 31.54 C ATOM 1994 O HIS A 242 -9.357 49.859 -36.596 1.00 32.93 O ATOM 1995 CB HIS A 242 -6.169 48.536 -36.404 1.00 33.00 C ATOM 1996 CG HIS A 242 -6.241 49.028 -34.987 1.00 34.71 C ATOM 1997 ND1 HIS A 242 -6.567 48.203 -33.931 1.00 33.89 N ATOM 1998 CD2 HIS A 242 -5.874 50.213 -34.438 1.00 37.15 C ATOM 1999 CE1 HIS A 242 -6.420 48.868 -32.794 1.00 39.01 C ATOM 2000 NE2 HIS A 242 -5.989 50.087 -33.070 1.00 37.27 N ATOM 0 H HIS A 242 -6.422 48.599 -38.858 1.00 29.67 H new ATOM 0 HA HIS A 242 -8.019 47.836 -36.816 1.00 31.52 H new ATOM 0 HB2 HIS A 242 -5.834 47.626 -36.395 1.00 33.00 H new ATOM 0 HB3 HIS A 242 -5.518 49.074 -36.882 1.00 33.00 H new ATOM 0 HD2 HIS A 242 -5.596 50.971 -34.900 1.00 37.15 H new ATOM 0 HE1 HIS A 242 -6.591 48.533 -31.944 1.00 39.01 H new ATOM 0 HE2 HIS A 242 -5.810 50.699 -32.493 1.00 37.27 H new ATOM 2001 N GLU A 243 -7.687 50.935 -37.640 1.00 30.82 N ATOM 2002 CA GLU A 243 -8.444 52.144 -37.662 1.00 30.90 C ATOM 2003 C GLU A 243 -9.876 52.020 -38.242 1.00 30.36 C ATOM 2004 O GLU A 243 -10.721 52.810 -37.843 1.00 32.11 O ATOM 2005 CB GLU A 243 -7.742 53.269 -38.403 1.00 31.06 C ATOM 2006 CG GLU A 243 -8.761 54.397 -38.686 1.00 31.97 C ATOM 2007 CD GLU A 243 -8.244 55.791 -38.559 1.00 33.13 C ATOM 2008 OE1 GLU A 243 -8.979 56.720 -38.967 1.00 36.33 O ATOM 2009 OE2 GLU A 243 -7.120 55.978 -38.072 1.00 35.92 O ATOM 0 H GLU A 243 -6.903 50.973 -37.991 1.00 30.82 H new ATOM 0 HA GLU A 243 -8.521 52.352 -36.718 1.00 30.90 H new ATOM 0 HB2 GLU A 243 -7.004 53.609 -37.874 1.00 31.06 H new ATOM 0 HB3 GLU A 243 -7.367 52.940 -39.235 1.00 31.06 H new ATOM 0 HG2 GLU A 243 -9.106 54.279 -39.585 1.00 31.97 H new ATOM 0 HG3 GLU A 243 -9.510 54.292 -38.079 1.00 31.97 H new ATOM 2010 N CYS A 244 -10.177 51.124 -39.190 1.00 29.01 N ATOM 2011 CA CYS A 244 -11.528 51.169 -39.829 1.00 26.73 C ATOM 2012 C CYS A 244 -12.417 50.161 -39.242 1.00 27.91 C ATOM 2013 O CYS A 244 -13.477 49.883 -39.804 1.00 30.45 O ATOM 2014 CB CYS A 244 -11.472 50.829 -41.274 1.00 25.84 C ATOM 2015 SG CYS A 244 -10.619 52.036 -42.153 1.00 23.14 S ATOM 0 H CYS A 244 -9.651 50.506 -39.475 1.00 29.01 H new ATOM 0 HA CYS A 244 -11.848 52.074 -39.690 1.00 26.73 H new ATOM 0 HB2 CYS A 244 -11.038 49.970 -41.392 1.00 25.84 H new ATOM 0 HB3 CYS A 244 -12.372 50.742 -41.625 1.00 25.84 H new ATOM 0 HG CYS A 244 -10.586 51.737 -43.315 1.00 23.14 H new ATOM 2016 N GLY A 245 -12.001 49.557 -38.132 1.00 28.08 N ATOM 2017 CA GLY A 245 -12.831 48.577 -37.450 1.00 27.91 C ATOM 2018 C GLY A 245 -13.005 47.313 -38.294 1.00 29.36 C ATOM 2019 O GLY A 245 -14.055 46.655 -38.228 1.00 31.16 O ATOM 0 H GLY A 245 -11.240 49.703 -37.759 1.00 28.08 H new ATOM 0 HA2 GLY A 245 -12.429 48.347 -36.598 1.00 27.91 H new ATOM 0 HA3 GLY A 245 -13.700 48.963 -37.259 1.00 27.91 H new ATOM 2020 N LEU A 246 -11.994 46.943 -39.083 1.00 28.92 N ATOM 2021 CA LEU A 246 -12.158 45.862 -40.053 1.00 28.87 C ATOM 2022 C LEU A 246 -11.293 44.681 -39.726 1.00 31.35 C ATOM 2023 O LEU A 246 -10.333 44.778 -38.945 1.00 32.54 O ATOM 2024 CB LEU A 246 -11.845 46.363 -41.445 1.00 27.37 C ATOM 2025 CG LEU A 246 -12.988 47.067 -42.129 1.00 20.47 C ATOM 2026 CD1 LEU A 246 -12.565 47.452 -43.450 1.00 13.72 C ATOM 2027 CD2 LEU A 246 -14.098 46.073 -42.234 1.00 24.16 C ATOM 0 H LEU A 246 -11.213 47.302 -39.072 1.00 28.92 H new ATOM 0 HA LEU A 246 -13.082 45.570 -40.013 1.00 28.87 H new ATOM 0 HB2 LEU A 246 -11.090 46.970 -41.396 1.00 27.37 H new ATOM 0 HB3 LEU A 246 -11.569 45.611 -41.992 1.00 27.37 H new ATOM 0 HG LEU A 246 -13.270 47.857 -41.642 1.00 20.47 H new ATOM 0 HD11 LEU A 246 -13.292 47.907 -43.903 1.00 13.72 H new ATOM 0 HD12 LEU A 246 -11.802 48.047 -43.385 1.00 13.72 H new ATOM 0 HD13 LEU A 246 -12.316 46.661 -43.953 1.00 13.72 H new ATOM 0 HD21 LEU A 246 -14.860 46.484 -42.671 1.00 24.16 H new ATOM 0 HD22 LEU A 246 -13.801 45.310 -42.754 1.00 24.16 H new ATOM 0 HD23 LEU A 246 -14.354 45.779 -41.346 1.00 24.16 H new ATOM 2028 N GLU A 247 -11.592 43.551 -40.340 1.00 33.58 N ATOM 2029 CA GLU A 247 -10.709 42.427 -40.111 1.00 35.28 C ATOM 2030 C GLU A 247 -9.640 42.473 -41.182 1.00 34.06 C ATOM 2031 O GLU A 247 -9.755 43.241 -42.149 1.00 34.38 O ATOM 2032 CB GLU A 247 -11.467 41.158 -40.253 1.00 36.67 C ATOM 2033 CG GLU A 247 -10.862 40.071 -39.471 1.00 46.67 C ATOM 2034 CD GLU A 247 -11.646 39.868 -38.193 1.00 60.28 C ATOM 2035 OE1 GLU A 247 -12.691 39.136 -38.255 1.00 64.21 O ATOM 2036 OE2 GLU A 247 -11.222 40.446 -37.138 1.00 66.65 O ATOM 0 H GLU A 247 -12.261 43.416 -40.864 1.00 33.58 H new ATOM 0 HA GLU A 247 -10.325 42.471 -39.221 1.00 35.28 H new ATOM 0 HB2 GLU A 247 -12.383 41.294 -39.963 1.00 36.67 H new ATOM 0 HB3 GLU A 247 -11.500 40.904 -41.189 1.00 36.67 H new ATOM 0 HG2 GLU A 247 -10.855 39.252 -39.990 1.00 46.67 H new ATOM 0 HG3 GLU A 247 -9.939 40.284 -39.264 1.00 46.67 H new ATOM 2037 N VAL A 248 -8.636 41.618 -41.067 1.00 31.69 N ATOM 2038 CA VAL A 248 -7.537 41.693 -41.990 1.00 29.02 C ATOM 2039 C VAL A 248 -7.658 40.520 -42.959 1.00 26.82 C ATOM 2040 O VAL A 248 -8.103 39.427 -42.597 1.00 27.03 O ATOM 2041 CB VAL A 248 -6.274 41.788 -41.169 1.00 28.19 C ATOM 2042 CG1 VAL A 248 -5.665 40.413 -40.885 1.00 31.15 C ATOM 2043 CG2 VAL A 248 -5.355 42.645 -41.820 1.00 30.72 C ATOM 0 H VAL A 248 -8.578 41.001 -40.471 1.00 31.69 H new ATOM 0 HA VAL A 248 -7.530 42.477 -42.561 1.00 29.02 H new ATOM 0 HB VAL A 248 -6.497 42.164 -40.303 1.00 28.19 H new ATOM 0 HG11 VAL A 248 -4.858 40.519 -40.357 1.00 31.15 H new ATOM 0 HG12 VAL A 248 -6.303 39.871 -40.395 1.00 31.15 H new ATOM 0 HG13 VAL A 248 -5.447 39.976 -41.723 1.00 31.15 H new ATOM 0 HG21 VAL A 248 -4.542 42.708 -41.294 1.00 30.72 H new ATOM 0 HG22 VAL A 248 -5.145 42.288 -42.697 1.00 30.72 H new ATOM 0 HG23 VAL A 248 -5.747 43.527 -41.915 1.00 30.72 H new ATOM 2044 N GLY A 249 -7.319 40.778 -44.197 1.00 24.94 N ATOM 2045 CA GLY A 249 -7.528 39.853 -45.285 1.00 22.13 C ATOM 2046 C GLY A 249 -6.178 39.505 -45.880 1.00 22.05 C ATOM 2047 O GLY A 249 -5.330 38.946 -45.184 1.00 22.73 O ATOM 0 H GLY A 249 -6.950 41.516 -44.439 1.00 24.94 H new ATOM 0 HA2 GLY A 249 -7.974 39.052 -44.967 1.00 22.13 H new ATOM 0 HA3 GLY A 249 -8.103 40.248 -45.959 1.00 22.13 H new ATOM 2048 N GLU A 250 -5.932 39.786 -47.145 1.00 19.68 N ATOM 2049 CA GLU A 250 -4.597 39.446 -47.641 1.00 20.31 C ATOM 2050 C GLU A 250 -3.775 40.625 -48.027 1.00 19.54 C ATOM 2051 O GLU A 250 -4.315 41.661 -48.471 1.00 22.65 O ATOM 2052 CB GLU A 250 -4.668 38.616 -48.925 1.00 19.46 C ATOM 2053 CG GLU A 250 -5.408 37.407 -48.785 1.00 21.55 C ATOM 2054 CD GLU A 250 -5.664 36.769 -50.067 1.00 21.84 C ATOM 2055 OE1 GLU A 250 -6.751 37.002 -50.545 1.00 32.07 O ATOM 2056 OE2 GLU A 250 -4.841 36.010 -50.605 1.00 26.35 O ATOM 0 H GLU A 250 -6.475 40.147 -47.706 1.00 19.68 H new ATOM 0 HA GLU A 250 -4.198 38.972 -46.895 1.00 20.31 H new ATOM 0 HB2 GLU A 250 -5.070 39.153 -49.626 1.00 19.46 H new ATOM 0 HB3 GLU A 250 -3.767 38.403 -49.213 1.00 19.46 H new ATOM 0 HG2 GLU A 250 -4.919 36.795 -48.213 1.00 21.55 H new ATOM 0 HG3 GLU A 250 -6.252 37.595 -48.345 1.00 21.55 H new ATOM 2057 N PHE A 251 -2.482 40.458 -47.963 1.00 16.96 N ATOM 2058 CA PHE A 251 -1.564 41.345 -48.601 1.00 16.13 C ATOM 2059 C PHE A 251 -1.091 40.699 -49.932 1.00 16.37 C ATOM 2060 O PHE A 251 -0.536 39.569 -49.927 1.00 16.90 O ATOM 2061 CB PHE A 251 -0.353 41.622 -47.716 1.00 15.11 C ATOM 2062 CG PHE A 251 0.756 42.355 -48.448 1.00 15.39 C ATOM 2063 CD1 PHE A 251 0.504 43.568 -49.114 1.00 12.53 C ATOM 2064 CD2 PHE A 251 2.044 41.815 -48.529 1.00 14.30 C ATOM 2065 CE1 PHE A 251 1.579 44.266 -49.834 1.00 12.63 C ATOM 2066 CE2 PHE A 251 3.063 42.461 -49.280 1.00 12.36 C ATOM 2067 CZ PHE A 251 2.800 43.665 -49.935 1.00 13.67 C ATOM 0 H PHE A 251 -2.107 39.811 -47.538 1.00 16.96 H new ATOM 0 HA PHE A 251 -2.013 42.188 -48.769 1.00 16.13 H new ATOM 0 HB2 PHE A 251 -0.631 42.148 -46.950 1.00 15.11 H new ATOM 0 HB3 PHE A 251 -0.009 40.782 -47.374 1.00 15.11 H new ATOM 0 HD1 PHE A 251 -0.352 43.932 -49.099 1.00 12.53 H new ATOM 0 HD2 PHE A 251 2.236 41.021 -48.085 1.00 14.30 H new ATOM 0 HE1 PHE A 251 1.430 45.102 -50.214 1.00 12.63 H new ATOM 0 HE2 PHE A 251 3.909 42.080 -49.335 1.00 12.36 H new ATOM 0 HZ PHE A 251 3.466 44.063 -50.447 1.00 13.67 H new ATOM 2068 N ILE A 252 -1.310 41.420 -51.045 1.00 15.77 N ATOM 2069 CA ILE A 252 -0.967 40.973 -52.428 1.00 15.39 C ATOM 2070 C ILE A 252 0.196 41.801 -52.999 1.00 15.99 C ATOM 2071 O ILE A 252 0.100 43.042 -53.146 1.00 15.82 O ATOM 2072 CB ILE A 252 -2.185 41.079 -53.377 1.00 13.72 C ATOM 2073 CG1 ILE A 252 -3.249 40.092 -52.983 1.00 14.22 C ATOM 2074 CG2 ILE A 252 -1.825 40.666 -54.811 1.00 12.81 C ATOM 2075 CD1 ILE A 252 -4.563 40.710 -52.673 1.00 19.72 C ATOM 0 H ILE A 252 -1.670 42.201 -51.024 1.00 15.77 H new ATOM 0 HA ILE A 252 -0.700 40.042 -52.368 1.00 15.39 H new ATOM 0 HB ILE A 252 -2.477 42.002 -53.322 1.00 13.72 H new ATOM 0 HG12 ILE A 252 -3.365 39.452 -53.702 1.00 14.22 H new ATOM 0 HG13 ILE A 252 -2.945 39.595 -52.207 1.00 14.22 H new ATOM 0 HG21 ILE A 252 -2.609 40.744 -55.377 1.00 12.81 H new ATOM 0 HG22 ILE A 252 -1.124 41.245 -55.148 1.00 12.81 H new ATOM 0 HG23 ILE A 252 -1.514 39.747 -54.815 1.00 12.81 H new ATOM 0 HD11 ILE A 252 -5.197 40.018 -52.428 1.00 19.72 H new ATOM 0 HD12 ILE A 252 -4.463 41.331 -51.935 1.00 19.72 H new ATOM 0 HD13 ILE A 252 -4.889 41.185 -53.453 1.00 19.72 H new ATOM 2076 N HIS A 253 1.268 41.114 -53.409 1.00 15.60 N ATOM 2077 CA HIS A 253 2.450 41.827 -53.768 1.00 14.07 C ATOM 2078 C HIS A 253 2.711 41.637 -55.278 1.00 15.17 C ATOM 2079 O HIS A 253 2.994 40.522 -55.751 1.00 17.51 O ATOM 2080 CB HIS A 253 3.580 41.378 -52.850 1.00 11.62 C ATOM 2081 CG HIS A 253 4.761 42.319 -52.808 1.00 