USER MOD reduce.3.24.130724 H: found=0, std=0, add=1941, rem=0, adj=59 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE 22-JUL-99 1C23 TITLE E. COLI METHIONINE AMINOPEPTIDASE: METHIONINE PHOSPHONATE TITLE 2 COMPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: METHIONINE AMINOPEPTIDASE; COMPND 3 CHAIN: A; COMPND 4 EC: 3.4.11.18; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES; COMPND 7 OTHER_DETAILS: METHIONINE PHOSPHONATE COMPLEX SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 562; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_PLASMID: PET28B KEYWDS PRODUCT COMPLEX, HYDROLASE EXPDTA X-RAY DIFFRACTION AUTHOR W.T.LOWTHER,Y.ZHANG,P.B.SAMPSON,J.F.HONEK,B.W.MATTHEWS REVDAT 4 24-FEB-09 1C23 1 VERSN REVDAT 3 01-APR-03 1C23 1 JRNL REVDAT 2 30-AUG-00 1C23 1 COMPND REVDAT 1 17-NOV-99 1C23 0 JRNL AUTH W.T.LOWTHER,Y.ZHANG,P.B.SAMPSON,J.F.HONEK, JRNL AUTH 2 B.W.MATTHEWS JRNL TITL INSIGHTS INTO THE MECHANISM OF ESCHERICHIA COLI JRNL TITL 2 METHIONINE AMINOPEPTIDASE FROM THE STRUCTURAL JRNL TITL 3 ANALYSIS OF REACTION PRODUCTS AND PHOSPHORUS-BASED JRNL TITL 4 TRANSITION-STATE ANALOGUES. JRNL REF BIOCHEMISTRY V. 38 14810 1999 JRNL REFN ISSN 0006-2960 JRNL PMID 10555963 JRNL DOI 10.1021/BI991711G REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 2.00 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : TNT REMARK 3 AUTHORS : TRONRUD,TEN EYCK,MATTHEWS REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.00 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 32.20 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : NULL REMARK 3 NUMBER OF REFLECTIONS : 79515 REMARK 3 REMARK 3 USING DATA ABOVE SIGMA CUTOFF. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING + TEST SET) : NULL REMARK 3 R VALUE (WORKING SET) : NULL REMARK 3 FREE R VALUE : NULL REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : NULL REMARK 3 REMARK 3 USING ALL DATA, NO SIGMA CUTOFF. REMARK 3 R VALUE (WORKING + TEST SET, NO CUTOFF) : 0.1510 REMARK 3 R VALUE (WORKING SET, NO CUTOFF) : NULL REMARK 3 FREE R VALUE (NO CUTOFF) : NULL REMARK 3 FREE R VALUE TEST SET SIZE (%, NO CUTOFF) : NULL REMARK 3 FREE R VALUE TEST SET COUNT (NO CUTOFF) : NULL REMARK 3 TOTAL NUMBER OF REFLECTIONS (NO CUTOFF) : 16137 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1983 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 13 REMARK 3 SOLVENT ATOMS : 96 REMARK 3 REMARK 3 WILSON B VALUE (FROM FCALC, A**2) : 15.500 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. RMS WEIGHT COUNT REMARK 3 BOND LENGTHS (A) : 0.011 ; NULL ; NULL REMARK 3 BOND ANGLES (DEGREES) : 2.160 ; NULL ; NULL REMARK 3 TORSION ANGLES (DEGREES) : NULL ; NULL ; NULL REMARK 3 PSEUDOROTATION ANGLES (DEGREES) : NULL ; NULL ; NULL REMARK 3 TRIGONAL CARBON PLANES (A) : 0.009 ; NULL ; NULL REMARK 3 GENERAL PLANES (A) : 0.012 ; NULL ; NULL REMARK 3 ISOTROPIC THERMAL FACTORS (A**2) : NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS (A) : NULL ; NULL ; NULL REMARK 3 REMARK 3 INCORRECT CHIRAL-CENTERS (COUNT) : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : TNT REMARK 3 KSOL : 0.84 REMARK 3 BSOL : 256.50 REMARK 3 REMARK 3 RESTRAINT LIBRARIES. REMARK 3 STEREOCHEMISTRY : TNT REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1C23 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 28-JUL-99. REMARK 100 THE RCSB ID CODE IS RCSB009384. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 27-JAN-99 REMARK 200 TEMPERATURE (KELVIN) : 298 REMARK 200 PH : NULL 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 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.54 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : RIGAKU RAXIS REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 79515 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.000 REMARK 200 RESOLUTION RANGE LOW (A) : 32.200 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 200 DATA REDUNDANCY : 4.900 REMARK 200 R MERGE (I) : 0.06400 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 27.4000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.00 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.07 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : 0.20000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 6.400 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: TNT REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 40.36 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.06 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: HEPES, NACL, K2SO4, COCL2, PEG REMARK 280 4000, METHIONINE, N-OCTANOYL SUCROSE, VAPOR DIFFUSION, SITTING REMARK 280 DROP, TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y+1/2,-Z 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 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 33.75900 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLU A 264 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 13 CE NZ REMARK 470 LYS A 86 CD CE NZ REMARK 470 LEU A 87 CD1 CD2 REMARK 470 LYS A 89 CD CE NZ REMARK 470 LYS A 117 CG CD CE NZ REMARK 470 ILE A 120 CD1 REMARK 470 ILE A 144 CD1 REMARK 470 LYS A 155 CD CE NZ REMARK 470 ARG A 189 CD NE CZ NH1 NH2 REMARK 470 ARG A 215 CG CD NE CZ NH1 NH2 REMARK 470 LYS A 218 CG CD CE NZ REMARK 470 LYS A 226 CG CD CE NZ REMARK 470 ARG A 228 CD NE CZ NH1 NH2 REMARK 470 LYS A 252 CD CE NZ REMARK 470 ASP A 263 CG OD1 OD2 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 GLU A 9 CD GLU A 9 OE2 0.073 REMARK 500 GLU A 123 CD GLU A 123 OE2 0.069 REMARK 500 GLU A 148 CD GLU A 148 OE2 0.066 REMARK 500 GLU A 204 CD GLU A 204 OE2 0.074 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 10 CB - CG - OD2 ANGL. DEV. = -5.5 DEGREES REMARK 500 ASP A 83 CB - CG - OD1 ANGL. DEV. = 5.6 DEGREES REMARK 500 ASP A 83 CB - CG - OD2 ANGL. DEV. = -5.6 DEGREES REMARK 500 ASP A 90 CB - CG - OD2 ANGL. DEV. = -5.4 DEGREES REMARK 500 ASP A 92 CB - CG - OD1 ANGL. DEV. = 7.2 DEGREES REMARK 500 ASP A 92 CB - CG - OD2 ANGL. DEV. = -7.0 DEGREES REMARK 500 ASP A 97 CB - CG - OD1 ANGL. DEV. = 6.9 DEGREES REMARK 500 ASP A 97 CB - CG - OD2 ANGL. DEV. = -6.9 DEGREES REMARK 500 ARG A 127 NE - CZ - NH2 ANGL. DEV. = -5.2 DEGREES REMARK 500 ARG A 166 NE - CZ - NH1 ANGL. DEV. = 3.8 DEGREES REMARK 500 ARG A 166 NE - CZ - NH2 ANGL. DEV. = -4.5 DEGREES REMARK 500 ASP A 187 CB - CG - OD1 ANGL. DEV. = 6.0 DEGREES REMARK 500 ASP A 219 CB - CG - OD2 ANGL. DEV. = -6.2 DEGREES REMARK 500 ASP A 227 CB - CG - OD2 ANGL. DEV. = -7.5 DEGREES REMARK 500 ARG A 251 NE - CZ - NH1 ANGL. DEV. = 3.9 DEGREES REMARK 500 ASP A 253 CB - CG - OD1 ANGL. DEV. = 5.5 DEGREES REMARK 500 ASP A 253 CB - CG - OD2 ANGL. DEV. = -5.5 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 ALA A 55 -162.51 -117.27 REMARK 500 LEU A 60 107.72 -57.60 REMARK 500 ASN A 74 -108.83 51.08 REMARK 500 GLU A 204 64.69 -157.18 REMARK 500 TRP A 221 -52.50 -133.19 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 560 DISTANCE = 5.95 ANGSTROMS REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CO A 401 CO REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASP A 108 OD1 REMARK 620 2 HIS A 171 NE2 94.6 REMARK 620 3 GLU A 204 OE2 157.5 81.0 REMARK 620 4 GLU A 235 OE1 86.9 114.5 75.1 REMARK 620 5 MPH A 300 O2 91.8 84.8 109.7 160.7 REMARK 620 6 MPH A 300 O1 105.6 147.4 88.8 92.2 69.6 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CO A 402 CO REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASP A 97 OD2 REMARK 620 2 ASP A 97 OD1 58.9 REMARK 620 3 GLU A 235 OE2 97.8 95.6 REMARK 620 4 MPH A 300 N 91.8 99.1 165.1 REMARK 620 5 MPH A 300 O1 90.5 149.3 85.5 83.0 REMARK 620 6 ASP A 108 OD2 153.7 95.0 87.3 89.0 115.6 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA A 501 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 SER A 231 O REMARK 620 2 VAL A 76 O 112.2 REMARK 620 3 ASN A 74 O 76.3 83.0 REMARK 620 4 HOH A 586 O 75.1 90.2 145.5 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CO A 401 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CO A 402 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA A 501 