16.07 C ATOM 2082 ND1 HIS A 253 5.655 42.322 -51.764 1.00 10.28 N ATOM 2083 CD2 HIS A 253 5.164 43.330 -53.644 1.00 17.62 C ATOM 2084 CE1 HIS A 253 6.559 43.279 -51.962 1.00 16.66 C ATOM 2085 NE2 HIS A 253 6.317 43.880 -53.107 1.00 11.61 N ATOM 0 H HIS A 253 1.313 40.258 -53.479 1.00 15.60 H new ATOM 0 HA HIS A 253 2.364 42.785 -53.639 1.00 14.07 H new ATOM 0 HB2 HIS A 253 3.230 41.275 -51.951 1.00 11.62 H new ATOM 0 HB3 HIS A 253 3.887 40.504 -53.137 1.00 11.62 H new ATOM 0 HD2 HIS A 253 4.741 43.597 -54.428 1.00 17.62 H new ATOM 0 HE1 HIS A 253 7.254 43.490 -51.381 1.00 16.66 H new ATOM 0 HE2 HIS A 253 6.791 44.505 -53.460 1.00 11.61 H new ATOM 2086 N THR A 254 2.677 42.729 -56.044 1.00 13.84 N ATOM 2087 CA THR A 254 2.725 42.628 -57.466 1.00 11.78 C ATOM 2088 C THR A 254 3.970 43.262 -57.907 1.00 13.05 C ATOM 2089 O THR A 254 4.300 44.371 -57.439 1.00 13.15 O ATOM 2090 CB THR A 254 1.509 43.215 -58.188 1.00 11.27 C ATOM 2091 OG1 THR A 254 0.308 42.462 -57.831 1.00 9.89 O ATOM 2092 CG2 THR A 254 1.691 43.021 -59.706 1.00 10.73 C ATOM 0 H THR A 254 2.626 43.532 -55.741 1.00 13.84 H new ATOM 0 HA THR A 254 2.702 41.688 -57.704 1.00 11.78 H new ATOM 0 HB THR A 254 1.426 44.150 -57.942 1.00 11.27 H new ATOM 0 HG1 THR A 254 -0.323 42.996 -57.681 1.00 9.89 H new ATOM 0 HG21 THR A 254 0.925 43.390 -60.174 1.00 10.73 H new ATOM 0 HG22 THR A 254 2.497 43.476 -59.996 1.00 10.73 H new ATOM 0 HG23 THR A 254 1.766 42.075 -59.905 1.00 10.73 H new ATOM 2093 N PHE A 255 4.707 42.599 -58.800 1.00 11.96 N ATOM 2094 CA PHE A 255 5.949 43.213 -59.198 1.00 12.11 C ATOM 2095 C PHE A 255 6.013 43.417 -60.690 1.00 12.96 C ATOM 2096 O PHE A 255 5.447 42.592 -61.567 1.00 12.40 O ATOM 2097 CB PHE A 255 7.133 42.305 -58.876 1.00 13.73 C ATOM 2098 CG PHE A 255 7.285 41.918 -57.449 1.00 14.08 C ATOM 2099 CD1 PHE A 255 6.654 40.775 -56.933 1.00 19.38 C ATOM 2100 CD2 PHE A 255 8.136 42.627 -56.622 1.00 17.42 C ATOM 2101 CE1 PHE A 255 6.825 40.380 -55.576 1.00 20.79 C ATOM 2102 CE2 PHE A 255 8.308 42.212 -55.239 1.00 17.68 C ATOM 2103 CZ PHE A 255 7.643 41.094 -54.745 1.00 15.74 C ATOM 0 H PHE A 255 4.515 41.843 -59.162 1.00 11.96 H new ATOM 0 HA PHE A 255 5.990 44.056 -58.719 1.00 12.11 H new ATOM 0 HB2 PHE A 255 7.052 41.496 -59.406 1.00 13.73 H new ATOM 0 HB3 PHE A 255 7.946 42.750 -59.161 1.00 13.73 H new ATOM 0 HD1 PHE A 255 6.112 40.264 -57.490 1.00 19.38 H new ATOM 0 HD2 PHE A 255 8.596 43.366 -56.949 1.00 17.42 H new ATOM 0 HE1 PHE A 255 6.377 39.632 -55.253 1.00 20.79 H new ATOM 0 HE2 PHE A 255 8.868 42.699 -54.679 1.00 17.68 H new ATOM 0 HZ PHE A 255 7.754 40.835 -53.859 1.00 15.74 H new ATOM 2104 N GLY A 256 6.748 44.468 -61.008 1.00 11.88 N ATOM 2105 CA GLY A 256 7.214 44.717 -62.345 1.00 13.00 C ATOM 2106 C GLY A 256 8.573 44.098 -62.505 1.00 14.36 C ATOM 2107 O GLY A 256 8.701 42.910 -62.670 1.00 18.58 O ATOM 0 H GLY A 256 6.991 45.064 -60.438 1.00 11.88 H new ATOM 0 HA2 GLY A 256 6.596 44.342 -62.992 1.00 13.00 H new ATOM 0 HA3 GLY A 256 7.257 45.671 -62.514 1.00 13.00 H new ATOM 2108 N ASP A 257 9.636 44.850 -62.470 1.00 17.54 N ATOM 2109 CA ASP A 257 10.972 44.190 -62.487 1.00 18.97 C ATOM 2110 C ASP A 257 11.312 43.673 -61.104 1.00 19.29 C ATOM 2111 O ASP A 257 11.426 44.484 -60.184 1.00 20.71 O ATOM 2112 CB ASP A 257 12.057 45.184 -62.856 1.00 20.22 C ATOM 2113 CG ASP A 257 13.452 44.553 -62.897 1.00 25.82 C ATOM 2114 OD1 ASP A 257 14.017 44.420 -64.007 1.00 28.58 O ATOM 2115 OD2 ASP A 257 14.003 44.269 -61.799 1.00 31.43 O ATOM 0 H ASP A 257 9.641 45.709 -62.437 1.00 17.54 H new ATOM 0 HA ASP A 257 10.931 43.470 -63.135 1.00 18.97 H new ATOM 0 HB2 ASP A 257 11.855 45.569 -63.723 1.00 20.22 H new ATOM 0 HB3 ASP A 257 12.055 45.912 -62.215 1.00 20.22 H new ATOM 2116 N ALA A 258 11.482 42.357 -60.926 1.00 19.00 N ATOM 2117 CA ALA A 258 12.048 41.827 -59.682 1.00 19.35 C ATOM 2118 C ALA A 258 13.385 41.218 -59.949 1.00 21.08 C ATOM 2119 O ALA A 258 13.527 40.314 -60.762 1.00 20.86 O ATOM 2120 CB ALA A 258 11.132 40.844 -59.046 1.00 16.82 C ATOM 0 H ALA A 258 11.277 41.760 -61.510 1.00 19.00 H new ATOM 0 HA ALA A 258 12.159 42.562 -59.059 1.00 19.35 H new ATOM 0 HB1 ALA A 258 11.532 40.511 -58.227 1.00 16.82 H new ATOM 0 HB2 ALA A 258 10.287 41.274 -58.841 1.00 16.82 H new ATOM 0 HB3 ALA A 258 10.978 40.104 -59.654 1.00 16.82 H new ATOM 2121 N HIS A 259 14.383 41.725 -59.254 1.00 24.44 N ATOM 2122 CA HIS A 259 15.788 41.316 -59.487 1.00 26.64 C ATOM 2123 C HIS A 259 16.640 40.811 -58.297 1.00 28.05 C ATOM 2124 O HIS A 259 16.303 40.998 -57.099 1.00 28.29 O ATOM 2125 CB HIS A 259 16.550 42.425 -60.178 1.00 26.75 C ATOM 2126 CG HIS A 259 16.501 43.773 -59.499 1.00 27.55 C ATOM 2127 ND1 HIS A 259 15.385 44.581 -59.527 1.00 31.81 N ATOM 2128 CD2 HIS A 259 17.483 44.535 -58.945 1.00 30.76 C ATOM 2129 CE1 HIS A 259 15.657 45.740 -58.952 1.00 28.69 C ATOM 2130 NE2 HIS A 259 16.927 45.750 -58.614 1.00 26.37 N ATOM 0 H HIS A 259 14.284 42.313 -58.634 1.00 24.44 H new ATOM 0 HA HIS A 259 15.665 40.523 -60.032 1.00 26.64 H new ATOM 0 HB2 HIS A 259 17.478 42.156 -60.259 1.00 26.75 H new ATOM 0 HB3 HIS A 259 16.203 42.522 -61.078 1.00 26.75 H new ATOM 0 HD1 HIS A 259 14.626 44.364 -59.867 1.00 31.81 H new ATOM 0 HD2 HIS A 259 18.368 44.281 -58.814 1.00 30.76 H new ATOM 0 HE1 HIS A 259 15.052 46.432 -58.811 1.00 28.69 H new ATOM 2131 N LEU A 260 17.758 40.191 -58.673 1.00 28.80 N ATOM 2132 CA LEU A 260 18.745 39.695 -57.758 1.00 30.76 C ATOM 2133 C LEU A 260 20.103 40.138 -58.289 1.00 33.02 C ATOM 2134 O LEU A 260 20.461 39.776 -59.402 1.00 31.86 O ATOM 2135 CB LEU A 260 18.668 38.179 -57.750 1.00 30.70 C ATOM 2136 CG LEU A 260 19.328 37.391 -56.662 1.00 27.99 C ATOM 2137 CD1 LEU A 260 18.879 37.804 -55.249 1.00 28.99 C ATOM 2138 CD2 LEU A 260 18.735 36.072 -56.969 1.00 31.54 C ATOM 0 H LEU A 260 17.957 40.050 -59.498 1.00 28.80 H new ATOM 0 HA LEU A 260 18.605 40.027 -56.858 1.00 30.76 H new ATOM 0 HB2 LEU A 260 17.728 37.940 -57.747 1.00 30.70 H new ATOM 0 HB3 LEU A 260 19.037 37.869 -58.592 1.00 30.70 H new ATOM 0 HG LEU A 260 20.294 37.474 -56.648 1.00 27.99 H new ATOM 0 HD11 LEU A 260 19.339 37.260 -54.591 1.00 28.99 H new ATOM 0 HD12 LEU A 260 19.092 38.739 -55.102 1.00 28.99 H new ATOM 0 HD13 LEU A 260 17.922 37.674 -55.163 1.00 28.99 H new ATOM 0 HD21 LEU A 260 19.065 35.414 -56.338 1.00 31.54 H new ATOM 0 HD22 LEU A 260 17.769 36.128 -56.902 1.00 31.54 H new ATOM 0 HD23 LEU A 260 18.981 35.808 -57.869 1.00 31.54 H new ATOM 2139 N TRP A 261 20.824 40.982 -57.536 1.00 35.98 N ATOM 2140 CA TRP A 261 22.162 41.426 -57.952 1.00 39.07 C ATOM 2141 C TRP A 261 22.973 40.183 -57.935 1.00 39.12 C ATOM 2142 O TRP A 261 22.719 39.284 -57.071 1.00 39.48 O ATOM 2143 CB TRP A 261 22.763 42.461 -56.997 1.00 41.17 C ATOM 2144 CG TRP A 261 21.945 43.679 -56.994 1.00 44.91 C ATOM 2145 CD1 TRP A 261 20.971 44.022 -56.070 1.00 48.22 C ATOM 2146 CD2 TRP A 261 21.938 44.726 -57.997 1.00 48.13 C ATOM 2147 NE1 TRP A 261 20.371 45.235 -56.433 1.00 49.66 N ATOM 2148 CE2 TRP A 261 20.945 45.694 -57.594 1.00 49.03 C ATOM 2149 CE3 TRP A 261 22.686 44.961 -59.168 1.00 48.51 C ATOM 2150 CZ2 TRP A 261 20.689 46.887 -58.325 1.00 47.70 C ATOM 2151 CZ3 TRP A 261 22.415 46.153 -59.919 1.00 48.45 C ATOM 2152 CH2 TRP A 261 21.416 47.098 -59.477 1.00 46.97 C ATOM 0 H TRP A 261 20.557 41.307 -56.786 1.00 35.98 H new ATOM 0 HA TRP A 261 22.135 41.863 -58.818 1.00 39.07 H new ATOM 0 HB2 TRP A 261 22.813 42.094 -56.100 1.00 41.17 H new ATOM 0 HB3 TRP A 261 23.670 42.673 -57.267 1.00 41.17 H new ATOM 0 HD1 TRP A 261 20.748 43.521 -55.319 1.00 48.22 H new ATOM 0 HE1 TRP A 261 19.743 45.630 -55.998 1.00 49.66 H new ATOM 0 HE3 TRP A 261 23.338 44.359 -59.447 1.00 48.51 H new ATOM 0 HZ2 TRP A 261 20.054 47.502 -58.036 1.00 47.70 H new ATOM 0 HZ3 TRP A 261 22.889 46.320 -60.701 1.00 48.45 H new ATOM 0 HH2 TRP A 261 21.260 47.865 -59.980 1.00 46.97 H new ATOM 2153 N VAL A 262 23.900 40.078 -58.867 1.00 37.45 N ATOM 2154 CA VAL A 262 24.698 38.864 -58.854 1.00 38.70 C ATOM 2155 C VAL A 262 25.609 38.628 -57.586 1.00 38.21 C ATOM 2156 O VAL A 262 25.741 37.507 -57.088 1.00 37.82 O ATOM 2157 CB VAL A 262 25.434 38.706 -60.129 1.00 38.61 C ATOM 2158 CG1 VAL A 262 26.204 39.992 -60.427 1.00 38.27 C ATOM 2159 CG2 VAL A 262 26.276 37.466 -60.010 1.00 39.84 C ATOM 0 H VAL A 262 24.079 40.654 -59.480 1.00 37.45 H new ATOM 0 HA VAL A 262 24.049 38.148 -58.771 1.00 38.70 H new ATOM 0 HB VAL A 262 24.852 38.579 -60.894 1.00 38.61 H new ATOM 0 HG11 VAL A 262 26.688 39.893 -61.262 1.00 38.27 H new ATOM 0 HG12 VAL A 262 25.582 40.732 -60.500 1.00 38.27 H new ATOM 0 HG13 VAL A 262 26.832 40.167 -59.709 1.00 38.27 H new ATOM 0 HG21 VAL A 262 26.774 37.332 -60.832 1.00 39.84 H new ATOM 0 HG22 VAL A 262 26.895 37.565 -59.270 1.00 39.84 H new ATOM 0 HG23 VAL A 262 25.703 36.700 -59.851 1.00 39.84 H new ATOM 2160 N ASN A 263 26.148 39.694 -57.032 1.00 38.54 N ATOM 2161 CA ASN A 263 26.800 39.643 -55.722 1.00 39.96 C ATOM 2162 C ASN A 263 25.969 39.053 -54.562 1.00 38.81 C ATOM 2163 O ASN A 263 26.330 39.231 -53.400 1.00 41.10 O ATOM 2164 CB ASN A 263 27.312 41.062 -55.332 1.00 41.03 C ATOM 2165 CG ASN A 263 26.217 42.257 -55.557 1.00 49.07 C ATOM 2166 OD1 ASN A 263 26.157 42.820 -56.795 1.00 52.93 O flip ATOM 2167 ND2 ASN A 263 25.511 42.683 -54.609 1.00 54.04 N flip ATOM 0 H ASN A 263 26.151 40.472 -57.398 1.00 38.54 H new ATOM 0 HA ASN A 263 27.530 39.015 -55.841 1.00 39.96 H new ATOM 0 HB2 ASN A 263 27.579 41.053 -54.399 1.00 41.03 H new ATOM 0 HB3 ASN A 263 28.106 41.262 -55.852 1.00 41.03 H new ATOM 0 HD21 ASN A 263 25.563 42.314 -53.834 1.00 54.04 H new ATOM 0 HD22 ASN A 263 24.975 43.344 -54.735 1.00 54.04 H new ATOM 2168 N HIS A 264 24.850 38.382 -54.823 1.00 