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MPH A 300 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1MAT RELATED DB: PDB REMARK 900 RELATED ID: 2MAT RELATED DB: PDB REMARK 900 RELATED ID: 3MAT RELATED DB: PDB REMARK 900 RELATED ID: 4MAT RELATED DB: PDB REMARK 900 RELATED ID: 1C21 RELATED DB: PDB REMARK 900 RELATED ID: 1C22 RELATED DB: PDB REMARK 900 RELATED ID: 1C24 RELATED DB: PDB REMARK 900 RELATED ID: 1C27 RELATED DB: PDB REMARK 999 REMARK 999 SEQUENCE REMARK 999 THERE ARE FOUR ADDITIONAL RESIDUES ON THE REMARK 999 C-TERMINUS LEFT OVER FROM A THROMBIN DIGEST REMARK 999 OF THE HIS-TAGGED PROTEIN. THESE RESIDUES, REMARK 999 L-V-P-R (RESIDUES 265-268), WERE NOT SEEN IN REMARK 999 THE ELECTRON DENSITY AND ARE NOT A PART OF THE SEQRES. DBREF 1C23 A 2 264 UNP P07906 AMPM_ECOLI 2 264 SEQADV 1C23 GLN A 175 UNP P07906 ARG 175 ENGINEERED SEQRES 1 A 263 ALA ILE SER ILE LYS THR PRO GLU ASP ILE GLU LYS MET SEQRES 2 A 263 ARG VAL ALA GLY ARG LEU ALA ALA GLU VAL LEU GLU MET SEQRES 3 A 263 ILE GLU PRO TYR VAL LYS PRO GLY VAL SER THR GLY GLU SEQRES 4 A 263 LEU ASP ARG ILE CYS ASN ASP TYR ILE VAL ASN GLU GLN SEQRES 5 A 263 HIS ALA VAL SER ALA CYS LEU GLY TYR HIS GLY TYR PRO SEQRES 6 A 263 LYS SER VAL CYS ILE SER ILE ASN GLU VAL VAL CYS HIS SEQRES 7 A 263 GLY ILE PRO ASP ASP ALA LYS LEU LEU LYS ASP GLY ASP SEQRES 8 A 263 ILE VAL ASN ILE ASP VAL THR VAL ILE LYS ASP GLY PHE SEQRES 9 A 263 HIS GLY ASP THR SER LYS MET PHE ILE VAL GLY LYS PRO SEQRES 10 A 263 THR ILE MET GLY GLU ARG LEU CYS ARG ILE THR GLN GLU SEQRES 11 A 263 SER LEU TYR LEU ALA LEU ARG MET VAL LYS PRO GLY ILE SEQRES 12 A 263 ASN LEU ARG GLU ILE GLY ALA ALA ILE GLN LYS PHE VAL SEQRES 13 A 263 GLU ALA GLU GLY PHE SER VAL VAL ARG GLU TYR CYS GLY SEQRES 14 A 263 HIS GLY ILE GLY GLN GLY PHE HIS GLU GLU PRO GLN VAL SEQRES 15 A 263 LEU HIS TYR ASP SER ARG GLU THR ASN VAL VAL LEU LYS SEQRES 16 A 263 PRO GLY MET THR PHE THR ILE GLU PRO MET VAL ASN ALA SEQRES 17 A 263 GLY LYS LYS GLU ILE ARG THR MET LYS ASP GLY TRP THR SEQRES 18 A 263 VAL LYS THR LYS ASP ARG SER LEU SER ALA GLN TYR GLU SEQRES 19 A 263 HIS THR ILE VAL VAL THR ASP ASN GLY CYS GLU ILE LEU SEQRES 20 A 263 THR LEU ARG LYS ASP ASP THR ILE PRO ALA ILE ILE SER SEQRES 21 A 263 HIS ASP GLU HET CO A 401 1 HET CO A 402 1 HET NA A 501 1 HET MPH A 300 10 HETNAM CO COBALT (II) ION HETNAM NA SODIUM ION HETNAM MPH (1-AMINO-3-METHYLSULFANYL-PROPYL)-PHOSPHONIC ACID HETSYN MPH METHIONINE PHOSPHONATE FORMUL 2 CO 2(CO 2+) FORMUL 4 NA NA 1+ FORMUL 5 MPH C4 H12 N O3 P S FORMUL 6 HOH *96(H2 O) HELIX 1 1 THR A 7 GLU A 29 1 23 HELIX 2 2 PRO A 30 VAL A 32 5 3 HELIX 3 3 SER A 37 GLU A 52 1 16 HELIX 4 4 GLY A 61 TYR A 65 5 5 HELIX 5 5 THR A 119 VAL A 140 1 22 HELIX 6 6 ASN A 145 GLU A 160 1 16 SHEET 1 A 3 PHE A 105 ILE A 114 0 SHEET 2 A 3 ILE A 93 LYS A 102 -1 N VAL A 94 O PHE A 113 SHEET 3 A 3 VAL A 56 SER A 57 -1 O VAL A 56 N ILE A 101 SHEET 1 A1 3 PHE A 105 ILE A 114 0 SHEET 2 A1 3 ILE A 93 LYS A 102 -1 N VAL A 94 O PHE A 113 SHEET 3 A1 3 CYS A 70 ILE A 73 -1 O CYS A 70 N ASP A 97 SHEET 1 B 3 VAL A 76 CYS A 78 0 SHEET 2 B 3 VAL A 223 THR A 225 -1 O VAL A 223 N VAL A 77 SHEET 3 B 3 ILE A 214 THR A 216 -1 O ARG A 215 N LYS A 224 SHEET 1 C 3 SER A 163 VAL A 164 0 SHEET 2 C 3 MET A 206 ASN A 208 -1 N ASN A 208 O SER A 163 SHEET 3 C 3 SER A 231 GLN A 233 -1 N ALA A 232 O VAL A 207 SHEET 1 D 2 GLY A 170 GLY A 172 0 SHEET 2 D 2 GLU A 179 VAL A 183 -1 N GLU A 179 O GLY A 172 SHEET 1 E 4 THR A 200 ILE A 203 0 SHEET 2 E 4 HIS A 236 THR A 241 -1 N HIS A 236 O ILE A 203 SHEET 3 E 4 GLY A 244 ILE A 247 -1 O GLY A 244 N THR A 241 SHEET 4 E 4 ILE A 259 SER A 261 -1 N ILE A 260 O CYS A 245 LINK CO CO A 401 OD1 ASP A 108 1555 1555 1.85 LINK CO CO A 401 NE2 HIS A 171 1555 1555 2.10 LINK CO CO A 401 OE2 GLU A 204 1555 1555 2.37 LINK CO CO A 401 OE1 GLU A 235 1555 1555 2.07 LINK CO CO A 401 O2 MPH A 300 1555 1555 2.49 LINK CO CO A 401 O1 MPH A 300 1555 1555 2.10 LINK CO CO A 402 OD2 ASP A 97 1555 1555 2.36 LINK CO CO A 402 OD1 ASP A 97 1555 1555 2.10 LINK CO CO A 402 OE2 GLU A 235 1555 1555 2.17 LINK CO CO A 402 N MPH A 300 1555 1555 2.26 LINK CO CO A 402 O1 MPH A 300 1555 1555 2.13 LINK CO CO A 402 OD2 ASP A 108 1555 1555 2.06 LINK NA NA A 501 O SER A 231 1555 1555 2.57 LINK NA NA A 501 O VAL A 76 1555 1555 2.56 LINK O ASN A 74 NA NA A 501 1555 1555 2.70 LINK NA NA A 501 O HOH A 586 1555 1555 2.85 CISPEP 1 GLU A 180 PRO A 181 0 1.24 SITE *** AC1 6 ASP A 108 HIS A 171 GLU A 204 GLU A 235 SITE *** AC1 6 MPH A 300 CO A 402 SITE *** AC2 5 ASP A 97 ASP A 108 GLU A 235 MPH A 300 SITE *** AC2 5 CO A 401 SITE *** AC3 5 SER A 72 ASN A 74 VAL A 76 SER A 231 SITE *** AC3 5 HOH A 586 SITE *** AC4 14 TYR A 65 HIS A 79 ASP A 97 THR A 99 SITE *** AC4 14 ASP A 108 HIS A 171 PHE A 177 HIS A 178 SITE *** AC4 14 GLU A 204 GLU A 235 CO A 401 CO A 402 SITE *** AC4 14 HOH A 505 HOH A 582 CRYST1 39.221 67.518 48.823 90.00 111.20 90.00 P 1 21 1 2 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 0.025497 0.000000 0.009887 0.00000 SCALE2 0.000000 0.014811 0.000000 0.00000 SCALE3 0.000000 0.000000 0.021968 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 171 HIS HE2 : A 171 HIS NE2 : A 401 COCO :(H bumps) USER MOD NoAdj-H: A 300 MPH HN2 : A 300 MPH N : A 402 COCO :(H bumps) USER MOD Set 1.1: A 236 HIS : no HD1:sc= 0.783 K(o=2.2,f=-13!) USER MOD Set 1.2: A 249 THR OG1 : rot 65:sc= 1.45 USER MOD Set 2.1: A 208 ASN : amide:sc= 1.27 K(o=2.9,f=0.35) USER MOD Set 2.2: A 231 SER OG : rot 99:sc= 1.6 USER MOD Set 3.1: A 4 SER OG : rot 131:sc= 1.07 USER MOD Set 3.2: A 6 LYS NZ :NH3+ 171:sc= 1.93 (180deg=0.998) USER MOD Set 3.3: A 200 THR OG1 : rot 107:sc= 0.151 USER MOD Set 4.1: A 145 ASN : amide:sc= -2.89! C(o=-8.7!,f=-6.7!) USER MOD Set 4.2: A 192 ASN : amide:sc= -5.8! K(o=-8.7!,f=1.1) USER MOD Set 5.1: A 130 GLN : amide:sc= 0.575 X(o=2,f=1.6) USER MOD Set 5.2: A 134 TYR OH : rot -3:sc= 1.45 USER MOD Set 6.1: A 112 MET CE :methyl -133:sc= -0.0119 (180deg=-0.534) USER MOD Set 6.2: A 126 CYS SG : rot 78:sc= 0.0155 USER MOD Set 7.1: A 95 ASN : amide:sc= 0.838 K(o=2.2,f=-0.25) USER MOD Set 7.2: A 110 SER OG : rot -143:sc= 1.35 USER MOD Set 8.1: A 65 TYR OH : rot 162:sc= 0.962 USER MOD Set 8.2: A 70 CYS SG : rot -35:sc= 0.187 USER MOD Set 9.1: A 62 TYR OH : rot 118:sc= 1.04 USER MOD Set 9.2: A 178 HIS : no HD1:sc= 1.16 K(o=2.2,f=-11!) USER MOD Set10.1: A 46 ASN : amide:sc= -0.538 K(o=-0.96,f=2.5) USER MOD Set10.2: A 68 SER OG : rot 90:sc= -0.42 USER MOD Single : A 7 THR OG1 : rot -114:sc= -1.65! USER MOD Single : A 14 MET CE :methyl -113:sc= -3.74 (180deg=-5.75!) USER MOD Single : A 27 MET CE :methyl -153:sc= -0.155 (180deg=-0.7) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0.143 USER MOD Single : A 38 THR OG1 : rot 161:sc= 1.88 USER MOD Single : A 45 CYS SG : rot 76:sc= 0.0582 USER MOD Single : A 48 TYR OH : rot 23:sc= 0.208 USER MOD Single : A 51 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 53 GLN : amide:sc= 0.43 K(o=0.43,f=-0.72) USER MOD Single : A 54 HIS : no HD1:sc= -0.0821 X(o=-0.082,f=-0.0048) USER MOD Single : A 57 SER OG : rot 134:sc= 1.38 USER MOD Single : A 59 CYS SG : rot -135:sc= 1.1 USER MOD Single : A 63 HIS : no HD1:sc= -2! K(o=-2!,f=0.57) USER MOD Single : A 67 LYS NZ :NH3+ -174:sc= 0.0891 (180deg=0.0808) USER MOD Single : A 72 SER OG : rot 85:sc= 1.3 USER MOD Single : A 74 ASN : amide:sc= 1.12 K(o=1.1,f=-3) USER MOD Single : A 78 CYS SG : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= 0.494 K(o=0.72,f=-5.6!) USER MOD Single : A 99 THR OG1 : rot -167:sc= 0.0111 USER MOD Single : A 102 LYS NZ :NH3+ 145:sc= 0.529 (180deg=0.164) USER MOD Single : A 106 HIS : no HE2:sc= 1.57 K(o=1.6,f=-5.9!) USER MOD Single : A 109 THR OG1 : rot 40:sc= 2.23 USER MOD Single : A 111 LYS NZ :NH3+ 171:sc= 1.02 (180deg=0.956) USER MOD Single : A 119 THR OG1 : rot -63:sc= 0.499 USER MOD Single : A 121 MET CE :methyl -152:sc= -0.0357 (180deg=-0.245) USER MOD Single : A 129 THR OG1 : rot 82:sc= 0.935 USER MOD Single : A 132 SER OG : rot -47:sc= 0.684 USER MOD Single : A 139 MET CE :methyl 158:sc= -0.0715 (180deg=-0.401) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 GLN : amide:sc= 1.22 K(o=1.2,f=-4.4!) USER MOD Single : A 163 SER OG : rot -108:sc= 0.403 USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 CYS SG : rot 180:sc= 0 USER MOD Single : A 175 GLN : amide:sc=-0.00468 X(o=-0.0047,f=0) USER MOD Single : A 182 GLN : amide:sc= -2! K(o=-2!,f=-0.049) USER MOD Single : A 185 HIS : no HE2:sc= -0.804! C(o=-0.8!,f=-5.3!) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 188 SER OG : rot 160:sc= -0.107 USER MOD Single : A 191 THR OG1 : rot 154:sc= 0.828 USER MOD Single : A 196 LYS NZ :NH3+ -166:sc= -0.913 (180deg=-1.33) USER MOD Single : A 199 MET CE :methyl -122:sc= -0.042 (180deg=-2.89!) USER MOD Single : A 202 THR OG1 : rot 152:sc= 0.0571 USER MOD Single : A 206 MET CE :methyl -118:sc= -0.237 (180deg=-2.4) USER MOD Single : A 211 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 LYS NZ :NH3+ 141:sc= 0.555! (180deg=-1.41!) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 MET CE :methyl -108:sc= -0.252 (180deg=-1.32) USER MOD Single : A 222 THR OG1 : rot 111:sc= 2.31 USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 225 THR OG1 : rot -154:sc= 0.548 USER MOD Single : A 229 SER OG : rot -78:sc= 0.918 USER MOD Single : A 233 GLN : amide:sc= 2.27 K(o=2.3,f=-0.018) USER MOD Single : A 234 TYR OH : rot 15:sc= 1.67 USER MOD Single : A 237 THR OG1 : rot 64:sc= 0.907 USER MOD Single : A 241 THR OG1 : rot -173:sc= 1.16 USER MOD Single : A 243 ASN : amide:sc= -1.18 K(o=-1.2,f=-4.7!) USER MOD Single : A 245 CYS SG : rot 180:sc= 0 USER MOD Single : A 255 THR OG1 : rot 180:sc= -0.045 USER MOD Single : A 261 SER OG : rot 180:sc= 0 USER MOD Single : A 262 HIS : no HD1:sc= 0.501 K(o=0.5,f=-4.6!) USER MOD Single : A 300 MPH CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 18.919 -14.765 -11.234 1.00 56.56 N ATOM 2 CA ALA A 2 17.504 -14.430 -11.176 1.00 57.74 C ATOM 3 C ALA A 2 16.773 -15.142 -10.047 1.00 49.66 C ATOM 4 O ALA A 2 17.372 -15.834 -9.210 1.00 47.78 O ATOM 5 CB ALA A 2 16.815 -14.721 -12.497 1.00 61.05 C ATOM 0 HA ALA A 2 17.463 -13.478 -10.996 1.00 57.74 H new ATOM 0 HB1 ALA A 2 15.876 -14.489 -12.430 1.00 61.05 H new ATOM 0 HB2 ALA A 2 17.228 -14.196 -13.200 1.00 61.05 H new ATOM 0 HB3 ALA A 2 16.901 -15.664 -12.706 1.00 61.05 H new ATOM 6 N ILE A 3 15.457 -14.956 -10.039 1.00 37.37 N ATOM 7 CA ILE A 3 14.639 -15.591 -9.026 1.00 27.44 C ATOM 8 C ILE A 3 14.353 -17.022 -9.410 1.00 34.21 C ATOM 9 O ILE A 3 13.773 -17.289 -10.464 1.00 34.09 O ATOM 10 CB ILE A 3 13.330 -14.856 -8.765 1.00 24.27 C ATOM 11 CG1 ILE A 3 13.647 -13.407 -8.418 1.00 21.81 C ATOM 12 CG2 ILE A 3 12.579 -15.537 -7.628 1.00 14.18 C ATOM 13 CD1 ILE A 3 12.404 -12.605 -8.104 1.00 27.50 C ATOM 0 H ILE A 3 15.027 -14.472 -10.605 1.00 37.37 H new ATOM 0 HA ILE A 3 15.149 -15.562 -8.201 1.00 27.44 H new ATOM 0 HB ILE A 3 12.766 -14.877 -9.554 1.00 24.27 H new ATOM 0 HG12 ILE A 3 14.246 -13.383 -7.655 1.00 21.81 H new ATOM 0 HG13 ILE A 3 14.116 -12.994 -9.160 1.00 21.81 H new ATOM 0 HG21 ILE A 3 11.746 -15.068 -7.463 1.00 14.18 H new ATOM 0 HG22 ILE A 3 12.389 -16.457 -7.871 1.00 14.18 H new ATOM 0 HG23 ILE A 3 13.123 -15.521 -6.825 1.00 14.18 H new ATOM 0 HD11 ILE A 3 12.653 -11.692 -7.890 1.00 27.50 H new ATOM 0 HD12 ILE A 3 11.815 -12.606 -8.874 1.00 27.50 H new ATOM 0 HD13 ILE A 3 11.946 -13.001 -7.346 1.00 27.50 H new ATOM 14 N SER A 4 14.763 -17.919 -8.520 1.00 29.12 N ATOM 15 CA SER A 4 14.571 -19.349 -8.678 1.00 29.08 C ATOM 16 C SER A 4 13.178 -19.798 -8.233 1.00 25.95 C ATOM 17 O SER A 4 12.659 -19.371 -7.218 1.00 31.49 O ATOM 18 CB SER A 4 15.614 -20.100 -7.873 1.00 28.18 C ATOM 19 OG SER A 4 15.055 -20.522 -6.643 1.00 54.66 O ATOM 0 H SER A 4 15.169 -17.705 -7.793 1.00 29.12 H new ATOM 0 HA SER A 4 14.663 -19.548 -9.623 1.00 29.08 H new ATOM 0 HB2 SER A 4 15.931 -20.867 -8.374 1.00 28.18 H new ATOM 0 HB3 SER A 4 16.382 -19.530 -7.711 1.00 28.18 H new ATOM 0 HG SER A 4 15.224 -21.336 -6.523 1.00 54.66 H new ATOM 20 N ILE A 5 12.557 -20.663 -9.009 1.00 18.85 N ATOM 21 CA ILE A 5 11.249 -21.166 -8.655 1.00 22.14 C ATOM 22 C ILE A 5 11.472 -22.572 -8.138 1.00 26.33 C ATOM 23 O ILE A 5 12.119 -23.387 -8.795 1.00 23.79 O ATOM 24 CB ILE A 5 10.276 -21.130 -9.845 1.00 22.58 C ATOM 25 CG1 ILE A 5 10.109 -19.702 -10.345 1.00 24.29 C ATOM 26 CG2 ILE A 5 8.932 -21.670 -9.397 1.00 18.36 C ATOM 27 CD1 ILE A 5 9.362 -18.839 -9.328 1.00 27.44 C ATOM 0 H ILE A 5 12.876 -20.972 -9.746 1.00 18.85 H new ATOM 0 HA ILE A 5 10.831 -20.610 -7.979 1.00 22.14 H new ATOM 0 HB ILE A 5 10.630 -21.674 -10.566 1.00 22.58 H new ATOM 0 HG12 ILE A 5 10.981 -19.315 -10.522 1.00 24.29 H new ATOM 0 HG13 ILE A 5 9.625 -19.706 -11.186 1.00 24.29 H new ATOM 0 HG21 ILE A 5 8.311 -21.651 -10.142 1.00 18.36 H new ATOM 0 HG22 ILE A 5 9.037 -22.583 -9.087 1.00 18.36 H new ATOM 0 HG23 ILE A 5 8.587 -21.122 -8.675 1.00 18.36 H new ATOM 0 HD11 ILE A 5 9.271 -17.937 -9.673 1.00 27.44 H new ATOM 0 HD12 ILE A 5 8.482 -19.214 -9.169 1.00 27.44 H new ATOM 0 HD13 ILE A 5 9.859 -18.817 -8.495 1.00 27.44 H new ATOM 28 N LYS A 6 10.972 -22.866 -6.949 1.00 18.93 N ATOM 29 CA LYS A 6 11.213 -24.171 -6.394 1.00 15.14 C ATOM 30 C LYS A 6 10.308 -25.235 -6.947 1.00 20.41 C ATOM 31 O LYS A 6 9.154 -24.975 -7.179 1.00 23.20 O ATOM 32 CB LYS A 6 11.155 -24.132 -4.864 1.00 15.93 C ATOM 33 CG LYS A 6 12.488 -23.713 -4.264 1.00 13.09 C ATOM 34 CD LYS A 6 12.885 -22.330 -4.683 1.00 14.36 C ATOM 35 CE LYS A 6 14.117 -21.841 -3.942 1.00 9.58 C ATOM 36 NZ LYS A 6 14.408 -20.454 -4.282 1.00 13.32 N ATOM 0 H LYS A 6 10.503 -22.335 -6.462 1.00 18.93 H new ATOM 0 HA LYS A 6 12.110 -24.420 -6.666 1.00 15.14 H new ATOM 0 HB2 LYS A 6 10.463 -23.513 -4.581 1.00 15.93 H new ATOM 0 HB3 LYS A 6 10.908 -25.007 -4.526 1.00 15.93 H new ATOM 0 HG2 LYS A 6 12.433 -23.753 -3.296 1.00 13.09 H new ATOM 0 HG3 LYS A 6 13.175 -24.342 -4.535 1.00 13.09 H new ATOM 0 HD2 LYS A 6 13.058 -22.319 -5.637 1.00 14.36 H new ATOM 0 HD3 LYS A 6 12.148 -21.720 -4.521 1.00 14.36 H new ATOM 0 HE2 LYS A 6 13.978 -21.922 -2.985 1.00 9.58 H new ATOM 0 HE3 LYS A 6 14.878 -22.400 -4.166 1.00 9.58 H new ATOM 0 HZ1 LYS A 6 15.048 -20.145 -3.746 1.00 13.32 H new ATOM 0 HZ2 LYS A 6 14.681 -20.406 -5.128 1.00 13.32 H new ATOM 0 HZ3 LYS A 6 13.673 -19.963 -4.180 1.00 13.32 H new ATOM 37 N THR A 7 10.823 -26.443 -7.125 1.00 14.48 N ATOM 38 CA THR A 7 9.974 -27.517 -7.595 1.00 18.15 C ATOM 39 C THR A 7 9.306 -28.069 -6.361 1.00 26.73 C ATOM 40 O THR A 7 9.710 -27.720 -5.244 1.00 28.03 O ATOM 41 CB THR A 7 10.821 -28.626 -8.268 1.00 23.41 C ATOM 42 OG1 THR A 7 10.002 -29.548 -8.943 1.00 75.95 O ATOM 43 CG2 THR A 7 11.644 -29.364 -7.229 1.00 7.57 C ATOM 0 H THR A 7 11.644 -26.656 -6.982 1.00 14.48 H new ATOM 0 HA THR A 7 9.334 -27.202 -8.252 1.00 18.15 H new ATOM 0 HB THR A 7 11.410 -28.198 -8.909 1.00 23.41 H new ATOM 0 HG1 THR A 7 10.057 -30.298 -8.569 1.00 75.95 H new ATOM 0 HG21 THR A 7 12.169 -30.055 -7.663 1.00 7.57 H new ATOM 0 HG22 THR A 7 12.237 -28.740 -6.783 1.00 7.57 H new ATOM 0 HG23 THR A 7 11.053 -29.770 -6.576 1.00 7.57 H new ATOM 44 N PRO A 8 8.314 -28.938 -6.539 1.00 21.20 N ATOM 45 CA PRO A 8 7.654 -29.532 -5.395 1.00 22.61 C ATOM 46 C PRO A 8 8.613 -30.336 -4.535 1.00 24.84 C ATOM 47 O PRO A 8 8.461 -30.415 -3.319 1.00 19.39 O ATOM 48 CB PRO A 8 6.548 -30.440 -5.945 1.00 25.70 C ATOM 49 CG PRO A 8 6.273 -29.917 -7.344 1.00 26.92 C ATOM 50 CD PRO A 8 7.505 -29.144 -7.766 1.00 19.53 C ATOM 0 HA PRO A 8 7.295 -28.835 -4.824 1.00 22.61 H new ATOM 0 HB2 PRO A 8 6.832 -31.367 -5.966 1.00 25.70 H new ATOM 0 HB3 PRO A 8 5.752 -30.400 -5.392 1.00 25.70 H new ATOM 0 HG2 PRO A 8 6.098 -30.648 -7.957 1.00 26.92 H new ATOM 0 HG3 PRO A 8 5.489 -29.346 -7.351 1.00 26.92 H new ATOM 0 HD2 PRO A 8 8.009 -29.635 -8.433 1.00 19.53 H new ATOM 0 HD3 PRO A 8 7.260 -28.294 -8.165 1.00 19.53 H new ATOM 51 N GLU A 9 9.607 -30.942 -5.181 1.00 19.93 N ATOM 52 CA GLU A 9 10.575 -31.717 -4.434 1.00 19.22 C ATOM 53 C GLU A 9 11.448 -30.757 -3.638 1.00 22.02 C ATOM 54 O GLU A 9 11.815 -31.067 -2.511 1.00 20.60 O ATOM 55 CB GLU A 9 11.443 -32.659 -5.314 1.00 16.96 C ATOM 56 CG GLU A 9 10.634 -33.652 -6.215 1.00 36.99 C ATOM 57 CD GLU A 9 9.718 -33.032 -7.263 1.00 37.39 C ATOM 58 OE1 GLU A 9 10.013 -32.042 -7.913 1.00 33.68 O ATOM 59 OE2 GLU A 9 8.574 -33.682 -7.422 1.00 48.43 O ATOM 0 H GLU A 9 9.732 -30.915 -6.031 1.00 19.93 H new ATOM 0 HA GLU A 9 10.085 -32.309 -3.842 1.00 19.22 H new ATOM 0 HB2 GLU A 9 12.011 -32.116 -5.883 1.00 16.96 H new ATOM 0 HB3 GLU A 9 12.029 -33.172 -4.735 1.00 16.96 H new ATOM 0 HG2 GLU A 9 11.265 -34.232 -6.669 1.00 36.99 H new ATOM 0 HG3 GLU A 9 10.096 -34.216 -5.637 1.00 36.99 H new ATOM 60 N ASP A 10 11.771 -29.598 -4.231 1.00 14.90 N ATOM 61 CA ASP A 10 12.579 -28.625 -3.530 1.00 15.13 C ATOM 62 C ASP A 10 11.827 -28.169 -2.285 1.00 18.17 C ATOM 63 O ASP A 10 12.368 -28.003 -1.203 1.00 15.00 O ATOM 64 CB ASP A 10 12.780 -27.397 -4.396 1.00 14.74 C ATOM 65 CG ASP A 10 13.735 -27.673 -5.508 1.00 24.72 C ATOM 66 OD1 ASP A 10 14.587 -28.532 -5.444 1.00 20.09 O ATOM 67 OD2 ASP A 10 13.601 -26.842 -6.507 1.00 28.41 O ATOM 0 H ASP A 10 11.531 -29.370 -5.025 1.00 14.90 H new ATOM 0 HA ASP A 10 13.432 -29.030 -3.308 1.00 15.13 H new ATOM 0 HB2 ASP A 10 11.928 -27.112 -4.761 1.00 14.74 H new ATOM 0 HB3 ASP A 10 13.114 -26.666 -3.853 1.00 14.74 H new ATOM 68 N ILE A 11 10.549 -27.974 -2.472 1.00 13.31 N ATOM 69 CA ILE A 11 9.711 -27.510 -1.404 1.00 14.65 C ATOM 70 C ILE A 11 9.643 -28.466 -0.240 1.00 25.25 C ATOM 71 O ILE A 11 9.632 -28.041 0.917 1.00 23.12 O ATOM 72 CB ILE A 11 8.356 -27.002 -1.904 1.00 16.86 C ATOM 73 CG1 ILE A 11 8.600 -25.703 -2.672 1.00 18.04 C ATOM 74 CG2 ILE A 11 7.394 -26.727 -0.757 1.00 12.15 C ATOM 75 CD1 ILE A 11 8.085 -25.749 -4.101 1.00 50.41 C ATOM 0 H ILE A 11 10.142 -28.106 -3.218 1.00 13.31 H new ATOM 0 HA ILE A 11 10.144 -26.727 -1.030 1.00 14.65 H new ATOM 0 HB ILE A 11 7.954 -27.682 -2.467 1.00 16.86 H new ATOM 0 HG12 ILE A 11 8.171 -24.971 -2.203 1.00 18.04 H new ATOM 0 HG13 ILE A 11 9.551 -25.514 -2.683 1.00 18.04 H new ATOM 0 HG21 ILE A 11 6.550 -26.408 -1.112 1.00 12.15 H new ATOM 0 HG22 ILE A 11 7.245 -27.544 -0.256 1.00 12.15 H new ATOM 0 HG23 ILE A 11 7.773 -26.053 -0.171 1.00 12.15 H new ATOM 0 HD11 ILE A 11 8.266 -24.902 -4.538 1.00 50.41 H new ATOM 0 HD12 ILE A 11 8.531 -26.463 -4.583 1.00 50.41 H new ATOM 0 HD13 ILE A 11 7.129 -25.911 -4.095 1.00 50.41 H new ATOM 76 N GLU A 12 9.600 -29.752 -0.537 1.00 21.67 N ATOM 77 CA GLU A 12 9.548 -30.714 0.529 1.00 16.64 C ATOM 78 C GLU A 12 10.814 -30.666 1.396 1.00 19.77 C ATOM 79 O GLU A 12 10.798 -30.848 2.630 1.00 18.68 O ATOM 80 CB GLU A 12 9.287 -32.106 -0.048 1.00 18.72 C ATOM 81 CG GLU A 12 8.030 -32.680 0.615 1.00 53.31 C ATOM 82 CD GLU A 12 7.975 -32.346 2.088 1.00100.00 C ATOM 83 OE1 GLU A 12 8.911 -32.504 2.879 1.00 63.88 O ATOM 84 OE2 GLU A 12 6.799 -31.873 2.430 1.00 80.96 O ATOM 0 H GLU A 12 9.600 -30.078 -1.333 1.00 21.67 H new ATOM 0 HA GLU A 12 8.812 -30.491 1.120 1.00 16.64 H new ATOM 0 HB2 GLU A 12 9.168 -32.055 -1.009 1.00 18.72 H new ATOM 0 HB3 GLU A 12 10.048 -32.686 0.113 1.00 18.72 H new ATOM 0 HG2 GLU A 12 7.241 -32.328 0.173 1.00 53.31 H new ATOM 0 HG3 GLU A 12 8.014 -33.643 0.500 1.00 53.31 H new ATOM 85 N LYS A 13 11.941 -30.394 0.730 1.00 14.50 N ATOM 86 CA LYS A 13 13.197 -30.298 1.427 1.00 14.45 C ATOM 87 C LYS A 13 13.248 -29.033 2.261 1.00 17.14 C ATOM 88 O LYS A 13 13.822 -28.986 3.335 1.00 18.93 O ATOM 89 CB LYS A 13 14.372 -30.438 0.475 1.00 21.75 C ATOM 90 CG LYS A 13 14.835 -31.904 0.353 1.00 37.94 C ATOM 91 CD LYS A 13 15.625 -32.262 -0.901 1.00 53.61 C ATOM 0 H LYS A 13 11.986 -30.265 -0.119 1.00 14.50 H new ATOM 0 HA LYS A 13 13.269 -31.042 2.045 1.00 14.45 H new ATOM 0 HB2 LYS A 13 14.121 -30.104 -0.400 1.00 21.75 H new ATOM 0 HB3 LYS A 13 15.109 -29.890 0.787 1.00 21.75 H new ATOM 0 HG2 LYS A 13 15.380 -32.116 1.127 1.00 37.94 H new ATOM 0 HG3 LYS A 13 14.052 -32.475 0.392 1.00 37.94 H new ATOM 92 N MET A 14 12.623 -27.985 1.774 1.00 12.88 N ATOM 93 CA MET A 14 12.599 -26.740 2.522 1.00 15.54 C ATOM 94 C MET A 14 11.736 -26.825 3.783 1.00 16.57 C ATOM 95 O MET A 14 11.987 -26.116 4.767 1.00 15.22 O ATOM 96 CB MET A 14 12.084 -25.592 1.668 1.00 16.80 C ATOM 97 CG MET A 14 12.731 -25.552 0.318 1.00 26.84 C ATOM 98 SD MET A 14 13.481 -23.944 0.084 1.00 32.26 S ATOM 99 CE MET A 14 14.671 -24.197 1.386 1.00 15.78 C ATOM 0 H MET A 14 12.209 -27.967 1.021 1.00 12.88 H new ATOM 0 HA MET A 14 13.518 -26.576 2.784 1.00 15.54 H new ATOM 0 HB2 MET A 14 11.124 -25.677 1.562 1.00 16.80 H new ATOM 0 HB3 MET A 14 12.246 -24.753 2.127 1.00 16.80 H new ATOM 0 HG2 MET A 14 13.402 -26.249 0.247 1.00 26.84 H new ATOM 0 HG3 MET A 14 12.073 -25.720 -0.375 1.00 26.84 H new ATOM 0 HE1 MET A 14 14.486 -23.587 2.117 1.00 15.78 H new ATOM 0 HE2 MET A 14 14.612 -25.111 1.705 1.00 15.78 H new ATOM 0 HE3 MET A 14 15.564 -24.031 1.045 1.00 15.78 H new ATOM 100 N ARG A 15 10.688 -27.648 3.734 1.00 10.86 N ATOM 101 CA ARG A 15 9.805 -27.861 4.879 1.00 18.66 C ATOM 102 C ARG A 15 10.586 -28.528 6.004 1.00 19.34 C ATOM 103 O ARG A 15 10.355 -28.278 7.176 1.00 18.64 O ATOM 104 CB ARG A 15 8.665 -28.834 4.607 1.00 19.80 C ATOM 105 CG ARG A 15 7.538 -28.200 3.856 1.00 22.04 C ATOM 106 CD ARG A 15 6.396 -29.168 3.579 1.00 23.93 C ATOM 107 NE ARG A 15 5.393 -28.466 2.793 1.00 26.00 N ATOM 108 CZ ARG A 15 5.166 -28.703 1.511 1.00 50.04 C ATOM 109 NH1 ARG A 15 5.820 -29.658 0.837 1.00 37.92 N ATOM 110 NH2 ARG A 15 4.236 -27.967 0.902 1.00 46.44 N ATOM 0 H ARG A 15 10.470 -28.098 3.035 1.00 10.86 H new ATOM 0 HA ARG A 15 9.457 -26.981 5.090 1.00 18.66 H new ATOM 0 HB2 ARG A 15 9.002 -29.590 4.101 1.00 19.80 H new ATOM 0 HB3 ARG A 15 8.333 -29.182 5.449 1.00 19.80 H new ATOM 0 HG2 ARG A 15 7.201 -27.445 4.363 1.00 22.04 H new ATOM 0 HG3 ARG A 15 7.871 -27.850 3.015 1.00 22.04 H new ATOM 0 HD2 ARG A 15 6.720 -29.946 3.099 1.00 23.93 H new ATOM 0 HD3 ARG A 15 6.013 -29.487 4.411 1.00 23.93 H new ATOM 0 HE ARG A 15 4.921 -27.863 3.184 1.00 26.00 H new ATOM 0 HH11 ARG A 15 6.409 -30.140 1.237 1.00 37.92 H new ATOM 0 HH12 ARG A 15 5.651 -29.789 0.004 1.00 37.92 H new ATOM 0 HH21 ARG A 15 3.809 -27.364 1.342 1.00 46.44 H new ATOM 0 HH22 ARG A 15 4.064 -28.095 0.069 1.00 46.44 H new ATOM 111 N VAL A 16 11.494 -29.418 5.642 1.00 14.73 N ATOM 112 CA VAL A 16 12.268 -30.106 6.647 1.00 13.22 C ATOM 113 C VAL A 16 13.264 -29.156 7.293 1.00 14.10 C ATOM 114 O VAL A 16 13.348 -29.092 8.495 1.00 14.70 O ATOM 115 CB VAL A 16 13.034 -31.254 5.996 1.00 20.88 C ATOM 116 CG1 VAL A 16 14.064 -31.850 6.967 1.00 22.40 C ATOM 117 CG2 VAL A 16 12.059 -32.326 5.564 1.00 20.43 C ATOM 0 H VAL A 16 11.674 -29.634 4.829 1.00 14.73 H new ATOM 0 HA VAL A 16 11.664 -30.446 7.326 1.00 13.22 H new ATOM 0 HB VAL A 16 13.510 -30.910 5.224 1.00 20.88 H new ATOM 0 HG11 VAL A 16 14.537 -32.576 6.532 1.00 22.40 H new ATOM 0 HG12 VAL A 16 14.697 -31.163 7.229 1.00 22.40 H new ATOM 0 HG13 VAL A 16 13.609 -32.187 7.755 1.00 22.40 H new ATOM 0 HG21 VAL A 16 12.544 -33.057 5.150 1.00 20.43 H new ATOM 0 HG22 VAL A 16 11.577 -32.656 6.338 1.00 20.43 H new ATOM 0 HG23 VAL A 16 11.430 -31.954 4.926 1.00 20.43 H new ATOM 118 N ALA A 17 14.022 -28.424 6.471 1.00 15.89 N ATOM 119 CA ALA A 17 15.033 -27.464 6.932 1.00 11.72 C ATOM 120 C ALA A 17 14.362 -26.382 7.749 1.00 18.78 C ATOM 121 O ALA A 17 14.893 -25.899 8.745 1.00 16.43 O ATOM 122 CB ALA A 17 15.885 -26.858 5.793 1.00 7.80 C ATOM 0 H ALA A 17 13.962 -28.472 5.614 1.00 15.89 H new ATOM 0 HA ALA A 17 15.662 -27.955 7.484 1.00 11.72 H new ATOM 0 HB1 ALA A 17 16.529 -26.236 6.166 1.00 7.80 H new ATOM 0 HB2 ALA A 17 16.354 -27.568 5.327 1.00 7.80 H new ATOM 0 HB3 ALA A 17 15.307 -26.390 5.170 1.00 7.80 H new ATOM 123 N GLY A 18 13.173 -26.012 7.309 1.00 14.82 N ATOM 124 CA GLY A 18 12.410 -24.986 7.961 1.00 12.24 C ATOM 125 C GLY A 18 11.968 -25.423 9.345 1.00 16.92 C ATOM 126 O GLY A 18 12.081 -24.676 10.319 1.00 15.26 O ATOM 0 H GLY A 18 12.789 -26.355 6.620 1.00 14.82 H new ATOM 0 HA2 GLY A 18 12.942 -24.178 8.029 1.00 12.24 H new ATOM 0 HA3 GLY A 18 11.632 -24.768 7.424 1.00 12.24 H new ATOM 127 N