36.23 N ATOM 2169 CA HIS A 264 23.983 37.950 -53.714 1.00 34.07 C ATOM 2170 C HIS A 264 23.597 36.486 -53.863 1.00 32.28 C ATOM 2171 O HIS A 264 22.807 35.938 -53.020 1.00 32.16 O ATOM 2172 CB HIS A 264 22.658 38.801 -53.592 1.00 33.79 C ATOM 2173 CG HIS A 264 22.830 40.198 -53.067 1.00 35.86 C ATOM 2174 ND1 HIS A 264 21.831 41.150 -53.164 1.00 38.42 N ATOM 2175 CD2 HIS A 264 23.859 40.810 -52.422 1.00 38.85 C ATOM 2176 CE1 HIS A 264 22.234 42.288 -52.620 1.00 36.98 C ATOM 2177 NE2 HIS A 264 23.457 42.109 -52.154 1.00 39.96 N ATOM 0 H HIS A 264 24.575 38.169 -55.610 1.00 36.23 H new ATOM 0 HA HIS A 264 24.507 38.085 -52.909 1.00 34.07 H new ATOM 0 HB2 HIS A 264 22.243 38.850 -54.467 1.00 33.79 H new ATOM 0 HB3 HIS A 264 22.041 38.328 -53.012 1.00 33.79 H new ATOM 0 HD1 HIS A 264 21.061 41.022 -53.525 1.00 38.42 H new ATOM 0 HD2 HIS A 264 24.678 40.429 -52.202 1.00 38.85 H new ATOM 0 HE1 HIS A 264 21.742 43.076 -52.574 1.00 36.98 H new ATOM 0 HE2 HIS A 264 23.928 42.703 -51.749 1.00 39.96 H new ATOM 2178 N LEU A 265 24.118 35.858 -54.915 1.00 30.61 N ATOM 2179 CA LEU A 265 23.780 34.492 -55.249 1.00 30.73 C ATOM 2180 C LEU A 265 24.045 33.490 -54.140 1.00 30.65 C ATOM 2181 O LEU A 265 23.197 32.672 -53.837 1.00 30.60 O ATOM 2182 CB LEU A 265 24.513 34.108 -56.491 1.00 30.92 C ATOM 2183 CG LEU A 265 23.846 34.408 -57.820 1.00 36.54 C ATOM 2184 CD1 LEU A 265 22.823 35.603 -57.810 1.00 39.03 C ATOM 2185 CD2 LEU A 265 24.909 34.671 -58.877 1.00 41.12 C ATOM 0 H LEU A 265 24.681 36.221 -55.454 1.00 30.61 H new ATOM 0 HA LEU A 265 22.820 34.463 -55.387 1.00 30.73 H new ATOM 0 HB2 LEU A 265 25.374 34.555 -56.481 1.00 30.92 H new ATOM 0 HB3 LEU A 265 24.688 33.155 -56.453 1.00 30.92 H new ATOM 0 HG LEU A 265 23.321 33.618 -58.022 1.00 36.54 H new ATOM 0 HD11 LEU A 265 22.451 35.718 -58.698 1.00 39.03 H new ATOM 0 HD12 LEU A 265 22.108 35.412 -57.183 1.00 39.03 H new ATOM 0 HD13 LEU A 265 23.278 36.417 -57.543 1.00 39.03 H new ATOM 0 HD21 LEU A 265 24.481 34.863 -59.726 1.00 41.12 H new ATOM 0 HD22 LEU A 265 25.450 35.430 -58.610 1.00 41.12 H new ATOM 0 HD23 LEU A 265 25.474 33.888 -58.970 1.00 41.12 H new ATOM 2186 N ASP A 266 25.195 33.598 -53.493 1.00 30.21 N ATOM 2187 CA ASP A 266 25.573 32.665 -52.470 1.00 31.99 C ATOM 2188 C ASP A 266 24.730 32.809 -51.276 1.00 32.04 C ATOM 2189 O ASP A 266 24.336 31.819 -50.666 1.00 32.04 O ATOM 2190 CB ASP A 266 27.019 32.904 -52.050 1.00 33.69 C ATOM 2191 CG ASP A 266 28.010 32.405 -53.108 1.00 39.62 C ATOM 2192 OD1 ASP A 266 29.001 33.118 -53.395 1.00 44.27 O ATOM 2193 OD2 ASP A 266 27.777 31.291 -53.686 1.00 46.81 O ATOM 0 H ASP A 266 25.773 34.217 -53.641 1.00 30.21 H new ATOM 0 HA ASP A 266 25.464 31.775 -52.840 1.00 31.99 H new ATOM 0 HB2 ASP A 266 27.159 33.852 -51.897 1.00 33.69 H new ATOM 0 HB3 ASP A 266 27.190 32.453 -51.208 1.00 33.69 H new ATOM 2194 N GLN A 267 24.516 34.068 -50.892 1.00 32.26 N ATOM 2195 CA GLN A 267 23.723 34.435 -49.745 1.00 30.78 C ATOM 2196 C GLN A 267 22.299 33.969 -49.933 1.00 30.82 C ATOM 2197 O GLN A 267 21.760 33.290 -49.055 1.00 31.61 O ATOM 2198 CB GLN A 267 23.811 35.904 -49.542 1.00 30.16 C ATOM 2199 CG GLN A 267 25.167 36.321 -49.146 1.00 34.62 C ATOM 2200 CD GLN A 267 26.036 36.727 -50.315 1.00 41.92 C ATOM 2201 OE1 GLN A 267 25.964 36.125 -51.394 1.00 46.31 O ATOM 2202 NE2 GLN A 267 26.788 37.690 -50.168 1.00 44.64 N ATOM 0 H GLN A 267 24.842 34.744 -51.311 1.00 32.26 H new ATOM 0 HA GLN A 267 24.063 34.001 -48.947 1.00 30.78 H new ATOM 0 HB2 GLN A 267 23.559 36.359 -50.360 1.00 30.16 H new ATOM 0 HB3 GLN A 267 23.177 36.175 -48.860 1.00 30.16 H new ATOM 0 HG2 GLN A 267 25.101 37.065 -48.527 1.00 34.62 H new ATOM 0 HG3 GLN A 267 25.596 35.593 -48.670 1.00 34.62 H new ATOM 0 HE21 GLN A 267 26.824 38.096 -49.411 1.00 44.64 H new ATOM 0 HE22 GLN A 267 27.277 37.957 -50.823 1.00 44.64 H new ATOM 2203 N ILE A 268 21.676 34.247 -51.075 1.00 31.14 N ATOM 2204 CA ILE A 268 20.309 33.744 -51.234 1.00 30.89 C ATOM 2205 C ILE A 268 20.260 32.208 -51.199 1.00 31.35 C ATOM 2206 O ILE A 268 19.357 31.618 -50.609 1.00 31.64 O ATOM 2207 CB ILE A 268 19.588 34.303 -52.483 1.00 31.09 C ATOM 2208 CG1 ILE A 268 18.035 34.170 -52.353 1.00 31.03 C ATOM 2209 CG2 ILE A 268 20.044 33.562 -53.654 1.00 29.01 C ATOM 2210 CD1 ILE A 268 17.549 34.416 -50.921 1.00 32.64 C ATOM 0 H ILE A 268 21.999 34.696 -51.734 1.00 31.14 H new ATOM 0 HA ILE A 268 19.816 34.078 -50.468 1.00 30.89 H new ATOM 0 HB ILE A 268 19.800 35.246 -52.570 1.00 31.09 H new ATOM 0 HG12 ILE A 268 17.607 34.803 -52.951 1.00 31.03 H new ATOM 0 HG13 ILE A 268 17.763 33.283 -52.637 1.00 31.03 H new ATOM 0 HG21 ILE A 268 19.599 33.902 -54.446 1.00 29.01 H new ATOM 0 HG22 ILE A 268 21.003 33.669 -53.751 1.00 29.01 H new ATOM 0 HG23 ILE A 268 19.833 32.622 -53.544 1.00 29.01 H new ATOM 0 HD11 ILE A 268 16.584 34.324 -50.886 1.00 32.64 H new ATOM 0 HD12 ILE A 268 17.957 33.769 -50.325 1.00 32.64 H new ATOM 0 HD13 ILE A 268 17.798 35.312 -50.644 1.00 32.64 H new ATOM 2211 N LYS A 269 21.239 31.543 -51.793 1.00 32.88 N ATOM 2212 CA LYS A 269 21.240 30.082 -51.773 1.00 33.06 C ATOM 2213 C LYS A 269 21.341 29.541 -50.371 1.00 33.90 C ATOM 2214 O LYS A 269 20.622 28.573 -50.006 1.00 35.28 O ATOM 2215 CB LYS A 269 22.374 29.548 -52.569 1.00 33.89 C ATOM 2216 CG LYS A 269 22.282 29.805 -54.015 1.00 35.57 C ATOM 2217 CD LYS A 269 23.272 28.912 -54.678 1.00 39.72 C ATOM 2218 CE LYS A 269 23.912 29.606 -55.904 1.00 47.26 C ATOM 2219 NZ LYS A 269 23.692 28.696 -57.108 1.00 50.91 N ATOM 0 H LYS A 269 21.901 31.905 -52.206 1.00 32.88 H new ATOM 0 HA LYS A 269 20.397 29.797 -52.160 1.00 33.06 H new ATOM 0 HB2 LYS A 269 23.199 29.935 -52.235 1.00 33.89 H new ATOM 0 HB3 LYS A 269 22.432 28.590 -52.426 1.00 33.89 H new ATOM 0 HG2 LYS A 269 21.386 29.625 -54.339 1.00 35.57 H new ATOM 0 HG3 LYS A 269 22.473 30.735 -54.211 1.00 35.57 H new ATOM 0 HD2 LYS A 269 23.964 28.664 -54.045 1.00 39.72 H new ATOM 0 HD3 LYS A 269 22.836 28.092 -54.958 1.00 39.72 H new ATOM 0 HE2 LYS A 269 23.508 30.475 -56.054 1.00 47.26 H new ATOM 0 HE3 LYS A 269 24.859 29.755 -55.757 1.00 47.26 H new ATOM 0 HZ1 LYS A 269 24.050 29.069 -57.832 1.00 50.91 H new ATOM 0 HZ2 LYS A 269 24.078 27.908 -56.959 1.00 50.91 H new ATOM 0 HZ3 LYS A 269 22.819 28.579 -57.236 1.00 50.91 H new ATOM 2220 N GLU A 270 22.183 30.156 -49.537 1.00 33.74 N ATOM 2221 CA GLU A 270 22.284 29.640 -48.207 1.00 34.10 C ATOM 2222 C GLU A 270 20.906 29.663 -47.591 1.00 33.68 C ATOM 2223 O GLU A 270 20.473 28.684 -46.974 1.00 34.21 O ATOM 2224 CB GLU A 270 23.281 30.401 -47.354 1.00 35.22 C ATOM 2225 CG GLU A 270 23.581 29.649 -46.027 1.00 40.35 C ATOM 2226 CD GLU A 270 22.464 29.776 -44.937 1.00 49.50 C ATOM 2227 OE1 GLU A 270 22.121 28.772 -44.192 1.00 47.95 O ATOM 2228 OE2 GLU A 270 21.939 30.916 -44.821 1.00 56.57 O ATOM 0 H GLU A 270 22.674 30.837 -49.722 1.00 33.74 H new ATOM 0 HA GLU A 270 22.622 28.732 -48.249 1.00 34.10 H new ATOM 0 HB2 GLU A 270 24.105 30.526 -47.850 1.00 35.22 H new ATOM 0 HB3 GLU A 270 22.932 31.284 -47.156 1.00 35.22 H new ATOM 0 HG2 GLU A 270 23.717 28.709 -46.225 1.00 40.35 H new ATOM 0 HG3 GLU A 270 24.414 29.985 -45.660 1.00 40.35 H new ATOM 2229 N GLN A 271 20.200 30.776 -47.791 1.00 33.17 N ATOM 2230 CA GLN A 271 18.875 31.021 -47.185 1.00 31.77 C ATOM 2231 C GLN A 271 17.856 30.001 -47.608 1.00 30.62 C ATOM 2232 O GLN A 271 17.074 29.517 -46.799 1.00 29.98 O ATOM 2233 CB GLN A 271 18.392 32.440 -47.512 1.00 32.27 C ATOM 2234 CG GLN A 271 17.361 32.984 -46.534 1.00 33.92 C ATOM 2235 CD GLN A 271 16.805 34.344 -46.970 1.00 32.67 C ATOM 2236 OE1 GLN A 271 17.602 35.127 -47.671 1.00 34.24 O flip ATOM 2237 NE2 GLN A 271 15.676 34.673 -46.661 1.00 34.91 N flip ATOM 0 H GLN A 271 20.475 31.422 -48.288 1.00 33.17 H new ATOM 0 HA GLN A 271 18.977 30.936 -46.224 1.00 31.77 H new ATOM 0 HB2 GLN A 271 19.157 33.037 -47.526 1.00 32.27 H new ATOM 0 HB3 GLN A 271 18.012 32.445 -48.404 1.00 32.27 H new ATOM 0 HG2 GLN A 271 16.631 32.350 -46.451 1.00 33.92 H new ATOM 0 HG3 GLN A 271 17.764 33.068 -45.656 1.00 33.92 H new ATOM 0 HE21 GLN A 271 15.182 34.138 -46.203 1.00 34.91 H new ATOM 0 HE22 GLN A 271 15.371 35.441 -46.900 1.00 34.91 H new ATOM 2238 N LEU A 272 17.892 29.662 -48.892 1.00 29.99 N ATOM 2239 CA LEU A 272 16.991 28.683 -49.447 1.00 29.44 C ATOM 2240 C LEU A 272 17.199 27.277 -48.854 1.00 30.65 C ATOM 2241 O LEU A 272 16.458 26.354 -49.179 1.00 30.78 O ATOM 2242 CB LEU A 272 17.194 28.647 -50.949 1.00 30.00 C ATOM 2243 CG LEU A 272 16.393 29.691 -51.723 1.00 28.17 C ATOM 2244 CD1 LEU A 272 16.753 29.648 -53.190 1.00 23.18 C ATOM 2245 CD2 LEU A 272 14.966 29.310 -51.563 1.00 30.24 C ATOM 0 H LEU A 272 18.443 29.998 -49.460 1.00 29.99 H new ATOM 0 HA LEU A 272 16.084 28.944 -49.223 1.00 29.44 H new ATOM 0 HB2 LEU A 272 18.137 28.773 -51.139 1.00 30.00 H new ATOM 0 HB3 LEU A 272 16.954 27.765 -51.275 1.00 30.00 H new ATOM 0 HG LEU A 272 16.575 30.585 -51.394 1.00 28.17 H new ATOM 0 HD11 LEU A 272 16.238 30.315 -53.670 1.00 23.18 H new ATOM 0 HD12 LEU A 272 17.699 29.833 -53.297 1.00 23.18 H new ATOM 0 HD13 LEU A 272 16.553 28.768 -53.547 1.00 23.18 H new ATOM 0 HD21 LEU A 272 14.406 29.944 -52.038 1.00 30.24 H new ATOM 0 HD22 LEU A 272 14.826 28.421 -51.925 1.00 30.24 H new ATOM 0 HD23 LEU A 272 14.733 29.316 -50.621 1.00 30.24 H new ATOM 2246 N SER A 273 18.201 27.089 -47.985 1.00 30.02 N ATOM 2247 CA SER A 273 18.422 25.777 -47.396 1.00 29.46 C ATOM 2248 C SER A 273 17.918 25.687 -45.964 1.00 28.37 C ATOM 2249 O SER A 273 18.230 24.749 -45.237 1.00 27.39 O ATOM 2250 CB SER A 273 19.914 25.493 -47.409 1.00 30.45 C ATOM 2251 OG SER A 273 20.503 26.341 -46.468 1.00 30.69 O ATOM 0 H SER A 273 18.751 27.700 -47.732 1.00 30.02 H new ATOM 0 HA SER A 273 17.927 25.127 -47.920 1.00 29.46 H new ATOM 0 HB2 SER A 273 20.088 24.564 -47.189 1.00 30.45 H new ATOM 0 HB3 SER A 273 20.285 25.650 -48.291 1.00 30.45 H new ATOM 0 HG SER A 273 20.681 27.079 -46.828 1.00 30.69 H new ATOM 2252 N ARG A 274 17.174 26.708 -45.556 1.00 28.25 N ATOM 2253 CA ARG A 274 16.622 26.733 -44.233 1.00 27.65 C ATOM 2254 C ARG A 274 15.131 26.498 -44.339 1.00 27.83 C ATOM 2255 O ARG A 274 14.448 26.754 -45.372 1.00 28.58 O ATOM 2256 CB ARG A 274 16.942 28.034 -43.527 1.00 26.93 C ATOM 2257 CG ARG A 274 18.333 28.585 -43.827 1.00 28.02 C ATOM 2258 CD ARG A 274 18.453 30.059 -43.389 1.00 25.81 C ATOM 2259 NE ARG A 274 19.764 30.441 -42.871 1.00 26.04 N ATOM 2260 CZ ARG A 274 20.044 31.606 -42.296 1.00 29.06 C ATOM 2261 NH1 ARG A 274 21.251 31.836 -41.855 1.00 31.11 N ATOM 2262 NH2 ARG A 274 19.129 32.546 -42.133 1.00 28.76 N ATOM 0 H ARG A 274 16.983 27.393 -46.040 1.00 28.25 H new ATOM 0 HA ARG A 274 17.020 26.031 -43.694 1.00 27.65 H new ATOM 0 HB2 ARG A 274 16.281 28.698 -43.779 1.00 26.93 H new ATOM 0 HB3 ARG A 274 16.858 27.900 -42.570 1.00 26.93 H new ATOM 0 HG2 ARG A 274 19.001 28.053 -43.367 1.00 28.02 H new ATOM 0 HG3 ARG A 274 18.516 28.511 -44.777 1.00 28.02 H new ATOM 0 HD2 ARG A 274 18.241 30.626 -44.147 1.00 25.81 H new ATOM 0 HD3 ARG A 274 17.786 30.236 -42.707 1.00 25.81 H new ATOM 0 HE ARG A 274 20.402 29.869 -42.943 1.00 26.04 H new ATOM 0 HH11 ARG A 274 21.861 31.235 -41.937 1.00 31.11 H new ATOM 0 HH12 ARG A 274 21.436 32.589 -41.482 1.00 31.11 H new ATOM 0 HH21 ARG A 274 18.323 32.413 -42.403 1.00 28.76 H new ATOM 0 HH22 ARG A 274 19.339 33.290 -41.757 1.00 28.76 H new ATOM 2263 N THR A 275 14.630 25.993 -43.259 1.00 27.13 N ATOM 2264 CA THR A 275 13.286 25.599 -43.213 1.00 28.49 C ATOM 2265 C THR A 275 12.508 26.646 -42.418 1.00 27.12 C ATOM 2266 O THR A 275 12.739 26.773 -41.191 1.00 27.78 O ATOM 2267 CB THR A 275 13.218 24.255 -42.528 1.00 28.37 C ATOM 2268 OG1 THR A 275 14.244 23.439 -43.087 1.00 33.74 O ATOM 2269 CG2 THR A 275 11.838 23.589 -42.702 1.00 29.33 C ATOM 0 H THR A 275 15.069 25.871 -42.529 1.00 27.13 H new ATOM 0 HA THR A 275 12.904 25.527 -44.102 1.00 28.49 H new ATOM 0 HB THR A 275 13.347 24.369 -41.573 1.00 28.37 H new ATOM 0 HG1 THR A 275 14.975 23.610 -42.710 1.00 33.74 H new ATOM 0 HG21 THR A 275 11.833 22.731 -42.250 1.00 29.33 H new ATOM 0 HG22 THR A 275 11.153 24.159 -42.320 1.00 29.33 H new ATOM 0 HG23 THR A 275 11.659 23.457 -43.646 1.00 29.33 H new ATOM 2270 N PRO A 276 11.543 27.329 -43.075 1.00 25.92 N ATOM 2271 CA PRO A 276 10.705 28.307 -42.366 1.00 25.22 C ATOM 2272 C PRO A 276 10.233 27.894 -40.969 1.00 25.05 C ATOM 2273 O PRO A 276 10.074 26.733 -40.625 1.00 23.02 O ATOM 2274 CB PRO A 276 9.522 28.496 -43.330 1.00 24.27 C ATOM 2275 CG PRO A 276 10.182 28.476 -44.645 1.00 24.98 C ATOM 2276 CD PRO A 276 11.118 27.239 -44.483 1.00 25.19 C ATOM 0 HA PRO A 276 11.209 29.113 -42.171 1.00 25.22 H new ATOM 0 HB2 PRO A 276 8.867 27.786 -43.243 1.00 24.27 H new ATOM 0 HB3 PRO A 276 9.056 29.332 -43.172 1.00 24.27 H new ATOM 0 HG2 PRO A 276 9.550 28.366 -45.372 1.00 24.98 H new ATOM 0 HG3 PRO A 276 10.677 29.291 -44.820 1.00 24.98 H new ATOM 0 HD2 PRO A 276 10.651 26.409 -44.665 1.00 25.19 H new ATOM 0 HD3 PRO A 276 11.874 27.278 -45.090 1.00 25.19 H new ATOM 2277 N ARG A 277 10.038 28.888 -40.139 1.00 27.14 N ATOM 2278 CA ARG A 277 9.449 28.616 -38.878 1.00 28.07 C ATOM 2279 C ARG A 277 7.991 29.133 -38.835 1.00 29.47 C ATOM 2280 O ARG A 277 7.501 29.834 -39.771 1.00 30.39 O ATOM 2281 CB ARG A 277 10.372 29.231 -37.842 1.00 27.76 C ATOM 2282 CG ARG A 277 11.526 28.348 -37.679 1.00 29.52 C ATOM 2283 CD ARG A 277 12.496 28.854 -36.671 1.00 33.96 C ATOM 2284 NE ARG A 277 13.775 28.123 -36.695 1.00 36.36 N ATOM 2285 CZ ARG A 277 14.952 28.672 -36.369 1.00 39.83 C ATOM 2286 NH1 ARG A 277 16.069 27.940 -36.400 1.00 42.57 N ATOM 2287 NH2 ARG A 277 15.019 29.968 -36.028 1.00 37.74 N ATOM 0 H ARG A 277 10.238 29.711 -40.290 1.00 27.14 H new ATOM 0 HA ARG A 277 9.366 27.667 -38.696 1.00 28.07 H new ATOM 0 HB2 ARG A 277 10.658 30.114 -38.125 1.00 27.76 H new ATOM 0 HB3 ARG A 277 9.908 29.341 -36.997 1.00 27.76 H new ATOM 0 HG2 ARG A 277 11.220 27.467 -37.414 1.00 29.52 H new ATOM 0 HG3 ARG A 277 11.975 28.247 -38.533 1.00 29.52 H new ATOM 0 HD2 ARG A 277 12.663 29.796 -36.833 1.00 33.96 H new ATOM 0 HD3 ARG A 277 12.104 28.783 -35.787 1.00 33.96 H new ATOM 0 HE ARG A 277 13.765 27.296 -36.932 1.00 36.36 H new ATOM 0 HH11 ARG A 277 16.034 27.112 -36.630 1.00 42.57 H new ATOM 0 HH12 ARG A 277 16.823 28.297 -36.190 1.00 42.57 H new ATOM 0 HH21 ARG A 277 14.305 30.448 -36.019 1.00 37.74 H new ATOM 0 HH22 ARG A 277 15.776 30.319 -35.819 1.00 37.74 H new ATOM 2288 N PRO A 278 7.276 28.831 -37.750 1.00 29.69 N ATOM 2289 CA PRO A 278 5.910 29.300 -37.653 1.00 30.04 C ATOM 2290 C PRO A 278 6.004 30.834 -37.548 1.00 31.29 C ATOM 2291 O PRO A 278 6.929 31.324 -36.870 1.00 30.78 O ATOM 2292 CB PRO A 278 5.465 28.748 -36.310 1.00 30.01 C ATOM 2293 CG PRO A 278 6.458 27.712 -35.949 1.00 30.46 C ATOM 2294 CD PRO A 278 7.739 28.168 -36.525 1.00 29.68 C ATOM 0 HA PRO A 278 5.324 29.046 -38.383 1.00 30.04 H new ATOM 0 HB2 PRO A 278 5.434 29.448 -35.639 1.00 30.01 H new ATOM 0 HB3 PRO A 278 4.573 28.370 -36.368 1.00 30.01 H new ATOM 0 HG2 PRO A 278 6.524 27.613 -34.986 1.00 30.46 H new ATOM 0 HG3 PRO A 278 6.204 26.847 -36.306 1.00 30.46 H new ATOM 0 HD2 PRO A 278 8.211 28.776 -35.935 1.00 29.68 H new ATOM 0 HD3 PRO A 278 8.340 27.430 -36.712 1.00 29.68 H new ATOM 2295 N ALA A 279 5.075 31.589 -38.154 1.00 31.57 N ATOM 2296 CA ALA A 279 5.271 33.073 -38.344 1.00 31.07 C ATOM 2297 C ALA A 279 4.943 33.807 -37.051 1.00 30.53 C ATOM 2298 O ALA A 279 4.264 33.189 -36.228 1.00 30.73 O ATOM 2299 CB ALA A 279 4.371 33.588 -39.477 1.00 32.07 C ATOM 0 H ALA A 279 4.332 31.284 -38.463 1.00 31.57 H new ATOM 0 HA ALA A 279 6.197 33.238 -38.580 1.00 31.07 H new ATOM 0 HB1 ALA A 279 4.506 34.542 -39.589 1.00 32.07 H new ATOM 0 HB2 ALA A 279 4.596 33.131 -40.302 1.00 32.07 H new ATOM 0 HB3 ALA A 279 3.442 33.417 -39.256 1.00 32.07 H new ATOM 2300 N PRO A 280 5.441 35.071 -36.851 1.00 28.76 N ATOM 2301 CA PRO A 280 5.214 35.809 -35.604 1.00 28.36 C ATOM 2302 C PRO A 280 3.819 36.376 -35.617 1.00 29.58 C ATOM 2303 O PRO A 280 3.104 36.170 -36.602 1.00 30.51 O ATOM 2304 CB PRO A 280 6.235 36.937 -35.667 1.00 27.01 C ATOM 2305 CG PRO A 280 6.466 37.143 -37.053 1.00 27.17 C ATOM 2306 CD PRO A 280 6.289 35.844 -37.770 1.00 28.33 C ATOM 0 HA PRO A 280 5.304 35.265 -34.806 1.00 28.36 H new ATOM 0 HB2 PRO A 280 5.897 37.741 -35.243 1.00 27.01 H new ATOM 0 HB3 PRO A 280 7.054 36.696 -35.206 1.00 27.01 H new ATOM 0 HG2 PRO A 280 5.849 37.805 -37.401 1.00 27.17 H new ATOM 0 HG3 PRO A 280 7.362 37.486 -37.197 1.00 27.17 H new ATOM 0 HD2 PRO A 280 5.865 35.966 -38.634 1.00 28.33 H new ATOM 0 HD3 PRO A 280 7.138 35.404 -37.931 1.00 28.33 H new ATOM 2307 N THR A 281 3.440 37.127 -34.587 1.00 29.73 N ATOM 2308 CA THR A 281 2.086 37.637 -34.489 1.00 30.68 C ATOM 2309 C THR A 281 2.055 39.121 -34.232 1.00 31.53 C ATOM 2310 O THR A 281 2.838 39.631 -33.459 1.00 32.68 O ATOM 2311 CB THR A 281 1.429 36.897 -33.427 1.00 30.37 C ATOM 2312 OG1 THR A 281 0.863 35.765 -34.067 1.00 35.25 O ATOM 2313 CG2 THR A 281 0.308 37.650 -32.790 1.00 30.09 C ATOM 0 H THR A 281 3.956 37.350 -33.936 1.00 29.73 H new ATOM 0 HA THR A 281 1.621 37.512 -35.331 1.00 30.68 H new ATOM 0 HB THR A 281 2.072 36.698 -32.729 1.00 30.37 H new ATOM 0 HG1 THR A 281 0.466 35.291 -33.499 1.00 35.25 H new ATOM 0 HG21 THR A 281 -0.091 37.108 -32.091 1.00 30.09 H new ATOM 0 HG22 THR A 281 0.648 38.473 -32.406 1.00 30.09 H new ATOM 0 HG23 THR A 281 -0.363 37.859 -33.459 1.00 30.09 H new ATOM 2314 N LEU A 282 1.164 39.858 -34.870 1.00 32.44 N ATOM 2315 CA LEU A 282 1.192 41.299 -34.620 1.00 31.90 C ATOM 2316 C LEU A 282 0.239 41.678 -33.548 1.00 34.51 C ATOM 2317 O LEU A 282 -0.792 41.058 -33.365 1.00 34.84 O ATOM 2318 CB LEU A 282 0.850 42.065 -35.869 1.00 31.09 C ATOM 2319 CG LEU A 282 1.309 43.515 -35.977 1.00 27.49 C ATOM 2320 CD1 LEU A 282 2.861 43.690 -35.991 1.00 17.00 C ATOM 2321 CD2 LEU A 282 0.691 44.130 -37.199 1.00 26.22 C ATOM 0 H LEU A 282 0.567 39.574 -35.420 1.00 32.44 H new ATOM 0 HA LEU A 282 2.093 41.522 -34.338 1.00 31.90 H new ATOM 0 HB2 LEU A 282 1.220 41.581 -36.624 1.00 31.09 H new ATOM 0 HB3 LEU A 282 -0.115 42.052 -35.969 1.00 31.09 H new ATOM 0 HG LEU A 282 1.010 43.972 -35.176 1.00 27.49 H new ATOM 0 HD11 LEU A 282 3.080 44.632 -36.061 1.00 17.00 H new ATOM 0 HD12 LEU A 282 3.235 43.332 -35.171 1.00 17.00 H new ATOM 0 HD13 LEU A 282 3.234 43.215 -36.750 1.00 17.00 H new ATOM 0 HD21 LEU A 282 0.977 45.054 -37.277 1.00 26.22 H new ATOM 0 HD22 LEU A 282 0.971 43.638 -37.986 1.00 26.22 H new ATOM 0 HD23 LEU A 282 -0.276 44.097 -37.125 1.00 26.22 H new ATOM 2322 N GLN A 283 0.563 42.706 -32.803 1.00 36.99 N ATOM 2323 CA GLN A 283 -0.335 43.104 -31.747 1.00 39.59 C ATOM 2324 C GLN A 283 -0.471 44.610 -31.741 1.00 39.60 C ATOM 2325 O GLN A 283 0.532 45.285 -31.517 1.00 40.25 O ATOM 2326 CB GLN A 283 0.292 42.702 -30.456 1.00 40.17 C ATOM 2327 CG GLN A 283 -0.602 42.935 -29.335 1.00 45.67 C ATOM 2328 CD GLN A 283 -0.915 41.645 -28.646 1.00 52.04 C ATOM 2329 OE1 GLN A 283 -1.466 40.710 -29.271 1.00 53.73 O ATOM 2330 NE2 GLN A 283 -0.582 41.569 -27.340 1.00 52.28 N ATOM 0 H GLN A 283 1.277 43.178 -32.886 1.00 36.99 H new ATOM 0 HA GLN A 283 -1.205 42.693 -31.873 1.00 39.59 H new ATOM 0 HB2 GLN A 283 0.532 41.763 -30.490 1.00 40.17 H new ATOM 0 HB3 GLN A 283 1.114 43.200 -30.325 1.00 40.17 H new ATOM 0 HG2 GLN A 283 -0.192 43.552 -28.709 1.00 45.67 H new ATOM 0 HG3 GLN A 283 -1.421 