ARG A 19 11.469 -26.639 9.426 1.00 8.61 N ATOM 128 CA ARG A 19 11.026 -27.171 10.696 1.00 13.71 C ATOM 129 C ARG A 19 12.242 -27.366 11.631 1.00 20.30 C ATOM 130 O ARG A 19 12.142 -27.162 12.829 1.00 15.82 O ATOM 131 CB ARG A 19 10.276 -28.485 10.485 1.00 16.90 C ATOM 132 CG ARG A 19 9.479 -28.917 11.711 1.00 32.52 C ATOM 133 CD ARG A 19 8.751 -27.772 12.433 1.00 28.45 C ATOM 134 NE ARG A 19 9.012 -27.770 13.876 1.00 36.94 N ATOM 135 CZ ARG A 19 8.301 -27.130 14.802 1.00 84.18 C ATOM 136 NH1 ARG A 19 8.639 -27.218 16.073 1.00 88.29 N ATOM 137 NH2 ARG A 19 7.236 -26.393 14.473 1.00 84.15 N ATOM 0 H ARG A 19 11.378 -27.173 8.758 1.00 8.61 H new ATOM 0 HA ARG A 19 10.415 -26.543 11.113 1.00 13.71 H new ATOM 0 HB2 ARG A 19 9.674 -28.391 9.730 1.00 16.90 H new ATOM 0 HB3 ARG A 19 10.911 -29.181 10.256 1.00 16.90 H new ATOM 0 HG2 ARG A 19 8.826 -29.581 11.441 1.00 32.52 H new ATOM 0 HG3 ARG A 19 10.080 -29.349 12.338 1.00 32.52 H new ATOM 0 HD2 ARG A 19 9.031 -26.924 12.055 1.00 28.45 H new ATOM 0 HD3 ARG A 19 7.796 -27.850 12.279 1.00 28.45 H new ATOM 0 HE ARG A 19 9.688 -28.225 14.150 1.00 36.94 H new ATOM 0 HH11 ARG A 19 9.320 -27.689 16.305 1.00 88.29 H new ATOM 0 HH12 ARG A 19 8.179 -26.804 16.670 1.00 88.29 H new ATOM 0 HH21 ARG A 19 6.998 -26.325 13.649 1.00 84.15 H new ATOM 0 HH22 ARG A 19 6.789 -25.987 15.085 1.00 84.15 H new ATOM 138 N LEU A 20 13.407 -27.766 11.089 1.00 14.00 N ATOM 139 CA LEU A 20 14.623 -27.946 11.900 1.00 13.01 C ATOM 140 C LEU A 20 15.014 -26.624 12.565 1.00 14.38 C ATOM 141 O LEU A 20 15.326 -26.533 13.752 1.00 15.04 O ATOM 142 CB LEU A 20 15.782 -28.427 10.997 1.00 13.49 C ATOM 143 CG LEU A 20 15.675 -29.907 10.554 1.00 16.93 C ATOM 144 CD1 LEU A 20 16.967 -30.391 9.917 1.00 15.55 C ATOM 145 CD2 LEU A 20 15.388 -30.830 11.715 1.00 14.38 C ATOM 0 H LEU A 20 13.511 -27.938 10.253 1.00 14.00 H new ATOM 0 HA LEU A 20 14.447 -28.608 12.587 1.00 13.01 H new ATOM 0 HB2 LEU A 20 15.816 -27.866 10.207 1.00 13.49 H new ATOM 0 HB3 LEU A 20 16.620 -28.302 11.470 1.00 13.49 H new ATOM 0 HG LEU A 20 14.944 -29.933 9.917 1.00 16.93 H new ATOM 0 HD11 LEU A 20 16.869 -31.319 9.651 1.00 15.55 H new ATOM 0 HD12 LEU A 20 17.166 -29.850 9.137 1.00 15.55 H new ATOM 0 HD13 LEU A 20 17.692 -30.313 10.557 1.00 15.55 H new ATOM 0 HD21 LEU A 20 15.329 -31.744 11.395 1.00 14.38 H new ATOM 0 HD22 LEU A 20 16.103 -30.762 12.367 1.00 14.38 H new ATOM 0 HD23 LEU A 20 14.548 -30.578 12.129 1.00 14.38 H new ATOM 146 N ALA A 21 14.993 -25.555 11.774 1.00 12.52 N ATOM 147 CA ALA A 21 15.368 -24.256 12.300 1.00 10.98 C ATOM 148 C ALA A 21 14.423 -23.779 13.370 1.00 15.53 C ATOM 149 O ALA A 21 14.801 -23.169 14.375 1.00 9.95 O ATOM 150 CB ALA A 21 15.533 -23.245 11.183 1.00 10.29 C ATOM 0 H ALA A 21 14.768 -25.563 10.944 1.00 12.52 H new ATOM 0 HA ALA A 21 16.231 -24.354 12.732 1.00 10.98 H new ATOM 0 HB1 ALA A 21 15.783 -22.386 11.558 1.00 10.29 H new ATOM 0 HB2 ALA A 21 16.226 -23.546 10.574 1.00 10.29 H new ATOM 0 HB3 ALA A 21 14.696 -23.155 10.701 1.00 10.29 H new ATOM 151 N ALA A 22 13.156 -24.058 13.132 1.00 14.05 N ATOM 152 CA ALA A 22 12.133 -23.639 14.064 1.00 14.34 C ATOM 153 C ALA A 22 12.339 -24.350 15.394 1.00 23.21 C ATOM 154 O ALA A 22 12.186 -23.784 16.490 1.00 10.66 O ATOM 155 CB ALA A 22 10.748 -23.973 13.495 1.00 13.50 C ATOM 0 H ALA A 22 12.869 -24.485 12.443 1.00 14.05 H new ATOM 0 HA ALA A 22 12.192 -22.681 14.203 1.00 14.34 H new ATOM 0 HB1 ALA A 22 10.064 -23.691 14.122 1.00 13.50 H new ATOM 0 HB2 ALA A 22 10.624 -23.510 12.652 1.00 13.50 H new ATOM 0 HB3 ALA A 22 10.679 -24.930 13.351 1.00 13.50 H new ATOM 156 N GLU A 23 12.697 -25.616 15.276 1.00 12.38 N ATOM 157 CA GLU A 23 12.911 -26.420 16.458 1.00 9.47 C ATOM 158 C GLU A 23 14.057 -25.982 17.379 1.00 11.21 C ATOM 159 O GLU A 23 13.986 -26.156 18.607 1.00 12.04 O ATOM 160 CB GLU A 23 13.150 -27.825 15.973 1.00 13.37 C ATOM 161 CG GLU A 23 13.190 -28.822 17.109 1.00 28.57 C ATOM 162 CD GLU A 23 13.338 -30.151 16.470 1.00 65.62 C ATOM 163 OE1 GLU A 23 14.418 -30.676 16.238 1.00 27.72 O ATOM 164 OE2 GLU A 23 12.185 -30.569 16.029 1.00 42.28 O ATOM 0 H GLU A 23 12.820 -26.024 14.529 1.00 12.38 H new ATOM 0 HA GLU A 23 12.125 -26.325 17.018 1.00 9.47 H new ATOM 0 HB2 GLU A 23 12.449 -28.074 15.351 1.00 13.37 H new ATOM 0 HB3 GLU A 23 13.988 -27.859 15.485 1.00 13.37 H new ATOM 0 HG2 GLU A 23 13.931 -28.639 17.708 1.00 28.57 H new ATOM 0 HG3 GLU A 23 12.379 -28.779 17.640 1.00 28.57 H new ATOM 165 N VAL A 24 15.115 -25.422 16.806 1.00 8.03 N ATOM 166 CA VAL A 24 16.233 -24.923 17.622 1.00 10.55 C ATOM 167 C VAL A 24 15.698 -23.792 18.516 1.00 19.52 C ATOM 168 O VAL A 24 16.013 -23.666 19.693 1.00 12.82 O ATOM 169 CB VAL A 24 17.291 -24.378 16.668 1.00 13.50 C ATOM 170 CG1 VAL A 24 18.429 -23.661 17.388 1.00 14.48 C ATOM 171 CG2 VAL A 24 17.838 -25.558 15.874 1.00 12.33 C ATOM 0 H VAL A 24 15.212 -25.319 15.958 1.00 8.03 H new ATOM 0 HA VAL A 24 16.616 -25.621 18.176 1.00 10.55 H new ATOM 0 HB VAL A 24 16.879 -23.716 16.091 1.00 13.50 H new ATOM 0 HG11 VAL A 24 19.070 -23.336 16.737 1.00 14.48 H new ATOM 0 HG12 VAL A 24 18.073 -22.912 17.892 1.00 14.48 H new ATOM 0 HG13 VAL A 24 18.868 -24.278 17.994 1.00 14.48 H new ATOM 0 HG21 VAL A 24 18.516 -25.245 15.255 1.00 12.33 H new ATOM 0 HG22 VAL A 24 18.229 -26.204 16.482 1.00 12.33 H new ATOM 0 HG23 VAL A 24 17.117 -25.977 15.378 1.00 12.33 H new ATOM 172 N LEU A 25 14.834 -22.953 17.925 1.00 12.19 N ATOM 173 CA LEU A 25 14.233 -21.852 18.658 1.00 9.14 C ATOM 174 C LEU A 25 13.314 -22.361 19.744 1.00 12.39 C ATOM 175 O LEU A 25 13.233 -21.815 20.852 1.00 15.82 O ATOM 176 CB LEU A 25 13.532 -20.812 17.738 1.00 8.99 C ATOM 177 CG LEU A 25 14.512 -20.092 16.814 1.00 10.22 C ATOM 178 CD1 LEU A 25 13.764 -19.105 15.920 1.00 11.30 C ATOM 179 CD2 LEU A 25 15.555 -19.376 17.676 1.00 16.22 C ATOM 0 H LEU A 25 14.589 -23.012 17.103 1.00 12.19 H new ATOM 0 HA LEU A 25 14.960 -21.372 19.083 1.00 9.14 H new ATOM 0 HB2 LEU A 25 12.858 -21.260 17.203 1.00 8.99 H new ATOM 0 HB3 LEU A 25 13.070 -20.159 18.287 1.00 8.99 H new ATOM 0 HG LEU A 25 14.959 -20.730 16.236 1.00 10.22 H new ATOM 0 HD11 LEU A 25 14.395 -18.653 15.338 1.00 11.30 H new ATOM 0 HD12 LEU A 25 13.114 -19.584 15.382 1.00 11.30 H new ATOM 0 HD13 LEU A 25 13.308 -18.450 16.471 1.00 11.30 H new ATOM 0 HD21 LEU A 25 16.186 -18.913 17.103 1.00 16.22 H new ATOM 0 HD22 LEU A 25 15.113 -18.735 18.254 1.00 16.22 H new ATOM 0 HD23 LEU A 25 16.028 -20.026 18.218 1.00 16.22 H new ATOM 180 N GLU A 26 12.590 -23.417 19.446 1.00 7.57 N ATOM 181 CA GLU A 26 11.720 -23.902 20.499 1.00 9.26 C ATOM 182 C GLU A 26 12.524 -24.503 21.630 1.00 17.10 C ATOM 183 O GLU A 26 12.189 -24.385 22.800 1.00 15.17 O ATOM 184 CB GLU A 26 10.727 -24.955 19.992 1.00 8.58 C ATOM 185 CG GLU A 26 9.765 -24.383 18.919 1.00 12.12 C ATOM 186 CD GLU A 26 8.946 -25.449 18.211 1.00 22.41 C ATOM 187 OE1 GLU A 26 9.238 -26.622 18.204 1.00 20.74 O ATOM 188 OE2 GLU A 26 7.906 -25.005 17.585 1.00 24.56 O ATOM 0 H GLU A 26 12.580 -23.844 18.700 1.00 7.57 H new ATOM 0 HA GLU A 26 11.222 -23.132 20.817 1.00 9.26 H new ATOM 0 HB2 GLU A 26 11.216 -25.705 19.619 1.00 8.58 H new ATOM 0 HB3 GLU A 26 10.210 -25.296 20.739 1.00 8.58 H new ATOM 0 HG2 GLU A 26 9.163 -23.749 19.339 1.00 12.12 H new ATOM 0 HG3 GLU A 26 10.281 -23.891 18.261 1.00 12.12 H new ATOM 189 N MET A 27 13.579 -25.166 21.271 1.00 13.71 N ATOM 190 CA MET A 27 14.424 -25.861 22.204 1.00 11.30 C ATOM 191 C MET A 27 15.177 -24.978 23.185 1.00 13.05 C ATOM 192 O MET A 27 15.425 -25.312 24.356 1.00 14.55 O ATOM 193 CB MET A 27 15.435 -26.606 21.282 1.00 15.55 C ATOM 194 CG MET A 27 16.518 -27.404 21.962 1.00 17.24 C ATOM 195 SD MET A 27 17.941 -26.434 22.497 1.00 19.32 S ATOM 196 CE MET A 27 18.622 -25.806 20.922 1.00 17.98 C ATOM 0 H MET A 27 13.839 -25.231 20.454 1.00 13.71 H new ATOM 0 HA MET A 27 13.886 -26.427 22.779 1.00 11.30 H new ATOM 0 HB2 MET A 27 14.934 -27.206 20.707 1.00 15.55 H new ATOM 0 HB3 MET A 27 15.859 -25.950 20.707 1.00 15.55 H new ATOM 0 HG2 MET A 27 16.138 -27.851 22.734 1.00 17.24 H new ATOM 