43.350 -29.647 1.00 45.67 H new ATOM 0 HE21 GLN A 283 -0.205 42.238 -26.953 1.00 52.28 H new ATOM 0 HE22 GLN A 283 -0.747 40.852 -26.895 1.00 52.28 H new ATOM 2331 N LEU A 284 -1.663 45.150 -31.988 1.00 39.35 N ATOM 2332 CA LEU A 284 -1.827 46.600 -31.885 1.00 39.58 C ATOM 2333 C LEU A 284 -2.487 47.038 -30.569 1.00 40.41 C ATOM 2334 O LEU A 284 -3.283 46.314 -30.023 1.00 40.14 O ATOM 2335 CB LEU A 284 -2.553 47.158 -33.087 1.00 39.68 C ATOM 2336 CG LEU A 284 -1.888 46.679 -34.366 1.00 38.45 C ATOM 2337 CD1 LEU A 284 -2.775 47.002 -35.537 1.00 37.28 C ATOM 2338 CD2 LEU A 284 -0.511 47.292 -34.530 1.00 35.45 C ATOM 0 H LEU A 284 -2.369 44.712 -32.210 1.00 39.35 H new ATOM 0 HA LEU A 284 -0.933 46.977 -31.875 1.00 39.58 H new ATOM 0 HB2 LEU A 284 -3.481 46.878 -33.072 1.00 39.68 H new ATOM 0 HB3 LEU A 284 -2.549 48.127 -33.055 1.00 39.68 H new ATOM 0 HG LEU A 284 -1.765 45.718 -34.320 1.00 38.45 H new ATOM 0 HD11 LEU A 284 -2.354 46.698 -36.356 1.00 37.28 H new ATOM 0 HD12 LEU A 284 -3.630 46.556 -35.428 1.00 37.28 H new ATOM 0 HD13 LEU A 284 -2.915 47.961 -35.583 1.00 37.28 H new ATOM 0 HD21 LEU A 284 -0.109 46.971 -35.352 1.00 35.45 H new ATOM 0 HD22 LEU A 284 -0.589 48.258 -34.565 1.00 35.45 H new ATOM 0 HD23 LEU A 284 0.047 47.040 -33.778 1.00 35.45 H new ATOM 2339 N ASN A 285 -2.099 48.206 -30.061 1.00 41.63 N ATOM 2340 CA ASN A 285 -2.675 48.795 -28.856 1.00 42.71 C ATOM 2341 C ASN A 285 -4.193 49.023 -28.991 1.00 43.50 C ATOM 2342 O ASN A 285 -4.609 49.874 -29.762 1.00 42.76 O ATOM 2343 CB ASN A 285 -1.949 50.101 -28.586 1.00 42.29 C ATOM 2344 CG ASN A 285 -2.634 50.956 -27.560 1.00 41.04 C ATOM 2345 OD1 ASN A 285 -3.645 50.420 -26.903 1.00 40.67 O flip ATOM 2346 ND2 ASN A 285 -2.230 52.102 -27.355 1.00 40.59 N flip ATOM 0 H ASN A 285 -1.481 48.687 -30.415 1.00 41.63 H new ATOM 0 HA ASN A 285 -2.561 48.183 -28.112 1.00 42.71 H new ATOM 0 HB2 ASN A 285 -1.047 49.907 -28.287 1.00 42.29 H new ATOM 0 HB3 ASN A 285 -1.872 50.599 -29.415 1.00 42.29 H new ATOM 0 HD21 ASN A 285 -1.567 52.411 -27.807 1.00 40.59 H new ATOM 0 HD22 ASN A 285 -2.611 52.592 -26.760 1.00 40.59 H new ATOM 2347 N PRO A 286 -5.013 48.290 -28.206 1.00 44.75 N ATOM 2348 CA PRO A 286 -6.414 48.106 -28.552 1.00 46.04 C ATOM 2349 C PRO A 286 -7.155 49.334 -28.158 1.00 47.25 C ATOM 2350 O PRO A 286 -8.300 49.517 -28.570 1.00 47.43 O ATOM 2351 CB PRO A 286 -6.855 46.993 -27.629 1.00 45.28 C ATOM 2352 CG PRO A 286 -6.095 47.263 -26.410 1.00 46.13 C ATOM 2353 CD PRO A 286 -4.725 47.698 -26.896 1.00 45.31 C ATOM 0 HA PRO A 286 -6.560 47.924 -29.493 1.00 46.04 H new ATOM 0 HB2 PRO A 286 -7.811 47.016 -27.469 1.00 45.28 H new ATOM 0 HB3 PRO A 286 -6.649 46.119 -27.995 1.00 45.28 H new ATOM 0 HG2 PRO A 286 -6.517 47.956 -25.879 1.00 46.13 H new ATOM 0 HG3 PRO A 286 -6.036 46.473 -25.850 1.00 46.13 H new ATOM 0 HD2 PRO A 286 -4.317 48.340 -26.294 1.00 45.31 H new ATOM 0 HD3 PRO A 286 -4.114 46.948 -26.967 1.00 45.31 H new ATOM 2354 N ASP A 287 -6.504 50.171 -27.366 1.00 48.52 N ATOM 2355 CA ASP A 287 -7.212 51.305 -26.873 1.00 51.90 C ATOM 2356 C ASP A 287 -7.121 52.469 -27.845 1.00 52.41 C ATOM 2357 O ASP A 287 -8.104 53.208 -27.972 1.00 54.25 O ATOM 2358 CB ASP A 287 -6.843 51.650 -25.416 1.00 52.27 C ATOM 2359 CG ASP A 287 -7.230 50.497 -24.409 1.00 57.28 C ATOM 2360 OD1 ASP A 287 -6.347 50.138 -23.567 1.00 60.22 O ATOM 2361 OD2 ASP A 287 -8.383 49.927 -24.461 1.00 57.43 O ATOM 0 H ASP A 287 -5.684 50.096 -27.117 1.00 48.52 H new ATOM 0 HA ASP A 287 -8.153 51.076 -26.825 1.00 51.90 H new ATOM 0 HB2 ASP A 287 -5.890 51.821 -25.358 1.00 52.27 H new ATOM 0 HB3 ASP A 287 -7.294 52.468 -25.156 1.00 52.27 H new ATOM 2362 N LYS A 288 -5.992 52.590 -28.550 1.00 52.48 N ATOM 2363 CA LYS A 288 -5.736 53.698 -29.483 1.00 52.39 C ATOM 2364 C LYS A 288 -6.169 53.301 -30.887 1.00 52.82 C ATOM 2365 O LYS A 288 -5.819 52.218 -31.395 1.00 52.37 O ATOM 2366 CB LYS A 288 -4.253 54.125 -29.467 1.00 52.48 C ATOM 2367 CG LYS A 288 -3.891 55.292 -30.380 1.00 51.44 C ATOM 2368 CD LYS A 288 -2.384 55.558 -30.356 1.00 52.55 C ATOM 2369 CE LYS A 288 -2.064 56.473 -29.176 1.00 53.74 C ATOM 2370 NZ LYS A 288 -0.625 56.525 -28.784 1.00 52.24 N ATOM 0 H LYS A 288 -5.345 52.025 -28.500 1.00 52.48 H new ATOM 0 HA LYS A 288 -6.257 54.463 -29.195 1.00 52.39 H new ATOM 0 HB2 LYS A 288 -4.011 54.360 -28.558 1.00 52.48 H new ATOM 0 HB3 LYS A 288 -3.711 53.360 -29.716 1.00 52.48 H new ATOM 0 HG2 LYS A 288 -4.174 55.098 -31.287 1.00 51.44 H new ATOM 0 HG3 LYS A 288 -4.368 56.088 -30.098 1.00 51.44 H new ATOM 0 HD2 LYS A 288 -1.897 54.723 -30.275 1.00 52.55 H new ATOM 0 HD3 LYS A 288 -2.103 55.971 -31.187 1.00 52.55 H new ATOM 0 HE2 LYS A 288 -2.358 57.372 -29.393 1.00 53.74 H new ATOM 0 HE3 LYS A 288 -2.583 56.182 -28.410 1.00 53.74 H new ATOM 0 HZ1 LYS A 288 -0.554 56.437 -27.901 1.00 52.24 H new ATOM 0 HZ2 LYS A 288 -0.184 55.864 -29.184 1.00 52.24 H new ATOM 0 HZ3 LYS A 288 -0.277 57.306 -29.033 1.00 52.24 H new ATOM 2371 N HIS A 289 -6.923 54.193 -31.515 1.00 53.01 N ATOM 2372 CA HIS A 289 -7.467 53.907 -32.825 1.00 53.54 C ATOM 2373 C HIS A 289 -7.074 54.846 -33.932 1.00 52.69 C ATOM 2374 O HIS A 289 -7.216 54.505 -35.141 1.00 53.16 O ATOM 2375 CB HIS A 289 -8.960 53.800 -32.714 1.00 54.65 C ATOM 2376 CG HIS A 289 -9.370 52.610 -31.913 1.00 60.46 C ATOM 2377 ND1 HIS A 289 -9.200 51.316 -32.375 1.00 62.26 N ATOM 2378 CD2 HIS A 289 -9.851 52.505 -30.647 1.00 65.26 C ATOM 2379 CE1 HIS A 289 -9.594 50.467 -31.441 1.00 64.65 C ATOM 2380 NE2 HIS A 289 -9.991 51.160 -30.383 1.00 67.36 N ATOM 0 H HIS A 289 -7.129 54.966 -31.198 1.00 53.01 H new ATOM 0 HA HIS A 289 -7.067 53.066 -33.097 1.00 53.54 H new ATOM 0 HB2 HIS A 289 -9.313 54.604 -32.302 1.00 54.65 H new ATOM 0 HB3 HIS A 289 -9.347 53.742 -33.601 1.00 54.65 H new ATOM 0 HD2 HIS A 289 -10.048 53.207 -30.069 1.00 65.26 H new ATOM 0 HE1 HIS A 289 -9.593 49.540 -31.514 1.00 64.65 H new ATOM 0 HE2 HIS A 289 -10.288 50.824 -29.649 1.00 67.36 H new ATOM 2381 N ASP A 290 -6.578 56.018 -33.539 1.00 50.74 N ATOM 2382 CA ASP A 290 -6.247 56.977 -34.524 1.00 49.60 C ATOM 2383 C ASP A 290 -4.846 56.645 -34.891 1.00 47.30 C ATOM 2384 O ASP A 290 -3.927 56.961 -34.140 1.00 46.47 O ATOM 2385 CB ASP A 290 -6.360 58.417 -34.046 1.00 51.02 C ATOM 2386 CG ASP A 290 -5.969 59.408 -35.161 1.00 55.89 C ATOM 2387 OD1 ASP A 290 -5.444 58.926 -36.199 1.00 61.06 O ATOM 2388 OD2 ASP A 290 -6.161 60.650 -35.026 1.00 63.17 O ATOM 0 H ASP A 290 -6.436 56.253 -32.724 1.00 50.74 H new ATOM 0 HA ASP A 290 -6.866 56.933 -35.269 1.00 49.60 H new ATOM 0 HB2 ASP A 290 -7.269 58.594 -33.757 1.00 51.02 H new ATOM 0 HB3 ASP A 290 -5.786 58.551 -33.275 1.00 51.02 H new ATOM 2389 N ILE A 291 -4.711 56.015 -36.064 1.00 45.23 N ATOM 2390 CA ILE A 291 -3.447 55.472 -36.495 1.00 42.64 C ATOM 2391 C ILE A 291 -2.427 56.510 -36.927 1.00 43.13 C ATOM 2392 O ILE A 291 -1.235 56.197 -37.006 1.00 42.61 O ATOM 2393 CB ILE A 291 -3.561 54.372 -37.568 1.00 41.49 C ATOM 2394 CG1 ILE A 291 -4.099 54.891 -38.892 1.00 37.20 C ATOM 2395 CG2 ILE A 291 -4.291 53.157 -37.031 1.00 41.40 C ATOM 2396 CD1 ILE A 291 -3.285 54.370 -40.079 1.00 27.51 C ATOM 0 H ILE A 291 -5.355 55.897 -36.621 1.00 45.23 H new ATOM 0 HA ILE A 291 -3.115 55.059 -35.683 1.00 42.64 H new ATOM 0 HB ILE A 291 -2.663 54.073 -37.780 1.00 41.49 H new ATOM 0 HG12 ILE A 291 -5.026 54.622 -38.992 1.00 37.20 H new ATOM 0 HG13 ILE A 291 -4.083 55.861 -38.890 1.00 37.20 H new ATOM 0 HG21 ILE A 291 -4.349 52.481 -37.725 1.00 41.40 H new ATOM 0 HG22 ILE A 291 -3.807 52.798 -36.271 1.00 41.40 H new ATOM 0 HG23 ILE A 291 -5.185 53.413 -36.754 1.00 41.40 H new ATOM 0 HD11 ILE A 291 -3.655 54.720 -40.904 1.00 27.51 H new ATOM 0 HD12 ILE A 291 -2.363 54.658 -39.991 1.00 27.51 H new ATOM 0 HD13 ILE A 291 -3.320 53.401 -40.095 1.00 27.51 H new ATOM 2397 N PHE A 292 -2.854 57.743 -37.215 1.00 44.02 N ATOM 2398 CA PHE A 292 -1.848 58.772 -37.496 1.00 44.07 C ATOM 2399 C PHE A 292 -1.107 59.213 -36.206 1.00 45.10 C ATOM 2400 O PHE A 292 -0.081 59.908 -36.282 1.00 46.82 O ATOM 2401 CB PHE A 292 -2.394 59.978 -38.273 1.00 44.11 C ATOM 2402 CG PHE A 292 -2.880 59.669 -39.692 1.00 43.30 C ATOM 2403 CD1 PHE A 292 -2.179 58.874 -40.540 1.00 39.45 C ATOM 2404 CD2 PHE A 292 -4.060 60.229 -40.165 1.00 43.35 C ATOM 2405 CE1 PHE A 292 -2.645 58.634 -41.851 1.00 43.20 C ATOM 2406 CE2 PHE A 292 -4.536 59.983 -41.478 1.00 42.79 C ATOM 2407 CZ PHE A 292 -3.841 59.188 -42.316 1.00 41.31 C ATOM 0 H PHE A 292 -3.675 57.996 -37.252 1.00 44.02 H new ATOM 0 HA PHE A 292 -1.203 58.352 -38.086 1.00 44.07 H new ATOM 0 HB2 PHE A 292 -3.129 60.363 -37.771 1.00 44.11 H new ATOM 0 HB3 PHE A 292 -1.700 60.654 -38.323 1.00 44.11 H new ATOM 0 HD1 PHE A 292 -1.384 58.484 -40.255 1.00 39.45 H new ATOM 0 HD2 PHE A 292 -4.553 60.782 -39.603 1.00 43.35 H new ATOM 0 HE1 PHE A 292 -2.144 58.094 -42.419 1.00 43.20 H new ATOM 0 HE2 PHE A 292 -5.331 60.372 -41.762 1.00 42.79 H new ATOM 0 HZ PHE A 292 -4.148 59.014 -43.176 1.00 41.31 H new ATOM 2408 N ASP A 293 -1.593 58.822 -35.034 1.00 44.48 N ATOM 2409 CA ASP A 293 -0.980 59.313 -33.833 1.00 45.71 C ATOM 2410 C ASP A 293 -0.491 58.120 -33.075 1.00 45.71 C ATOM 2411 O ASP A 293 -0.531 58.078 -31.834 1.00 45.85 O ATOM 2412 CB ASP A 293 -1.990 60.047 -32.966 1.00 46.24 C ATOM 2413 CG ASP A 293 -2.459 61.372 -33.558 1.00 50.33 C ATOM 2414 OD1 ASP A 293 -3.652 61.665 -33.213 1.00 54.43 O ATOM 2415 OD2 ASP A 293 -1.712 62.092 -34.343 1.00 50.47 O ATOM 0 H ASP A 293 -2.258 58.288 -34.923 1.00 44.48 H new ATOM 0 HA ASP A 293 -0.264 59.928 -34.058 1.00 45.71 H new ATOM 0 HB2 ASP A 293 -2.760 59.474 -32.825 1.00 46.24 H new ATOM 0 HB3 ASP A 293 -1.597 60.212 -32.095 1.00 46.24 H new ATOM 2416 N PHE A 294 -0.112 57.103 -33.837 1.00 45.96 N ATOM 2417 CA PHE A 294 0.464 55.896 -33.261 1.00 44.92 C ATOM 2418 C PHE A 294 1.925 56.130 -32.962 1.00 44.99 C ATOM 2419 O PHE A 294 2.624 56.935 -33.655 1.00 43.87 O ATOM 2420 CB PHE A 294 0.307 54.721 -34.183 1.00 43.82 C ATOM 2421 CG PHE A 294 -0.750 53.775 -33.752 1.00 44.54 C ATOM 2422 CD1 PHE A 294 -0.505 52.401 -33.727 1.00 43.65 C ATOM 2423 CD2 PHE A 294 -2.007 54.242 -33.369 1.00 43.72 C ATOM 2424 CE1 PHE A 294 -1.508 51.507 -33.346 1.00 43.54 C ATOM 2425 CE2 PHE A 294 -3.001 53.353 -32.995 1.00 42.22 C ATOM 2426 CZ PHE A 294 -2.735 51.982 -32.976 1.00 41.39 C ATOM 0 H PHE A 294 -0.180 57.092 -34.694 1.00 45.96 H new ATOM 0 HA PHE A 294 -0.010 55.692 -32.439 1.00 44.92 H new ATOM 0 HB2 PHE A 294 0.101 55.043 -35.075 1.00 43.82 H new ATOM 0 HB3 PHE A 294 1.152 54.248 -34.241 1.00 43.82 H new ATOM 0 HD1 PHE A 294 0.334 52.078 -33.966 1.00 43.65 H new ATOM 0 HD2 PHE A 294 -2.179 55.156 -33.365 1.00 43.72 H new ATOM 0 HE1 PHE A 294 -1.342 50.592 -33.344 1.00 43.54 H new ATOM 0 HE2 PHE A 294 -3.843 53.668 -32.757 1.00 42.22 H new ATOM 0 HZ PHE A 294 -3.398 51.387 -32.709 1.00 41.39 H new ATOM 2427 N ASP A 295 2.356 55.451 -31.899 1.00 44.76 N ATOM 2428 CA ASP A 295 3.743 55.446 -31.529 1.00 45.71 C ATOM 2429 C ASP A 295 4.322 54.036 -31.514 1.00 44.36 C ATOM 2430 O ASP A 295 3.553 53.097 -31.390 1.00 44.09 O ATOM 2431 CB ASP A 295 3.984 56.150 -30.189 1.00 46.31 C ATOM 2432 CG ASP A 295 5.447 56.651 -30.071 1.00 51.72 C ATOM 2433 OD1 ASP A 295 6.034 56.582 -28.950 1.00 57.11 O ATOM 2434 OD2 ASP A 295 6.034 57.064 -31.132 1.00 54.92 O ATOM 0 H ASP A 295 1.847 54.988 -31.384 1.00 44.76 H new ATOM 0 HA ASP A 295 4.211 55.950 -32.213 1.00 45.71 H new ATOM 0 HB2 ASP A 295 3.375 56.900 -30.101 1.00 46.31 H new ATOM 0 HB3 ASP A 295 3.789 55.539 -29.461 1.00 46.31 H new ATOM 2435 N MET A 296 5.666 53.920 -31.651 1.00 43.90 N ATOM 2436 CA MET A 296 6.431 52.656 -31.536 1.00 42.68 C ATOM 2437 C MET A 296 5.854 51.704 -30.517 1.00 42.83 C ATOM 2438 O MET A 296 5.701 50.493 -30.780 1.00 43.98 O ATOM 2439 CB MET A 296 7.878 52.913 -31.186 1.00 41.41 C ATOM 2440 CG MET A 296 8.611 53.848 -32.098 1.00 41.18 C ATOM 2441 SD MET A 296 9.167 53.208 -33.693 1.00 42.99 S ATOM 2442 CE MET A 296 10.566 52.139 -33.293 1.00 43.27 C ATOM 0 H MET A 296 6.168 54.598 -31.818 1.00 43.90 H new ATOM 0 HA MET A 296 6.368 52.242 -32.411 1.00 42.68 H new ATOM 0 HB2 MET A 296 7.917 53.270 -30.285 1.00 41.41 H new ATOM 0 HB3 MET A 296 8.347 52.064 -31.176 1.00 41.41 H new ATOM 0 HG2 MET A 296 8.036 54.611 -32.267 1.00 41.18 H new ATOM 0 HG3 MET A 296 9.389 54.179 -31.622 1.00 41.18 H new ATOM 0 HE1 MET A 296 10.533 51.342 -33.845 1.00 43.27 H new ATOM 0 HE2 MET A 296 11.395 52.614 -33.461 1.00 43.27 H new ATOM 0 HE3 MET A 296 10.523 51.886 -32.358 1.00 43.27 H new ATOM 2443 N LYS A 297 5.494 52.217 -29.361 1.00 43.50 N ATOM 2444 CA LYS A 297 5.048 51.309 -28.311 1.00 45.89 C ATOM 2445 C LYS A 297 3.659 50.693 -28.575 1.00 45.15 C ATOM 2446 O LYS A 297 3.266 49.664 -27.969 1.00 46.08 O ATOM 2447 CB LYS A 297 5.151 51.985 -26.960 1.00 45.15 C ATOM 2448 CG LYS A 297 4.949 53.499 -27.025 1.00 48.95 C ATOM 2449 CD LYS A 297 4.385 54.093 -25.634 1.00 50.13 C ATOM 2450 CE LYS A 297 2.815 53.906 -25.481 1.00 56.65 C ATOM 2451 NZ LYS A 297 1.963 54.374 -26.716 1.00 56.74 N ATOM 0 H LYS A 297 5.496 53.053 -29.161 1.00 43.50 H new ATOM 0 HA LYS A 297 5.648 50.547 -28.312 1.00 45.89 H new ATOM 0 HB2 LYS A 297 4.490 51.602 -26.362 1.00 45.15 H new ATOM 0 HB3 LYS A 297 6.022 51.797 -26.577 1.00 45.15 H new ATOM 0 HG2 LYS A 297 5.792 53.928 -27.241 1.00 48.95 H new ATOM 0 HG3 LYS A 297 4.330 53.712 -27.741 1.00 48.95 H new ATOM 0 HD2 LYS A 297 4.833 53.655 -24.894 1.00 50.13 H new ATOM 0 HD3 LYS A 297 4.602 55.037 -25.578 1.00 50.13 H new ATOM 0 HE2 LYS A 297 2.630 52.968 -25.315 1.00 56.65 H new ATOM 0 HE3 LYS A 297 2.520 54.396 -24.698 1.00 56.65 H new ATOM 0 HZ1 LYS A 297 1.305 54.905 -26.439 1.00 56.74 H new ATOM 0 HZ2 LYS A 297 2.484 54.819 -27.285 1.00 56.74 H new ATOM 0 HZ3 LYS A 297 1.617 53.663 -27.125 1.00 56.74 H new ATOM 2452 N ASP A 298 2.934 51.287 -29.517 1.00 44.08 N ATOM 2453 CA ASP A 298 1.588 50.837 -29.849 1.00 42.89 C ATOM 2454 C ASP A 298 1.525 49.643 -30.770 1.00 41.29 C ATOM 2455 O ASP A 298 0.426 49.198 -31.111 1.00 40.83 O ATOM 2456 CB ASP A 298 0.815 51.986 -30.527 1.00 43.43 C ATOM 2457 CG ASP A 298 0.600 53.166 -29.612 1.00 42.88 C ATOM 2458 OD1 ASP A 298 0.979 54.280 -30.005 1.00 39.59 O ATOM 2459 OD2 ASP A 298 0.037 52.964 -28.504 1.00 47.49 O ATOM 0 H ASP A 298 3.207 51.959 -29.979 1.00 44.08 H new ATOM 0 HA ASP A 298 1.197 50.567 -29.004 1.00 42.89 H new ATOM 0 HB2 ASP A 298 1.301 52.277 -31.314 1.00 43.43 H new ATOM 0 HB3 ASP A 298 -0.045 51.656 -30.831 1.00 43.43 H new ATOM 2460 N ILE A 299 2.683 49.174 -31.239 1.00 40.11 N ATOM 2461 CA ILE A 299 2.754 48.053 -32.189 1.00 38.52 C ATOM 2462 C ILE A 299 3.729 47.016 -31.665 1.00 39.38 C ATOM 2463 O ILE A 299 4.894 47.310 -31.513 1.00 40.54 O ATOM 2464 CB ILE A 299 3.265 48.504 -33.557 1.00 36.74 C ATOM 2465 CG1 ILE A 299 2.476 49.674 -34.055 1.00 34.34 C ATOM 2466 CG2 ILE A 299 3.173 47.401 -34.595 1.00 36.07 C ATOM 2467 CD1 ILE A 299 3.100 50.356 -35.277 1.00 29.07 C ATOM 0 H ILE A 299 3.450 49.494 -31.018 1.00 40.11 H new ATOM 0 HA ILE A 299 1.858 47.693 -32.282 1.00 38.52 H new ATOM 0 HB ILE A 299 4.196 48.746 -33.434 1.00 36.74 H new ATOM 0 HG12 ILE A 299 1.580 49.378 -34.281 1.00 34.34 H new ATOM 0 HG13 ILE A 299 2.389 50.324 -33.340 1.00 34.34 H new ATOM 0 HG21 ILE A 299 3.506 47.728 -35.445 1.00 36.07 H new ATOM 0 HG22 ILE A 299 3.706 46.642 -34.310 1.00 36.07 H new ATOM 0 HG23 ILE A 299 2.248 47.126 -34.695 1.00 36.07 H new ATOM 0 HD11 ILE A 299 2.544 51.103 -35.550 1.00 29.07 H new ATOM 0 HD12 ILE A 299 3.986 50.679 -35.050 1.00 29.07 H new ATOM 0 HD13 ILE A 299 3.165 49.719 -36.005 1.00 29.07 H new ATOM 2468 N LYS A 300 3.272 45.806 -31.443 1.00 39.78 N ATOM 2469 CA LYS A 300 4.117 44.756 -30.900 1.00 42.31 C ATOM 2470 C LYS A 300 4.282 43.545 -31.840 1.00 41.86 C ATOM 2471 O LYS A 300 3.302 43.066 -32.429 1.00 42.41 O ATOM 2472 CB LYS A 300 3.516 44.221 -29.605 1.00 42.35 C ATOM 2473 CG LYS A 300 3.467 45.234 -28.478 1.00 50.54 C ATOM 2474 CD LYS A 300 2.083 45.086 -27.640 1.00 58.68 C ATOM 2475 CE LYS A 300 0.848 45.897 -28.313 1.00 60.35 C ATOM 2476 NZ LYS A 300 -0.255 46.544 -27.441 1.00 58.53 N ATOM 0 H LYS A 300 2.462 45.563 -31.601 1.00 39.78 H new ATOM 0 HA LYS A 300 4.984 45.169 -30.766 1.00 42.31 H new ATOM 0 HB2 LYS A 300 2.616 43.907 -29.784 1.00 42.35 H new ATOM 0 HB3 LYS A 300 4.032 43.453 -29.314 1.00 42.35 H new ATOM 0 HG2 LYS A 300 4.225 45.105 -27.887 1.00 50.54 H new ATOM 0 HG3 LYS A 300 3.539 46.131 -28.839 1.00 50.54 H new ATOM 0 HD2 LYS A 300 1.849 44.147 -27.573 1.00 58.68 H new ATOM 0 HD3 LYS A 300 2.222 45.409 -26.736 1.00 58.68 H new ATOM 0 HE2 LYS A 300 1.234 46.605 -28.853 1.00 60.35 H new ATOM 0 HE3 LYS A 300 0.405 45.285 -28.922 1.00 60.35 H new ATOM 0 HZ1 LYS A 300 -1.029 46.528 -27.880 1.00 58.53 H new ATOM 0 HZ2 LYS A 300 -0.337 46.090 -26.680 1.00 58.53 H new ATOM 0 HZ3 LYS A 300 -0.035 47.387 -27.261 1.00 58.53 H new ATOM 2477 N LEU A 301 5.505 43.002 -31.940 1.00 40.78 N ATOM 2478 CA LEU A 301 5.707 41.692 -32.581 1.00 39.05 C ATOM 2479 C LEU A 301 5.733 40.521 -31.559 1.00 38.80 C ATOM 2480 O LEU A 301 6.376 40.595 -30.532 1.00 39.77 O ATOM 2481 CB LEU A 301 6.994 41.701 -33.403 1.00 38.33 C ATOM 2482 CG LEU A 301 7.025 40.708 -34.548 1.00 34.05 C ATOM 2483 CD1 LEU A 301 5.699 40.728 -35.264 1.00 29.57 C ATOM 2484 CD2 LEU A 301 8.136 41.125 -35.398 1.00 29.93 C ATOM 0 H LEU A 301 6.224 43.372 -31.646 1.00 40.78 H new ATOM 0 HA LEU A 301 4.947 41.542 -33.165 1.00 39.05 H new ATOM 0 HB2 LEU A 301 7.128 42.592 -33.761 1.00 38.33 H new ATOM 0 HB3 LEU A 301 7.741 41.518 -32.812 1.00 38.33 H new ATOM 0 HG LEU A 301 7.159 39.792 -34.258 1.00 34.05 H new ATOM 0 HD11 LEU A 301 5.717 40.093 -35.997 1.00 29.57 H new ATOM 0 HD12 LEU A 301 4.993 40.486 -34.645 1.00 29.57 H new ATOM 0 HD13 LEU A 301 5.532 41.618 -35.612 1.00 29.57 H new ATOM 0 HD21 LEU A 301 8.208 40.523 -36.155 1.00 29.93 H new ATOM 0 HD22 LEU A 301 7.979 42.028 -35.717 1.00 29.93 H new ATOM 0 HD23 LEU A 301 8.961 41.102 -34.888 1.00 29.93 H new ATOM 2485 N LEU A 302 5.045 39.445 -31.822 1.00 36.61 N ATOM 2486 CA LEU A 302 5.146 38.374 -30.905 1.00 35.86 C ATOM 2487 C LEU A 302 5.693 37.117 -31.595 1.00 34.87 C ATOM 2488 O LEU A 302 5.354 36.837 -32.762 1.00 33.97 O ATOM 2489 CB LEU A 302 3.773 38.122 -30.321 1.00 36.51 C ATOM 2490 CG LEU A 302 3.150 38.896 -29.149 1.00 38.74 C ATOM 2491 CD1 LEU A 302 3.291 40.395 -29.330 1.00 43.92 C ATOM 2492 CD2 LEU A 302 1.658 38.514 -29.068 1.00 35.61 C ATOM 0 H LEU A 302 4.533 39.322 -32.502 1.00 36.61 H new ATOM 0 HA LEU A 302 5.766 38.601 -30.195 1.00 35.86 H new ATOM 0 HB2 LEU A 302 3.150 38.213 -31.059 1.00 36.51 H new ATOM 0 HB3 LEU A 302 3.765 37.189 -30.056 1.00 36.51 H new ATOM 0 HG LEU A 302 3.613 38.662 -28.330 1.00 38.74 H new ATOM 0 HD11 LEU A 302 2.888 40.852 -28.575 1.00 43.92 H new ATOM 0 HD12 LEU A 302 4.231 40.628 -29.384 1.00 43.92 H new ATOM 0 HD13 LEU A 302 2.844 40.666 -30.147 1.00 43.92 H new ATOM 0 HD21 LEU A 302 1.241 38.991 -28.334 1.00 35.61 H new ATOM 0 HD22 LEU A 302 1.217 38.752 -29.899 1.00 35.61 H new ATOM 0 HD23 LEU A 302 1.576 37.559 -28.921 1.00 35.61 H new ATOM 2493 N ASN A 303 6.553 36.390 -30.882 1.00 33.18 N ATOM 2494 CA ASN A 303 7.046 35.060 -31.296 1.00 32.12 C ATOM 2495 C ASN A 303 7.804 35.052 -32.591 1.00 30.46 C ATOM 2496 O ASN A 303 7.585 34.196 -33.496 1.00 30.51 O ATOM 2497 CB ASN A 303 5.931 34.042 -31.339 1.00 32.23 C ATOM 2498 CG ASN A 303 5.044 34.163 -30.148 1.00 38.43 C ATOM 2499 OD1 ASN A 303 5.486 33.964 -29.014 1.00 41.05 O ATOM 2500 ND2 ASN A 303 3.785 34.531 -30.375 1.00 45.55 N ATOM 0 H ASN A 303 6.876 36.655 -30.130 1.00 33.18 H new ATOM 0 HA ASN A 303 7.683 34.812 -30.608 1.00 32.12 H new ATOM 0 HB2 ASN A 303 5.409 34.164 -32.148 1.00 32.23 H new ATOM 0 HB3 ASN A 303 6.307 33.149 -31.376 1.00 32.23 H new ATOM 0 HD21 ASN A 303 3.243 34.639 -29.716 1.00 45.55 H new ATOM 0 HD22 ASN A 303 3.513 34.660 -31.181 1.00 45.55 H new ATOM 2501 N TYR A 304 8.716 36.001 -32.686 1.00 28.83 N ATOM 2502 CA TYR A 304 9.511 36.040 -33.856 1.00 27.01 C ATOM 2503 C TYR A 304 10.791 35.368 -33.426 1.00 28.88 C ATOM 2504 O TYR A 304 11.422 35.811 -32.454 1.00 31.25 O ATOM 2505 CB TYR A 304 9.772 37.444 -34.251 1.00 24.69 C ATOM 2506 CG TYR A 304 10.583 37.551 -35.480 1.00 19.81 C ATOM 2507 CD1 TYR A 304 10.193 36.944 -36.685 1.00 21.87 C ATOM 2508 CD2 TYR A 304 11.723 38.320 -35.484 1.00 22.24 C ATOM 2509 CE1 TYR A 304 11.011 37.147 -37.909 1.00 21.68 C ATOM 2510 CE2 TYR A 304 12.520 38.537 -36.660 1.00 19.49 C ATOM 2511 CZ TYR A 304 12.156 37.933 -37.827 1.00 20.41 C ATOM 2512 OH TYR A 304 12.980 38.124 -38.863 1.00 22.78 O ATOM 0 H TYR A 304 8.876 36.607 -32.097 1.00 28.83 H new ATOM 0 HA TYR A 304 9.093 35.612 -34.619 1.00 27.01 H new ATOM 0 HB2 TYR A 304 8.927 37.900 -34.386 1.00 24.69 H new ATOM 0 HB3 TYR A 304 10.228 37.900 -33.527 1.00 24.69 H new ATOM 0 HD1 TYR A 304 9.427 36.418 -36.717 1.00 21.87 H new ATOM 0 HD2 TYR A 304 11.991 38.719 -34.688 1.00 22.24 H new ATOM 0 HE1 TYR A 304 10.762 36.756 -38.715 1.00 21.68 H new ATOM 0 HE2 TYR A 304 13.273 39.082 -36.626 1.00 19.49 H new ATOM 0 HH TYR A 304 12.753 37.623 -39.498 1.00 22.78 H new ATOM 2513 N ASP A 305 11.227 34.360 -34.182 1.00 28.20 N ATOM 2514 CA ASP A 305 12.291 33.528 -33.789 1.00 27.23 C ATOM 2515 C ASP A 305 12.995 33.123 -35.034 1.00 26.20 C ATOM 2516 O ASP A 305 12.861 31.982 -35.487 1.00 25.68 O ATOM 2517 CB ASP A 305 11.684 32.306 -33.111 1.00 28.72 C ATOM 2518 CG ASP A 305 12.736 31.438 -32.424 1.00 35.85 C ATOM 2519 OD1 ASP A 305 13.767 31.954 -31.845 1.00 38.42 O ATOM 2520 OD2 ASP A 305 12.522 30.200 -32.498 1.00 42.95 O ATOM 0 H ASP A 305 10.889 34.159 -34.947 1.00 28.20 H new ATOM 0 HA ASP A 305 12.907 33.965 -33.181 1.00 27.23 H new ATOM 0 HB2 ASP A 305 11.029 32.595 -32.456 1.00 28.72 H new ATOM 0 HB3 ASP A 305 11.211 31.775 -33.771 1.00 28.72 H new ATOM 2521 N PRO A 306 13.728 34.060 -35.618 1.00 25.25 N ATOM 2522 CA PRO A 306 14.335 33.789 -36.888 1.00 25.33 C ATOM 2523 C PRO A 306 15.593 33.042 -36.776 1.00 25.50 C ATOM 2524 O PRO A 306 16.227 33.073 -35.724 1.00 27.13 O ATOM 2525 CB PRO A 306 14.744 35.202 -37.389 1.00 25.60 C ATOM 2526 CG PRO A 306 14.821 36.013 -36.240 1.00 25.00 C ATOM 2527 CD PRO A 306 13.949 35.456 -35.190 1.00 24.71 C ATOM 0 HA PRO A 306 13.728 33.276 -37.445 1.00 25.33 H new ATOM 0 HB2 PRO A 306 15.596 35.173 -37.852 1.00 25.60 H new ATOM 0 HB3 PRO A 306 14.092 35.550 -38.017 1.00 25.60 H new ATOM 0 HG2 PRO A 306 15.737 36.058 -35.924 1.00 25.00 H new ATOM 0 HG3 PRO A 306 14.550 36.920 -36.453 1.00 25.00 H new ATOM 0 HD2 PRO A 306 14.371 35.498 -34.318 1.00 24.71 H new ATOM 0 HD3 PRO A 306 13.114 35.945 -35.125 1.00 24.71 H new ATOM 2528 N TYR A 307 15.979 32.450 -37.877 1.00 24.79 N ATOM 2529 CA TYR A 307 17.334 32.158 -38.134 1.00 26.98 C ATOM 2530 C TYR A 307 18.196 33.405 -38.027 1.00 27.38 C ATOM 2531 O TYR A 307 17.667 34.478 -37.958 1.00 27.90 O ATOM 2532 CB TYR A 307 17.421 31.671 -39.557 1.00 28.25 C ATOM 2533 CG TYR A 307 17.050 30.221 -39.743 1.00 31.24 C ATOM 2534 CD1 TYR A 307 15.740 29.775 -39.574 1.00 29.48 C ATOM 2535 CD2 TYR A 307 18.012 29.290 -40.157 1.00 36.04 C ATOM 2536 CE1 TYR A 307 15.411 28.461 -39.787 1.00 29.85 C ATOM 2537 CE2 TYR A 307 17.676 27.930 -40.314 1.00 35.61 C ATOM 2538 CZ TYR A 307 16.369 27.541 -40.133 1.00 31.84 C ATOM 2539 OH TYR A 307 16.056 26.236 -40.342 1.00 30.94 O ATOM 0 H TYR A 307 15.441 32.206 -38.502 1.00 24.79 H new ATOM 0 HA TYR A 307 17.647 31.503 -37.491 1.00 26.98 H new ATOM 0 HB2 TYR A 307 16.839 32.216 -40.110 1.00 28.25 H new ATOM 0 HB3 TYR A 307 18.326 31.806 -39.879 1.00 28.25 H new ATOM 0 HD1 TYR A 307 15.080 30.377 -39.313 1.00 29.48 H new ATOM 0 HD2 TYR A 307 18.881 29.572 -40.330 1.00 36.04 H new ATOM 0 HE1 TYR A 307 14.526 28.189 -39.696 1.00 29.85 H new ATOM 0 HE2 TYR A 307 18.328 27.305 -40.537 1.00 35.61 H new ATOM 0 HH TYR A 307 16.751 25.810 -40.546 1.00 30.94 H new ATOM 2540 N PRO A 308 19.559 33.262 -37.991 1.00 28.04 N ATOM 2541 CA PRO A 308 20.480 34.429 -37.947 1.00 26.59 C ATOM 2542 C PRO A 308 20.397 35.311 -39.150 1.00 25.80 C ATOM 2543 O PRO A 308 20.016 34.874 -40.190 1.00 24.62 O ATOM 2544 CB PRO A 308 21.875 33.789 -37.990 1.00 26.07 C ATOM 2545 CG PRO A 308 21.700 32.413 -37.590 1.00 27.55 C ATOM 2546 CD PRO A 308 20.304 31.981 -37.910 1.00 27.34 C ATOM 0 HA PRO A 308 20.271 34.976 -37.174 1.00 26.59 H new ATOM 0 HB2 PRO A 308 22.254 33.845 -38.881 1.00 26.07 H new ATOM 0 HB3 PRO A 308 22.485 34.248 -37.392 1.00 26.07 H new ATOM 0 HG2 PRO A 308 22.339 31.847 -38.051 1.00 27.55 H new ATOM 0 HG3 PRO A 308 21.870 32.317 -36.640 1.00 27.55 H new ATOM 0 HD2 PRO A 308 20.264 31.490 -38.746 1.00 27.34 H new ATOM 0 HD3 PRO A 308 19.943 31.400 -37.222 1.00 27.34 H new ATOM 2547 N ALA A 309 20.860 36.530 -38.990 1.00 27.47 N ATOM 2548 CA ALA A 309 20.979 37.491 -40.083 1.00 29.16 C ATOM 2549 C ALA A 309 21.967 37.003 -41.048 1.00 29.74 C ATOM 2550 O ALA A 309 22.759 36.169 -40.693 1.00 30.02 O ATOM 2551 CB ALA A 309 21.401 38.835 -39.559 1.00 28.60 C ATOM 0 H ALA A 309 21.122 36.837 -38.231 1.00 27.47 H new ATOM 0 HA ALA A 309 20.116 37.587 -40.516 1.00 29.16 H new ATOM 0 HB1 ALA A 309 21.475 39.461 -40.296 1.00 28.60 H new ATOM 0 HB2 ALA A 309 20.740 39.158 -38.926 1.00 28.60 H new ATOM 0 HB3 ALA A 309 22.260 38.755 -39.116 1.00 28.60 H new ATOM 2552 N ILE A 310 21.905 37.511 -42.273 1.00 32.47 N ATOM 2553 CA ILE A 310 22.869 37.126 -43.313 1.00 34.38 C ATOM 2554 C ILE A 310 23.460 38.390 -43.836 1.00 38.53 C ATOM 2555 O ILE A 310 22.801 39.067 -44.587 1.00 38.73 O ATOM 2556 CB ILE A 310 22.223 36.492 -44.505 1.00 32.73 C ATOM 2557 CG1 ILE A 310 21.407 35.256 -44.104 1.00 29.61 C ATOM 2558 CG2 ILE A 310 23.268 36.247 -45.608 1.00 31.77 C ATOM 2559 CD1 ILE A 310 20.968 34.515 -45.266 1.00 17.89 C ATOM 0 H ILE A 310 21.314 38.081 -42.528 1.00 32.47 H new ATOM 0 HA ILE A 310 23.496 36.503 -42.914 1.00 34.38 H new ATOM 0 HB ILE A 310 21.572 37.100 -44.889 1.00 32.73 H new ATOM 0 HG12 ILE A 310 21.944 34.682 -43.536 1.00 29.61 H new ATOM 0 HG13 ILE A 310 20.636 35.530 -43.583 1.00 29.61 H new ATOM 0 HG21 ILE A 310 22.839 35.836 -46.375 1.00 31.77 H new ATOM 0 HG22 ILE A 310 23.663 37.092 -45.873 1.00 31.77 H new ATOM 0 HG23 ILE A 310 23.961 35.658 -45.272 1.00 31.77 H new ATOM 0 HD11 ILE A 310 20.456 33.741 -44.982 1.00 17.89 H new ATOM 0 HD12 ILE A 310 20.412 35.084 -45.822 1.00 17.89 H new ATOM 0 HD13 ILE A 310 21.741 34.222 -45.774 1.00 17.89 H new ATOM 2560 N LYS A 311 24.673 38.740 -43.401 1.00 42.81 N ATOM 2561 CA LYS A 311 25.424 39.865 -43.953 1.00 47.28 C ATOM 2562 C LYS A 311 25.625 39.583 -45.439 1.00 49.47 C ATOM 2563 O LYS A 311 25.710 38.435 -45.867 1.00 49.23 O ATOM 2564 CB LYS A 311 26.747 40.092 -43.151 1.00 48.17 C ATOM 2565 CG LYS A 311 28.013 40.597 -43.914 1.00 52.69 C ATOM 2566 CD LYS A 311 28.813 39.430 -44.690 1.00 58.46 C ATOM 2567 CE LYS A 311 29.759 38.509 -43.785 1.00 62.64 C ATOM 2568 NZ LYS A 311 29.094 37.338 -43.018 1.00 63.28 N ATOM 0 H LYS A 311 25.085 38.325 -42.770 1.00 42.81 H new ATOM 0 HA LYS A 311 24.944 40.703 -43.867 1.00 47.28 H new ATOM 0 HB2 LYS A 311 26.556 40.729 -42.445 1.00 48.17 H new ATOM 0 HB3 LYS A 311 26.978 39.253 -42.722 1.00 48.17 H new ATOM 0 HG2 LYS A 311 27.746 41.275 -44.554 1.00 52.69 H new ATOM 0 HG3 LYS A 311 28.613 41.024 -43.282 1.00 52.69 H new ATOM 0 HD2 LYS A 311 28.167 38.860 -45.136 1.00 58.46 H new ATOM 0 HD3 LYS A 311 29.356 39.839 -45.382 1.00 58.46 H new ATOM 0 HE2 LYS A 311 30.451 38.139 -44.355 1.00 62.64 H new ATOM 0 HE3 LYS A 311 30.201 39.079 -43.137 1.00 62.64 H new ATOM 0 HZ1 LYS A 311 29.723 36.839 -42.634 1.00 63.28 H new ATOM 0 HZ2 LYS A 311 28.551 37.663 -42.392 1.00 63.28 H new ATOM 0 HZ3 LYS A 311 28.625 36.839 -43.586 1.00 63.28 H new ATOM 2569 N ALA A 312 25.644 40.658 -46.212 1.00 53.80 N ATOM 2570 CA ALA A 312 25.871 40.618 -47.641 1.00 57.75 C ATOM 2571 C ALA A 312 26.176 42.034 -48.055 1.00 60.81 C ATOM 2572 O ALA A 312 25.522 42.958 -47.552 1.00 60.02 O ATOM 2573 CB ALA A 312 24.644 40.178 -48.327 1.00 57.86 C ATOM 0 H ALA A 312 25.521 41.453 -45.908 1.00 53.80 H new ATOM 0 HA ALA A 312 26.590 40.007 -47.866 1.00 57.75 H new ATOM 0 HB1 ALA A 312 24.800 40.152 -49.284 1.00 57.86 H new ATOM 0 HB2 ALA A 312 24.399 39.293 -48.016 1.00 57.86 H new ATOM 0 HB3 ALA A 312 23.924 40.799 -48.133 1.00 57.86 H new ATOM 2574 N PRO A 313 27.134 42.207 -48.994 1.00 64.42 N ATOM 2575 CA PRO A 313 27.499 43.535 -49.515 1.00 67.71 C ATOM 2576 C PRO A 313 26.265 44.188 -50.147 1.00 70.88 C ATOM 2577 O PRO A 313 25.424 43.470 -50.691 1.00 71.61 O ATOM 2578 CB PRO A 313 28.569 43.223 -50.578 1.00 67.18 C ATOM 2579 CG PRO A 313 28.328 41.789 -50.956 1.00 66.17 C ATOM 2580 CD PRO A 313 27.905 41.139 -49.659 1.00 65.05 C ATOM 0 HA PRO A 313 27.823 44.149 -48.838 1.00 67.71 H new ATOM 0 HB2 PRO A 313 28.483 43.809 -51.346 1.00 67.18 H new ATOM 0 HB3 PRO A 313 29.464 43.348 -50.224 1.00 67.18 H new ATOM 0 HG2 PRO A 313 27.639 41.711 -51.634 1.00 66.17 H new ATOM 0 HG3 PRO A 313 29.129 41.377 -51.316 1.00 66.17 H new ATOM 0 HD2 PRO A 313 27.365 40.348 -49.812 1.00 65.05 H