0 HG3 MET A 27 16.823 -28.096 21.355 1.00 17.24 H new ATOM 0 HE1 MET A 27 19.574 -25.646 21.022 1.00 17.98 H new ATOM 0 HE2 MET A 27 18.476 -26.461 20.222 1.00 17.98 H new ATOM 0 HE3 MET A 27 18.178 -24.977 20.685 1.00 17.98 H new ATOM 197 N ILE A 28 15.633 -23.852 22.688 1.00 8.96 N ATOM 198 CA ILE A 28 16.509 -23.010 23.486 1.00 8.98 C ATOM 199 C ILE A 28 15.834 -22.199 24.586 1.00 11.20 C ATOM 200 O ILE A 28 16.454 -21.714 25.544 1.00 14.90 O ATOM 201 CB ILE A 28 17.327 -22.113 22.544 1.00 11.50 C ATOM 202 CG1 ILE A 28 18.544 -21.490 23.233 1.00 16.60 C ATOM 203 CG2 ILE A 28 16.455 -20.961 22.043 1.00 10.19 C ATOM 204 CD1 ILE A 28 19.698 -22.448 23.512 1.00 11.22 C ATOM 0 H ILE A 28 15.454 -23.554 21.901 1.00 8.96 H new ATOM 0 HA ILE A 28 17.086 -23.613 23.981 1.00 8.98 H new ATOM 0 HB ILE A 28 17.630 -22.681 21.819 1.00 11.50 H new ATOM 0 HG12 ILE A 28 18.873 -20.763 22.681 1.00 16.60 H new ATOM 0 HG13 ILE A 28 18.257 -21.100 24.073 1.00 16.60 H new ATOM 0 HG21 ILE A 28 16.974 -20.397 21.449 1.00 10.19 H new ATOM 0 HG22 ILE A 28 15.691 -21.318 21.564 1.00 10.19 H new ATOM 0 HG23 ILE A 28 16.146 -20.437 22.798 1.00 10.19 H new ATOM 0 HD11 ILE A 28 20.420 -21.968 23.947 1.00 11.22 H new ATOM 0 HD12 ILE A 28 19.392 -23.164 24.090 1.00 11.22 H new ATOM 0 HD13 ILE A 28 20.017 -22.822 22.676 1.00 11.22 H new ATOM 205 N GLU A 29 14.554 -22.012 24.403 1.00 11.23 N ATOM 206 CA GLU A 29 13.807 -21.198 25.309 1.00 13.38 C ATOM 207 C GLU A 29 14.144 -21.306 26.798 1.00 11.99 C ATOM 208 O GLU A 29 14.397 -20.301 27.453 1.00 14.61 O ATOM 209 CB GLU A 29 12.319 -21.328 25.055 1.00 14.69 C ATOM 210 CG GLU A 29 11.439 -20.367 25.899 1.00 24.94 C ATOM 211 CD GLU A 29 9.990 -20.463 25.473 1.00 41.16 C ATOM 212 OE1 GLU A 29 9.563 -21.369 24.749 1.00 53.52 O ATOM 213 OE2 GLU A 29 9.258 -19.472 25.925 1.00 84.63 O ATOM 0 H GLU A 29 14.098 -22.350 23.757 1.00 11.23 H new ATOM 0 HA GLU A 29 14.103 -20.299 25.097 1.00 13.38 H new ATOM 0 HB2 GLU A 29 12.147 -21.165 24.114 1.00 14.69 H new ATOM 0 HB3 GLU A 29 12.049 -22.241 25.238 1.00 14.69 H new ATOM 0 HG2 GLU A 29 11.520 -20.588 26.840 1.00 24.94 H new ATOM 0 HG3 GLU A 29 11.753 -19.455 25.793 1.00 24.94 H new ATOM 214 N PRO A 30 14.122 -22.513 27.336 1.00 15.27 N ATOM 215 CA PRO A 30 14.371 -22.668 28.746 1.00 15.36 C ATOM 216 C PRO A 30 15.738 -22.203 29.157 1.00 21.25 C ATOM 217 O PRO A 30 15.979 -21.956 30.332 1.00 17.15 O ATOM 218 CB PRO A 30 14.202 -24.156 29.050 1.00 18.80 C ATOM 219 CG PRO A 30 13.983 -24.884 27.740 1.00 17.65 C ATOM 220 CD PRO A 30 13.908 -23.824 26.670 1.00 17.04 C ATOM 0 HA PRO A 30 13.750 -22.117 29.247 1.00 15.36 H new ATOM 0 HB2 PRO A 30 14.988 -24.501 29.501 1.00 18.80 H new ATOM 0 HB3 PRO A 30 13.449 -24.296 29.645 1.00 18.80 H new ATOM 0 HG2 PRO A 30 14.709 -25.503 27.563 1.00 17.65 H new ATOM 0 HG3 PRO A 30 13.166 -25.406 27.767 1.00 17.65 H new ATOM 0 HD2 PRO A 30 14.582 -23.976 25.989 1.00 17.04 H new ATOM 0 HD3 PRO A 30 13.046 -23.846 26.226 1.00 17.04 H new ATOM 221 N TYR A 31 16.653 -22.073 28.207 1.00 10.67 N ATOM 222 CA TYR A 31 17.961 -21.649 28.628 1.00 9.19 C ATOM 223 C TYR A 31 18.160 -20.171 28.678 1.00 14.74 C ATOM 224 O TYR A 31 19.212 -19.692 29.128 1.00 16.04 O ATOM 225 CB TYR A 31 18.958 -22.157 27.633 1.00 7.67 C ATOM 226 CG TYR A 31 18.968 -23.649 27.616 1.00 15.17 C ATOM 227 CD1 TYR A 31 18.291 -24.368 26.628 1.00 12.60 C ATOM 228 CD2 TYR A 31 19.753 -24.330 28.552 1.00 18.18 C ATOM 229 CE1 TYR A 31 18.376 -25.763 26.586 1.00 10.96 C ATOM 230 CE2 TYR A 31 19.829 -25.722 28.534 1.00 18.77 C ATOM 231 CZ TYR A 31 19.146 -26.430 27.542 1.00 20.82 C ATOM 232 OH TYR A 31 19.236 -27.789 27.522 1.00 21.33 O ATOM 0 H TYR A 31 16.543 -22.216 27.366 1.00 10.67 H new ATOM 0 HA TYR A 31 18.068 -21.996 29.527 1.00 9.19 H new ATOM 0 HB2 TYR A 31 18.742 -21.820 26.750 1.00 7.67 H new ATOM 0 HB3 TYR A 31 19.842 -21.825 27.855 1.00 7.67 H new ATOM 0 HD1 TYR A 31 17.781 -23.916 25.995 1.00 12.60 H new ATOM 0 HD2 TYR A 31 20.228 -23.850 29.192 1.00 18.18 H new ATOM 0 HE1 TYR A 31 17.925 -26.242 25.929 1.00 10.96 H new ATOM 0 HE2 TYR A 31 20.329 -26.174 29.175 1.00 18.77 H new ATOM 0 HH TYR A 31 19.730 -28.047 28.151 1.00 21.33 H new ATOM 233 N VAL A 32 17.168 -19.457 28.189 1.00 13.60 N ATOM 234 CA VAL A 32 17.285 -18.017 28.133 1.00 18.89 C ATOM 235 C VAL A 32 16.943 -17.372 29.467 1.00 27.02 C ATOM 236 O VAL A 32 15.785 -17.089 29.752 1.00 19.35 O ATOM 237 CB VAL A 32 16.449 -17.421 26.999 1.00 16.67 C ATOM 238 CG1 VAL A 32 16.749 -15.927 26.940 1.00 14.03 C ATOM 239 CG2 VAL A 32 16.754 -18.138 25.664 1.00 11.73 C ATOM 0 H VAL A 32 16.429 -19.779 27.889 1.00 13.60 H new ATOM 0 HA VAL A 32 18.215 -17.818 27.942 1.00 18.89 H new ATOM 0 HB VAL A 32 15.501 -17.548 27.161 1.00 16.67 H new ATOM 0 HG11 VAL A 32 16.231 -15.521 26.227 1.00 14.03 H new ATOM 0 HG12 VAL A 32 16.513 -15.516 27.786 1.00 14.03 H new ATOM 0 HG13 VAL A 32 17.694 -15.793 26.769 1.00 14.03 H new ATOM 0 HG21 VAL A 32 16.216 -17.748 24.957 1.00 11.73 H new ATOM 0 HG22 VAL A 32 17.694 -18.035 25.449 1.00 11.73 H new ATOM 0 HG23 VAL A 32 16.543 -19.081 25.747 1.00 11.73 H new ATOM 240 N LYS A 33 17.955 -17.168 30.311 1.00 21.53 N ATOM 241 CA LYS A 33 17.679 -16.567 31.591 1.00 18.83 C ATOM 242 C LYS A 33 18.771 -15.655 32.052 1.00 14.26 C ATOM 243 O LYS A 33 19.876 -15.628 31.516 1.00 16.69 O ATOM 244 CB LYS A 33 17.274 -17.561 32.656 1.00 20.78 C ATOM 245 CG LYS A 33 17.956 -18.900 32.513 1.00 28.59 C ATOM 246 CD LYS A 33 17.104 -19.994 33.124 1.00 43.77 C ATOM 247 CE LYS A 33 17.918 -21.079 33.795 1.00 76.80 C ATOM 248 NZ LYS A 33 17.515 -21.281 35.197 1.00100.00 N ATOM 0 H LYS A 33 18.778 -17.366 30.160 1.00 21.53 H new ATOM 0 HA LYS A 33 16.898 -16.012 31.443 1.00 18.83 H new ATOM 0 HB2 LYS A 33 17.480 -17.192 33.529 1.00 20.78 H new ATOM 0 HB3 LYS A 33 16.313 -17.689 32.621 1.00 20.78 H new ATOM 0 HG2 LYS A 33 18.114 -19.091 31.575 1.00 28.59 H new ATOM 0 HG3 LYS A 33 18.823 -18.876 32.948 1.00 28.59 H new ATOM 0 HD2 LYS A 33 16.501 -19.601 33.774 1.00 43.77 H new ATOM 0 HD3 LYS A 33 16.554 -20.392 32.431 1.00 43.77 H new ATOM 0 HE2 LYS A 33 17.814 -21.910 33.306 1.00 76.80 H new ATOM 0 HE3 LYS A 33 18.859 -20.845 33.760 1.00 76.80 H new ATOM 0 HZ1 LYS A 33 18.013 -21.924 35.559 1.00100.00 H new ATOM 0 HZ2 LYS A 33 17.631 -20.525 35.651 1.00100.00 H new ATOM 0 HZ3 LYS A 33 16.657 -21.517 35.229 1.00100.00 H new ATOM 249 N PRO A 34 18.475 -14.860 33.049 1.00 13.36 N ATOM 250 CA PRO A 34 19.500 -13.941 33.533 1.00 13.75 C ATOM 251 C PRO A 34 20.764 -14.676 33.966 1.00 20.42 C ATOM 252 O PRO A 34 20.683 -15.724 34.594 1.00 20.01 O ATOM 253 CB PRO A 34 18.906 -13.126 34.668 1.00 14.39 C ATOM 254 CG PRO A 34 17.409 -13.409 34.609 1.00 20.82 C ATOM 255 CD PRO A 34 17.202 -14.673 33.763 1.00 16.14 C ATOM 0 HA PRO A 34 19.772 -13.350 32.814 1.00 13.75 H new ATOM 0 HB2 PRO A 34 19.280 -13.389 35.523 1.00 14.39 H new ATOM 0 HB3 PRO A 34 19.090 -12.180 34.556 1.00 14.39 H new ATOM 0 HG2 PRO A 34 17.052 -13.536 35.502 1.00 20.82 H new ATOM 0 HG3 PRO A 34 16.936 -12.657 34.218 1.00 20.82 H new ATOM 0 HD2 PRO A 34 16.995 -15.440 34.320 1.00 16.14 H new ATOM 0 HD3 PRO A 34 16.463 -14.565 33.143 1.00 16.14 H new ATOM 256 N GLY A 35 21.929 -14.153 33.589 1.00 16.74 N ATOM 257 CA GLY A 35 23.175 -14.793 33.976 1.00 16.56 C ATOM 258 C GLY A 35 23.707 -15.762 32.933 1.00 25.14 C ATOM 259 O GLY A 35 24.840 -16.220 33.050 1.00 25.46 O ATOM 0 H GLY A 35 22.016 -13.440 33.117 1.00 16.74 H new ATOM 0 HA2 GLY A 35 23.843 -14.110 34.143 1.00 16.56 H new ATOM 0 HA3 GLY A 35 23.041 -15.269 34.811 1.00 16.56 H new ATOM 260 N VAL A 36 22.937 -16.107 31.900 1.00 18.14 N ATOM 261 CA VAL A 36 23.525 -17.009 30.910 1.00 14.61 C ATOM 262 C VAL A 36 24.288 -16.136 29.910 1.00 12.14 C ATOM 263 O VAL A 36 23.912 -14.971 29.641 1.00 17.22 O ATOM 264 CB VAL A 36 22.505 -17.831 30.135 1.00 23.69 C ATOM 265 CG1 VAL A 36 21.694 -18.641 31.110 1.00 33.45 C ATOM 266 CG2 VAL A 36 21.571 -16.869 29.436 1.00 23.25 C ATOM 0 H VAL A 36 22.128 -15.852 31.758 1.00 18.14 H new ATOM 0 HA VAL A 36 24.086 -17.642 31.385 1.00 14.61 H new ATOM 0 HB VAL A 36 22.950 -18.414 29.500 1.00 23.69 H new ATOM 0 HG11 VAL A 36 21.040 -19.169 30.627 1.00 33.45 H new ATOM 0 HG12 VAL A 36 22.281 -19.231 31.608 1.00 33.45 H new ATOM 0 HG13 VAL A 36 21.237 -18.046 31.725 1.00 33.45 H new ATOM 0 HG21 VAL A 36 20.909 -17.368 28.933 1.00 23.25 H new ATOM 0 HG22 VAL A 36 21.125 -16.314 30.095 1.00 23.25 H new ATOM 0 HG23 VAL A 36 22.079 -16.306 28.831 1.00 23.25 H new ATOM 267 N SER A 37 25.391 -16.658 29.348 1.00 11.30 N ATOM 268 CA SER A 37 26.107 -15.825 28.387 1.00 13.36 C ATOM 269 C SER A 37 25.596 -16.099 26.962 1.00 11.89 C ATOM 270 O SER A 37 25.018 -17.153 26.717 1.00 13.81 O ATOM 271 CB SER A 37 27.598 -16.098 28.467 1.00 12.98 C ATOM 272 OG SER A 37 27.830 -17.376 27.902 1.00 12.93 O ATOM 0 H SER A 37 25.719 -17.439 29.499 1.00 11.30 H new ATOM 0 HA SER A 37 25.947 -14.893 28.603 1.00 13.36 H new ATOM 0 HB2 SER A 37 28.095 -15.418 27.987 1.00 12.98 H new ATOM 0 HB3 SER A 37 27.900 -16.073 29.388 1.00 12.98 H new ATOM 0 HG SER A 37 28.651 -17.551 27.933 1.00 12.93 H new ATOM 273 N THR A 38 25.813 -15.202 26.012 1.00 12.82 N ATOM 274 CA THR A 38 25.367 -15.515 24.658 1.00 14.64 C ATOM 275 C THR A 38 26.222 -16.626 24.011 1.00 15.72 C ATOM 276 O THR A 38 25.745 -17.385 23.152 1.00 8.72 O ATOM 277 CB THR A 38 25.347 -14.273 23.776 1.00 9.87 C ATOM 278 OG1 THR A 38 26.645 -13.697 23.737 1.00 15.13 O ATOM 279 CG2 THR A 38 24.293 -13.308 24.322 1.00 17.84 C ATOM 0 H THR A 38 26.198 -14.440 26.118 1.00 12.82 H new ATOM 0 HA THR A 38 24.459 -15.848 24.733 1.00 14.64 H new ATOM 0 HB THR A 38 25.108 -14.495 22.863 1.00 9.87 H new ATOM 0 HG1 THR A 38 26.705 -13.185 23.074 1.00 15.13 H new ATOM 0 HG21 THR A 38 24.268 -12.510 23.771 1.00 17.84 H new ATOM 0 HG22 THR A 38 23.423 -13.737 24.309 1.00 17.84 H new ATOM 0 HG23 THR A 38 24.519 -13.063 25.233 1.00 17.84 H new ATOM 280 N GLY A 39 27.499 -16.725 24.457 1.00 17.41 N ATOM 281 CA GLY A 39 28.436 -17.750 23.975 1.00 13.13 C ATOM 282 C GLY A 39 27.908 -19.128 24.339 1.00 12.74 C ATOM 283 O GLY A 39 27.974 -20.115 23.593 1.00 13.96 O ATOM 0 H GLY A 39 27.836 -16.196 25.046 1.00 17.41 H new ATOM 0 HA2 GLY A 39 28.544 -17.678 23.014 1.00 13.13 H new ATOM 0 HA3 GLY A 39 29.311 -17.613 24.370 1.00 13.13 H new ATOM 284 N GLU A 40 27.332 -19.227 25.533 1.00 16.30 N ATOM 285 CA GLU A 40 26.758 -20.501 25.942 1.00 12.45 C ATOM 286 C GLU A 40 25.529 -20.882 25.117 1.00 13.41 C ATOM 287 O GLU A 40 25.338 -22.054 24.793 1.00 12.78 O ATOM 288 CB GLU A 40 26.317 -20.480 27.416 1.00 12.93 C ATOM 289 CG GLU A 40 27.504 -20.613 28.342 1.00 26.39 C ATOM 290 CD GLU A 40 26.977 -20.430 29.728 1.00 99.65 C ATOM 291 OE1 GLU A 40 26.872 -19.334 30.247 1.00 42.20 O ATOM 292 OE2 GLU A 40 26.524 -21.548 30.246 1.00100.00 O ATOM 0 H GLU A 40 27.264 -18.589 26.105 1.00 16.30 H new ATOM 0 HA GLU A 40 27.465 -21.150 25.803 1.00 12.45 H new ATOM 0 HB2 GLU A 40 25.848 -19.652 27.604 1.00 12.93 H new ATOM 0 HB3 GLU A 40 25.693 -21.204 27.580 1.00 12.93 H new ATOM 0 HG2 GLU A 40 27.924 -21.482 28.243 1.00 26.39 H new ATOM 0 HG3 GLU A 40 28.179 -19.947 28.138 1.00 26.39 H new ATOM 293 N LEU A 41 24.671 -19.893 24.815 1.00 9.88 N ATOM 294 CA LEU A 41 23.483 -20.198 24.018 1.00 9.93 C ATOM 295 C LEU A 41 23.885 -20.689 22.627 1.00 12.34 C ATOM 296 O LEU A 41 23.286 -21.594 22.070 1.00 11.41 O ATOM 297 CB LEU A 41 22.587 -18.981 23.898 1.00 10.22 C ATOM 298 CG LEU A 41 22.012 -18.597 25.249 1.00 14.63 C ATOM 299 CD1 LEU A 41 21.304 -17.256 25.140 1.00 17.31 C ATOM 300 CD2 LEU A 41 21.064 -19.679 25.777 1.00 11.50 C ATOM 0 H LEU A 41 24.757 -19.071 25.054 1.00 9.88 H new ATOM 0 HA LEU A 41 22.990 -20.901 24.470 1.00 9.93 H new ATOM 0 HB2 LEU A 41 23.092 -18.237 23.534 1.00 10.22 H new ATOM 0 HB3 LEU A 41 21.866 -19.166 23.276 1.00 10.22 H new ATOM 0 HG LEU A 41 22.740 -18.518 25.886 1.00 14.63 H new ATOM 0 HD11 LEU A 41 20.937 -17.012 26.004 1.00 17.31 H new ATOM 0 HD12 LEU A 41 21.937 -16.578 24.855 1.00 17.31 H new ATOM 0 HD13 LEU A 41 20.586 -17.321 24.491 1.00 17.31 H new ATOM 0 HD21 LEU A 41 20.712 -19.408 26.639 1.00 11.50 H new ATOM 0 HD22 LEU A 41 20.331 -19.800 25.153 1.00 11.50 H new ATOM 0 HD23 LEU A 41 21.548 -20.514 25.873 1.00 11.50 H new ATOM 301 N ASP A 42 24.949 -20.085 22.104 1.00 11.44 N ATOM 302 CA ASP A 42 25.465 -20.463 20.808 1.00 9.18 C ATOM 303 C ASP A 42 25.953 -21.914 20.811 1.00 19.45 C ATOM 304 O ASP A 42 25.675 -22.694 19.886 1.00 11.12 O ATOM 305 CB ASP A 42 26.564 -19.498 20.370 1.00 6.03 C ATOM 306 CG ASP A 42 27.208 -19.913 19.071 1.00 19.75 C ATOM 307 OD1 ASP A 42 26.697 -19.717 17.996 1.00 16.70 O ATOM 308 OD2 ASP A 42 28.386 -20.487 19.209 1.00 19.24 O ATOM 0 H ASP A 42 25.383 -19.452 22.491 1.00 11.44 H new ATOM 0 HA ASP A 42 24.744 -20.406 20.161 1.00 9.18 H new ATOM 0 HB2 ASP A 42 26.190 -18.608 20.273 1.00 6.03 H new ATOM 0 HB3 ASP A 42 27.241 -19.447 21.062 1.00 6.03 H new ATOM 309 N ARG A 43 26.699 -22.291 21.859 1.00 13.17 N ATOM 310 CA ARG A 43 27.177 -23.667 21.948 1.00 16.44 C ATOM 311 C ARG A 43 26.034 -24.664 22.063 1.00 18.77 C ATOM 312 O ARG A 43 26.036 -25.726 21.458 1.00 14.02 O ATOM 313 CB ARG A 43 28.113 -23.862 23.138 1.00 17.34 C ATOM 314 CG ARG A 43 29.460 -23.195 22.955 1.00 42.11 C ATOM 315 CD ARG A 43 30.423 -23.574 24.070 1.00 71.53 C ATOM 316 NE ARG A 43 30.165 -22.826 25.297 1.00 48.83 N ATOM 317 CZ ARG A 43 30.633 -21.601 25.485 1.00 53.53 C ATOM 318 NH1 ARG A 43 30.396 -20.906 26.601 1.00 44.31 N ATOM 319 NH2 ARG A 43 31.366 -21.060 24.509 1.00 26.18 N ATOM 0 H ARG A 43 26.931 -21.778 22.509 1.00 13.17 H new ATOM 0 HA ARG A 43 27.661 -23.833 21.124 1.00 16.44 H new ATOM 0 HB2 ARG A 43 27.690 -23.509 23.936 1.00 17.34 H new ATOM 0 HB3 ARG A 43 28.246 -24.812 23.285 1.00 17.34 H new ATOM 0 HG2 ARG A 43 29.836 -23.452 22.099 1.00 42.11 H new ATOM 0 HG3 ARG A 43 29.346 -22.232 22.937 1.00 42.11 H new ATOM 0 HD2 ARG A 43 30.349 -24.524 24.250 1.00 71.53 H new ATOM 0 HD3 ARG A 43 31.334 -23.411 23.779 1.00 71.53 H new ATOM 0 HE ARG A 43 29.695 -23.192 25.917 1.00 48.83 H new ATOM 0 HH11 ARG A 43 29.924 -21.252 27.231 1.00 44.31 H new ATOM 0 HH12 ARG A 43 30.716 -20.113 26.689 1.00 44.31 H new ATOM 0 HH21 ARG A 43 31.520 -21.505 23.789 1.00 26.18 H new ATOM 0 HH22 ARG A 43 31.685 -20.266 24.600 1.00 26.18 H new ATOM 320 N ILE A 44 25.038 -24.331 22.879 1.00 11.90 N ATOM 321 CA ILE A 44 23.911 -25.232 22.998 1.00 14.21 C ATOM 322 C ILE A 44 23.244 -25.401 21.640 1.00 13.08 C ATOM 323 O ILE A 44 22.938 -26.515 21.205 1.00 14.10 O ATOM 324 CB ILE A 44 22.924 -24.724 24.049 1.00 18.39 C ATOM 325 CG1 ILE A 44 23.572 -24.776 25.422 1.00 13.83 C ATOM 326 CG2 ILE A 44 21.667 -25.589 24.082 1.00 11.29 C ATOM 327 CD1 ILE A 44 22.736 -23.995 26.431 1.00 11.51 C ATOM 0 H ILE A 44 24.998 -23.615 23.354 1.00 11.90 H new ATOM 0 HA ILE A 44 24.225 -26.101 23.293 1.00 14.21 H new ATOM 0 HB ILE A 44 22.682 -23.814 23.817 1.00 18.39 H new ATOM 0 HG12 ILE A 44 23.660 -25.698 25.710 1.00 13.83 H new ATOM 0 HG13 ILE A 44 24.467 -24.405 25.378 1.00 13.83 H new ATOM 0 HG21 ILE A 44 21.057 -25.248 24.755 1.00 11.29 H new ATOM 0 HG22 ILE A 44 21.235 -25.566 23.214 1.00 11.29 H new ATOM 0 HG23 ILE A 44 21.909 -26.503 24.299 1.00 11.29 H new ATOM 0 HD11 ILE A 44 23.159 -24.036 27.303 1.00 11.51 H new ATOM 0 HD12 ILE A 44 22.668 -23.070 26.148 1.00 11.51 H new ATOM 0 HD13 ILE A 44 21.848 -24.382 26.485 1.00 11.51 H new ATOM 328 N CYS A 45 23.024 -24.281 20.948 1.00 7.59 N ATOM 329 CA CYS A 45 22.376 -24.373 19.650 1.00 9.99 C ATOM 330 C CYS A 45 23.153 -25.240 18.678 1.00 15.88 C ATOM 331 O CYS A 45 22.584 -26.098 18.002 1.00 19.74 O ATOM 332 CB CYS A 45 22.123 -23.014 18.989 1.00 8.56 C ATOM 333 SG CYS A 45 20.858 -22.069 19.833 1.00 12.90 S ATOM 0 H CYS A 45 23.235 -23.488 21.204 1.00 7.59 H new ATOM 0 HA CYS A 45 21.518 -24.782 19.844 1.00 9.99 H new ATOM 0 HB2 CYS A 45 22.949 -22.505 18.976 1.00 8.56 H new ATOM 0 HB3 CYS A 45 21.859 -23.150 18.066 1.00 8.56 H new ATOM 0 HG CYS A 45 21.311 -21.607 20.844 1.00 12.90 H new ATOM 334 N ASN A 46 24.456 -24.992 