new ATOM 0 HD3 PRO A 313 28.669 40.863 -49.129 1.00 65.05 H new ATOM 2581 N VAL A 314 26.122 45.512 -50.020 1.00 74.67 N ATOM 2582 CA VAL A 314 25.023 46.252 -50.677 1.00 78.44 C ATOM 2583 C VAL A 314 25.342 46.424 -52.212 1.00 81.48 C ATOM 2584 O VAL A 314 26.493 46.173 -52.650 1.00 82.24 O ATOM 2585 CB VAL A 314 24.667 47.608 -49.940 1.00 78.08 C ATOM 2586 CG1 VAL A 314 23.339 48.157 -50.435 1.00 77.90 C ATOM 2587 CG2 VAL A 314 24.596 47.412 -48.430 1.00 77.46 C ATOM 0 H VAL A 314 26.651 46.006 -49.556 1.00 74.67 H new ATOM 0 HA VAL A 314 24.210 45.728 -50.605 1.00 78.44 H new ATOM 0 HB VAL A 314 25.373 48.241 -50.143 1.00 78.08 H new ATOM 0 HG11 VAL A 314 23.139 48.986 -49.973 1.00 77.90 H new ATOM 0 HG12 VAL A 314 23.393 48.324 -51.389 1.00 77.90 H new ATOM 0 HG13 VAL A 314 22.636 47.512 -50.260 1.00 77.90 H new ATOM 0 HG21 VAL A 314 24.377 48.255 -48.004 1.00 77.46 H new ATOM 0 HG22 VAL A 314 23.912 46.757 -48.220 1.00 77.46 H new ATOM 0 HG23 VAL A 314 25.454 47.099 -48.103 1.00 77.46 H new ATOM 2588 N ALA A 315 24.338 46.806 -53.023 1.00 84.38 N ATOM 2589 CA ALA A 315 24.532 46.963 -54.480 1.00 86.68 C ATOM 2590 C ALA A 315 25.369 48.206 -54.864 1.00 88.33 C ATOM 2591 O ALA A 315 25.061 49.336 -54.438 1.00 88.71 O ATOM 2592 CB ALA A 315 23.209 46.976 -55.181 1.00 86.38 C ATOM 0 H ALA A 315 23.541 46.978 -52.751 1.00 84.38 H new ATOM 0 HA ALA A 315 25.047 46.195 -54.773 1.00 86.68 H new ATOM 0 HB1 ALA A 315 23.349 47.079 -56.135 1.00 86.38 H new ATOM 0 HB2 ALA A 315 22.745 46.142 -55.011 1.00 86.38 H new ATOM 0 HB3 ALA A 315 22.675 47.716 -54.851 1.00 86.38 H new ATOM 2593 N VAL A 316 26.437 47.984 -55.646 1.00 90.22 N ATOM 2594 CA VAL A 316 27.292 49.087 -56.182 1.00 91.45 C ATOM 2595 C VAL A 316 27.152 49.269 -57.726 1.00 91.72 C ATOM 2596 O VAL A 316 27.751 50.169 -58.335 1.00 91.72 O ATOM 2597 CB VAL A 316 28.819 49.031 -55.672 1.00 91.74 C ATOM 2598 CG1 VAL A 316 29.047 50.004 -54.500 1.00 91.60 C ATOM 2599 CG2 VAL A 316 29.280 47.576 -55.296 1.00 92.06 C ATOM 2600 OXT VAL A 316 26.399 48.528 -58.396 1.00 91.89 O ATOM 0 H VAL A 316 26.693 47.198 -55.885 1.00 90.22 H new ATOM 0 HA VAL A 316 26.937 49.901 -55.792 1.00 91.45 H new ATOM 0 HB VAL A 316 29.372 49.314 -56.417 1.00 91.74 H new ATOM 0 HG11 VAL A 316 29.972 49.952 -54.211 1.00 91.60 H new ATOM 0 HG12 VAL A 316 28.849 50.909 -54.787 1.00 91.60 H new ATOM 0 HG13 VAL A 316 28.464 49.764 -53.762 1.00 91.60 H new ATOM 0 HG21 VAL A 316 30.202 47.596 -54.996 1.00 92.06 H new ATOM 0 HG22 VAL A 316 28.717 47.231 -54.585 1.00 92.06 H new ATOM 0 HG23 VAL A 316 29.206 47.002 -56.074 1.00 92.06 H new TER 2601 VAL A 316 HETATM 2602 N1 UMP A 317 14.575 48.733 -53.883 1.00 68.76 N HETATM 2603 C2 UMP A 317 13.879 47.621 -53.344 1.00 68.19 C HETATM 2604 N3 UMP A 317 13.093 47.856 -52.220 1.00 72.09 N HETATM 2605 C4 UMP A 317 12.973 49.128 -51.602 1.00 71.42 C HETATM 2606 C5 UMP A 317 13.672 50.204 -52.153 1.00 69.66 C HETATM 2607 C6 UMP A 317 14.473 49.964 -53.269 1.00 70.15 C HETATM 2608 O2 UMP A 317 13.865 46.470 -53.762 1.00 64.17 O HETATM 2609 O4 UMP A 317 12.261 49.313 -50.589 1.00 70.11 O HETATM 2610 C1' UMP A 317 15.513 48.801 -55.038 1.00 69.48 C HETATM 2611 C2' UMP A 317 15.488 47.808 -56.211 1.00 68.03 C HETATM 2612 C3' UMP A 317 16.442 48.511 -57.190 1.00 66.02 C HETATM 2613 C4' UMP A 317 16.398 50.011 -56.801 1.00 64.59 C HETATM 2614 O3' UMP A 317 17.748 47.944 -57.108 1.00 63.75 O HETATM 2615 O4' UMP A 317 15.567 50.104 -55.638 1.00 69.26 O HETATM 2616 C5' UMP A 317 15.798 50.963 -57.852 1.00 56.57 C HETATM 2617 O5' UMP A 317 16.703 51.336 -58.901 1.00 45.81 O HETATM 2618 P UMP A 317 15.889 51.854 -60.136 1.00 34.86 P HETATM 2619 OP1 UMP A 317 16.577 51.871 -61.494 1.00 34.72 O HETATM 2620 OP2 UMP A 317 14.939 50.689 -60.024 1.00 40.13 O HETATM 2621 OP3 UMP A 317 15.112 53.054 -59.734 1.00 35.44 O HETATM 0 HO3' UMP A 317 17.762 47.212 -57.519 1.00 63.75 H new HETATM 0 H5'' UMP A 317 15.019 50.541 -58.247 1.00 56.57 H new HETATM 0 H2'' UMP A 317 15.804 46.927 -55.956 1.00 68.03 H new HETATM 0 HN3 UMP A 317 12.657 47.196 -51.882 1.00 72.09 H new HETATM 0 H6 UMP A 317 14.986 50.702 -53.633 1.00 70.15 H new HETATM 0 H5' UMP A 317 15.489 51.767 -57.405 1.00 56.57 H new HETATM 0 H5 UMP A 317 13.602 51.093 -51.771 1.00 69.66 H new HETATM 0 H4' UMP A 317 17.320 50.289 -56.682 1.00 64.59 H new HETATM 0 H3' UMP A 317 16.180 48.400 -58.117 1.00 66.02 H new HETATM 0 H2' UMP A 317 14.598 47.694 -56.580 1.00 68.03 H new HETATM 0 H1' UMP A 317 16.287 48.526 -54.522 1.00 69.48 H new HETATM 2622 O HOH A 318 19.820 41.545 -54.781 1.00 37.48 O HETATM 2623 O HOH A 319 16.032 37.472 -47.875 1.00 25.28 O HETATM 2624 O HOH A 320 17.436 58.063 -42.135 1.00 34.86 O HETATM 2625 O HOH A 321 7.200 32.016 -42.594 1.00 37.04 O HETATM 2626 O HOH A 322 6.179 33.829 -55.217 1.00 32.68 O HETATM 2627 O HOH A 323 7.601 52.238 -48.832 1.00 28.00 O HETATM 2628 O HOH A 324 1.260 66.296 -61.503 1.00 27.91 O HETATM 2629 O HOH A 325 9.348 39.666 -43.882 1.00 30.02 O HETATM 2630 O HOH A 326 9.821 48.711 -46.970 1.00 47.55 O HETATM 2631 O HOH A 328 3.507 53.793 -51.922 1.00 27.62 O HETATM 2632 O HOH A 329 8.726 60.262 -45.691 1.00 23.56 O HETATM 2633 O HOH A 330 11.561 54.152 -53.083 1.00 26.03 O HETATM 2634 O HOH A 331 -0.416 38.640 -39.674 1.00 35.08 O HETATM 2635 O HOH A 332 13.605 47.525 -68.832 1.00 24.23 O HETATM 2636 O HOH A 333 -8.971 60.005 -42.555 1.00 26.51 O HETATM 2637 O HOH A 334 9.273 58.306 -52.310 1.00 23.90 O HETATM 2638 O HOH A 335 5.383 58.874 -65.442 1.00 29.23 O HETATM 2639 O HOH A 336 6.859 62.859 -37.490 1.00 30.77 O HETATM 2640 O HOH A 337 16.788 23.233 -43.022 1.00 27.67 O HETATM 2641 O HOH A 338 6.907 61.091 -57.837 1.00 29.55 O HETATM 2642 O HOH A 339 4.365 66.166 -51.944 1.00 30.27 O HETATM 2643 O HOH A 340 18.057 47.516 -52.630 1.00 42.49 O HETATM 2644 O HOH A 341 -10.682 49.903 -54.448 1.00 27.59 O HETATM 2645 O HOH A 342 16.529 41.911 -46.052 1.00 26.96 O HETATM 2646 O HOH A 343 13.191 25.217 -39.022 1.00 42.62 O HETATM 2647 O HOH A 344 -10.671 42.092 -48.269 1.00 36.40 O HETATM 2648 O HOH A 345 24.493 33.724 -41.701 1.00 30.64 O HETATM 2649 O HOH A 346 -7.911 36.506 -43.986 1.00 47.37 O HETATM 2650 O HOH A 347 13.137 51.989 -47.197 1.00 43.99 O HETATM 2651 O HOH A 348 13.071 63.173 -53.899 1.00 69.09 O HETATM 2652 O HOH A 349 6.356 63.405 -56.136 1.00 31.03 O HETATM 2653 O HOH A 350 1.843 67.788 -58.314 1.00 42.57 O HETATM 2654 O HOH A 351 -0.555 69.396 -45.997 1.00 41.00 O HETATM 2655 O HOH A 353 12.074 71.284 -42.921 1.00 41.33 O HETATM 2656 O HOH A 354 9.959 48.098 -31.222 1.00 73.82 O HETATM 2657 O HOH A 355 -12.257 59.131 -41.698 1.00 50.69 O HETATM 2658 O HOH A 356 -0.768 38.501 -36.942 1.00 39.28 O HETATM 2659 O HOH A 357 9.758 29.525 -58.048 1.00 54.22 O HETATM 2660 O HOH A 358 6.834 34.833 -41.559 1.00 30.10 O HETATM 2661 O HOH A 359 15.731 50.083 -34.244 1.00 43.52 O HETATM 2662 O HOH A 360 13.021 42.177 -35.787 1.00 56.45 O HETATM 2663 O HOH A 363 -14.682 59.778 -42.579 1.00 52.75 O HETATM 2664 O HOH A 364 -0.799 33.072 -47.228 1.00 40.55 O HETATM 2665 O HOH A 365 -19.883 51.130 -50.975 1.00 42.09 O HETATM 2666 O HOH A 366 4.479 66.780 -45.558 1.00 48.51 O HETATM 2667 O HOH A 367 13.975 52.080 -35.655 1.00 36.92 O HETATM 2668 O HOH A 368 -3.712 38.188 -38.039 1.00 56.31 O HETATM 2669 O HOH A 369 4.200 30.778 -54.191 1.00 59.26 O HETATM 2670 O HOH A 371 19.667 50.624 -36.307 1.00 66.48 O HETATM 2671 O HOH A 372 4.324 28.838 -51.640 1.00 69.66 O HETATM 2672 O HOH A 373 9.066 49.643 -29.111 1.00 60.40 O HETATM 2673 O HOH A 374 15.171 60.994 -62.394 1.00 49.05 O HETATM 2674 O HOH A 375 -2.816 39.140 -34.922 1.00 64.22 O HETATM 2675 O HOH A 376 -15.832 50.634 -43.824 1.00 50.42 O HETATM 2676 O HOH A 377 14.252 72.980 -46.904 1.00 82.36 O HETATM 2677 O HOH A 378 5.251 30.190 -41.633 1.00 80.26 O HETATM 2678 O HOH A 379 0.185 56.099 -26.224 1.00 75.17 O HETATM 2679 O HOH A 380 18.326 42.462 -43.681 1.00 35.29 O HETATM 2680 O HOH A 381 -7.005 46.039 -34.375 1.00 54.98 O HETATM 2681 O HOH A 383 21.976 52.279 -33.136 1.00 64.32 O HETATM 2682 O HOH A 384 20.189 40.741 -45.649 1.00 45.39 O HETATM 2683 O HOH A 385 11.648 57.458 -53.657 1.00 37.89 O HETATM 2684 O HOH A 386 -0.007 39.193 -25.571 1.00 43.86 O HETATM 2685 O HOH A 388 -12.961 60.876 -49.369 1.00 59.98 O HETATM 2686 O HOH A 389 6.617 34.783 -62.387 1.00 35.81 O HETATM 2687 O HOH A 390 16.513 76.793 -42.415 1.00 50.60 O HETATM 2688 O HOH A 391 -0.293 53.248 -24.365 1.00 49.04 O HETATM 2689 O HOH A 392 25.660 29.170 -50.233 1.00 32.97 O HETATM 2690 O HOH A 393 -17.648 59.919 -51.180 1.00 75.21 O HETATM 2691 O HOH A 395 8.718 50.558 -43.212 1.00 18.19 O HETATM 2692 O HOH A 396 -2.564 67.560 -45.758 1.00 31.00 O HETATM 2693 O HOH A 397 19.549 39.510 -42.533 1.00 49.70 O HETATM 2694 O HOH A 398 3.472 63.852 -56.060 1.00 38.07 O HETATM 2695 O HOH A 399 11.057 52.274 -48.771 1.00 54.22 O HETATM 2696 O HOH A 400 24.175 33.152 -66.170 1.00 39.01 O HETATM 2697 O HOH A 401 7.068 26.777 -47.197 1.00 46.80 O HETATM 2698 O HOH A 402 27.106 35.541 -54.278 1.00 37.16 O HETATM 2699 O HOH A 403 19.896 51.896 -39.629 1.00 48.40 O HETATM 2700 O HOH A 404 4.549 67.251 -54.894 1.00 54.76 O HETATM 2701 O HOH A 405 26.080 36.807 -41.013 1.00 46.12 O CONECT 2602 2603 2607 2610 CONECT 2603 2602 2604 2608 CONECT 2604 2603 2605 CONECT 2605 2604 2606 2609 CONECT 2606 2605 2607 CONECT 2607 2602 2606 CONECT 2608 2603 CONECT 2609 2605 CONECT 2610 2602 2611 2615 CONECT 2611 2610 2612 CONECT 2612 2611 2613 2614 CONECT 2613 2612 2615 2616 CONECT 2614 2612 CONECT 2615 2610 2613 CONECT 2616 2613 2617 CONECT 2617 2616 2618 CONECT 2618 2617 2619 2620 2621 CONECT 2619 2618 CONECT 2620 2618 CONECT 2621 2618 END