18.608 1.00 12.30 N ATOM 335 CA ASN A 46 25.340 -25.727 17.719 1.00 12.70 C ATOM 336 C ASN A 46 25.376 -27.236 17.978 1.00 17.45 C ATOM 337 O ASN A 46 25.359 -28.064 17.080 1.00 15.30 O ATOM 338 CB ASN A 46 26.765 -25.169 17.787 1.00 16.48 C ATOM 339 CG ASN A 46 27.589 -25.865 16.737 1.00 34.43 C ATOM 340 OD1 ASN A 46 28.465 -26.683 17.051 1.00 52.76 O ATOM 341 ND2 ASN A 46 27.198 -25.631 15.489 1.00 23.63 N ATOM 0 H ASN A 46 24.852 -24.390 19.078 1.00 12.30 H new ATOM 0 HA ASN A 46 24.969 -25.603 16.832 1.00 12.70 H new ATOM 0 HB2 ASN A 46 26.761 -24.211 17.635 1.00 16.48 H new ATOM 0 HB3 ASN A 46 27.145 -25.315 18.668 1.00 16.48 H new ATOM 0 HD21 ASN A 46 27.559 -26.061 14.837 1.00 23.63 H new ATOM 0 HD22 ASN A 46 26.584 -25.050 15.333 1.00 23.63 H new ATOM 342 N ASP A 47 25.406 -27.602 19.248 1.00 20.64 N ATOM 343 CA ASP A 47 25.426 -29.004 19.617 1.00 22.09 C ATOM 344 C ASP A 47 24.186 -29.706 19.140 1.00 19.28 C ATOM 345 O ASP A 47 24.220 -30.830 18.631 1.00 19.37 O ATOM 346 CB ASP A 47 25.585 -29.210 21.146 1.00 28.30 C ATOM 347 CG ASP A 47 26.889 -28.643 21.651 1.00 83.27 C ATOM 348 OD1 ASP A 47 27.782 -28.270 20.903 1.00 89.98 O ATOM 349 OD2 ASP A 47 26.956 -28.563 22.965 1.00100.00 O ATOM 0 H ASP A 47 25.415 -27.054 19.911 1.00 20.64 H new ATOM 0 HA ASP A 47 26.202 -29.390 19.181 1.00 22.09 H new ATOM 0 HB2 ASP A 47 24.846 -28.785 21.609 1.00 28.30 H new ATOM 0 HB3 ASP A 47 25.542 -30.157 21.352 1.00 28.30 H new ATOM 350 N TYR A 48 23.074 -29.022 19.331 1.00 18.52 N ATOM 351 CA TYR A 48 21.781 -29.566 18.955 1.00 16.80 C ATOM 352 C TYR A 48 21.702 -29.807 17.448 1.00 15.90 C ATOM 353 O TYR A 48 21.347 -30.874 16.978 1.00 15.26 O ATOM 354 CB TYR A 48 20.702 -28.574 19.420 1.00 15.97 C ATOM 355 CG TYR A 48 19.336 -29.159 19.333 1.00 16.81 C ATOM 356 CD1 TYR A 48 18.479 -28.791 18.291 1.00 16.28 C ATOM 357 CD2 TYR A 48 18.919 -30.121 20.259 1.00 17.39 C ATOM 358 CE1 TYR A 48 17.210 -29.375 18.205 1.00 15.32 C ATOM 359 CE2 TYR A 48 17.650 -30.707 20.192 1.00 17.82 C ATOM 360 CZ TYR A 48 16.798 -30.318 19.155 1.00 23.70 C ATOM 361 OH TYR A 48 15.548 -30.866 19.066 1.00 31.56 O ATOM 0 H TYR A 48 23.044 -28.236 19.679 1.00 18.52 H new ATOM 0 HA TYR A 48 21.644 -30.427 19.380 1.00 16.80 H new ATOM 0 HB2 TYR A 48 20.881 -28.307 20.335 1.00 15.97 H new ATOM 0 HB3 TYR A 48 20.745 -27.772 18.877 1.00 15.97 H new ATOM 0 HD1 TYR A 48 18.750 -28.163 17.660 1.00 16.28 H new ATOM 0 HD2 TYR A 48 19.501 -30.378 20.937 1.00 17.39 H new ATOM 0 HE1 TYR A 48 16.637 -29.135 17.513 1.00 15.32 H new ATOM 0 HE2 TYR A 48 17.381 -31.338 20.820 1.00 17.82 H new ATOM 0 HH TYR A 48 15.272 -30.809 18.275 1.00 31.56 H new ATOM 362 N ILE A 49 22.053 -28.768 16.704 1.00 12.28 N ATOM 363 CA ILE A 49 22.036 -28.801 15.243 1.00 11.91 C ATOM 364 C ILE A 49 22.864 -29.957 14.705 1.00 12.17 C ATOM 365 O ILE A 49 22.427 -30.766 13.905 1.00 17.00 O ATOM 366 CB ILE A 49 22.471 -27.442 14.638 1.00 11.89 C ATOM 367 CG1 ILE A 49 21.400 -26.361 14.877 1.00 7.42 C ATOM 368 CG2 ILE A 49 22.650 -27.564 13.126 1.00 16.70 C ATOM 369 CD1 ILE A 49 21.934 -24.949 14.712 1.00 8.62 C ATOM 0 H ILE A 49 22.310 -28.016 17.032 1.00 12.28 H new ATOM 0 HA ILE A 49 21.120 -28.953 14.963 1.00 11.91 H new ATOM 0 HB ILE A 49 23.304 -27.195 15.069 1.00 11.89 H new ATOM 0 HG12 ILE A 49 20.666 -26.498 14.258 1.00 7.42 H new ATOM 0 HG13 ILE A 49 21.039 -26.462 15.772 1.00 7.42 H new ATOM 0 HG21 ILE A 49 22.922 -26.707 12.762 1.00 16.70 H new ATOM 0 HG22 ILE A 49 23.331 -28.227 12.933 1.00 16.70 H new ATOM 0 HG23 ILE A 49 21.811 -27.835 12.721 1.00 16.70 H new ATOM 0 HD11 ILE A 49 21.220 -24.312 14.873 1.00 8.62 H new ATOM 0 HD12 ILE A 49 22.651 -24.798 15.347 1.00 8.62 H new ATOM 0 HD13 ILE A 49 22.272 -24.834 13.810 1.00 8.62 H new ATOM 370 N VAL A 50 24.086 -30.044 15.173 1.00 11.41 N ATOM 371 CA VAL A 50 25.004 -31.057 14.706 1.00 16.90 C ATOM 372 C VAL A 50 24.782 -32.441 15.248 1.00 21.21 C ATOM 373 O VAL A 50 24.767 -33.423 14.521 1.00 24.10 O ATOM 374 CB VAL A 50 26.445 -30.677 15.037 1.00 24.21 C ATOM 375 CG1 VAL A 50 27.350 -31.865 14.765 1.00 23.73 C ATOM 376 CG2 VAL A 50 26.892 -29.450 14.244 1.00 26.28 C ATOM 0 H VAL A 50 24.410 -29.518 15.771 1.00 11.41 H new ATOM 0 HA VAL A 50 24.834 -31.088 13.752 1.00 16.90 H new ATOM 0 HB VAL A 50 26.502 -30.442 15.977 1.00 24.21 H new ATOM 0 HG11 VAL A 50 28.267 -31.628 14.974 1.00 23.73 H new ATOM 0 HG12 VAL A 50 27.076 -32.614 15.317 1.00 23.73 H new ATOM 0 HG13 VAL A 50 27.286 -32.113 13.830 1.00 23.73 H new ATOM 0 HG21 VAL A 50 27.809 -29.232 14.474 1.00 26.28 H new ATOM 0 HG22 VAL A 50 26.833 -29.639 13.294 1.00 26.28 H new ATOM 0 HG23 VAL A 50 26.318 -28.698 14.459 1.00 26.28 H new ATOM 377 N ASN A 51 24.643 -32.514 16.552 1.00 18.48 N ATOM 378 CA ASN A 51 24.518 -33.796 17.192 1.00 15.78 C ATOM 379 C ASN A 51 23.152 -34.410 17.225 1.00 20.22 C ATOM 380 O ASN A 51 22.993 -35.631 17.184 1.00 21.67 O ATOM 381 CB ASN A 51 25.163 -33.812 18.593 1.00 21.76 C ATOM 382 CG ASN A 51 26.637 -33.458 18.544 1.00 32.86 C ATOM 383 OD1 ASN A 51 27.346 -33.856 17.613 1.00 33.74 O ATOM 384 ND2 ASN A 51 27.080 -32.651 19.499 1.00 29.89 N ATOM 0 H ASN A 51 24.619 -31.837 17.081 1.00 18.48 H new ATOM 0 HA ASN A 51 25.018 -34.375 16.595 1.00 15.78 H new ATOM 0 HB2 ASN A 51 24.699 -33.184 19.169 1.00 21.76 H new ATOM 0 HB3 ASN A 51 25.055 -34.692 18.988 1.00 21.76 H new ATOM 0 HD21 ASN A 51 27.896 -32.380 19.489 1.00 29.89 H new ATOM 0 HD22 ASN A 51 26.551 -32.399 20.128 1.00 29.89 H new ATOM 385 N GLU A 52 22.147 -33.603 17.350 1.00 15.13 N ATOM 386 CA GLU A 52 20.841 -34.225 17.391 1.00 13.75 C ATOM 387 C GLU A 52 20.189 -34.165 16.048 1.00 16.05 C ATOM 388 O GLU A 52 19.700 -35.126 15.489 1.00 22.84 O ATOM 389 CB GLU A 52 19.948 -33.506 18.435 1.00 17.03 C ATOM 390 CG GLU A 52 20.601 -33.507 19.822 1.00 25.45 C ATOM 391 CD GLU A 52 20.208 -34.710 20.643 1.00 40.95 C ATOM 392 OE1 GLU A 52 19.500 -35.610 20.213 1.00 28.01 O ATOM 393 OE2 GLU A 52 20.690 -34.670 21.864 1.00 63.49 O ATOM 0 H GLU A 52 22.176 -32.746 17.410 1.00 15.13 H new ATOM 0 HA GLU A 52 20.950 -35.155 17.644 1.00 13.75 H new ATOM 0 HB2 GLU A 52 19.787 -32.592 18.152 1.00 17.03 H new ATOM 0 HB3 GLU A 52 19.084 -33.945 18.482 1.00 17.03 H new ATOM 0 HG2 GLU A 52 21.566 -33.488 19.722 1.00 25.45 H new ATOM 0 HG3 GLU A 52 20.349 -32.699 20.296 1.00 25.45 H new ATOM 394 N GLN A 53 20.182 -32.992 15.485 1.00 16.46 N ATOM 395 CA GLN A 53 19.536 -32.885 14.203 1.00 10.72 C ATOM 396 C GLN A 53 20.341 -33.468 13.074 1.00 19.42 C ATOM 397 O GLN A 53 19.802 -33.710 11.995 1.00 25.27 O ATOM 398 CB GLN A 53 19.232 -31.410 13.865 1.00 7.63 C ATOM 399 CG GLN A 53 18.255 -30.801 14.880 1.00 10.44 C ATOM 400 CD GLN A 53 17.859 -29.409 14.462 1.00 18.12 C ATOM 401 OE1 GLN A 53 18.641 -28.678 13.869 1.00 13.15 O ATOM 402 NE2 GLN A 53 16.625 -29.048 14.709 1.00 16.48 N ATOM 0 H GLN A 53 20.526 -32.272 15.804 1.00 16.46 H new ATOM 0 HA GLN A 53 18.717 -33.399 14.285 1.00 10.72 H new ATOM 0 HB2 GLN A 53 20.057 -30.900 13.859 1.00 7.63 H new ATOM 0 HB3 GLN A 53 18.855 -31.350 12.973 1.00 7.63 H new ATOM 0 HG2 GLN A 53 17.465 -31.360 14.952 1.00 10.44 H new ATOM 0 HG3 GLN A 53 18.666 -30.776 15.758 1.00 10.44 H new ATOM 0 HE21 GLN A 53 16.096 -29.582 15.128 1.00 16.48 H new ATOM 0 HE22 GLN A 53 16.343 -28.277 14.452 1.00 16.48 H new ATOM 403 N HIS A 54 21.636 -33.614 13.251 1.00 15.08 N ATOM 404 CA HIS A 54 22.411 -34.103 12.120 1.00 21.09 C ATOM 405 C HIS A 54 22.341 -33.161 10.925 1.00 21.10 C ATOM 406 O HIS A 54 22.353 -33.554 9.758 1.00 20.49 O ATOM 407 CB HIS A 54 22.108 -35.568 11.731 1.00 27.85 C ATOM 408 CG HIS A 54 22.281 -36.464 12.911 1.00 38.16 C ATOM 409 ND1 HIS A 54 23.543 -36.858 13.338 1.00 43.66 N ATOM 410 CD2 HIS A 54 21.352 -36.974 13.770 1.00 48.00 C ATOM 411 CE1 HIS A 54 23.358 -37.603 14.423 1.00 46.08 C ATOM 412 NE2 HIS A 54 22.059 -37.693 14.715 1.00 48.39 N ATOM 0 H HIS A 54 22.073 -33.448 13.973 1.00 15.08 H new ATOM 0 HA HIS A 54 23.331 -34.111 12.428 1.00 21.09 H new ATOM 0 HB2 HIS A 54 21.201 -35.639 11.394 1.00 27.85 H new ATOM 0 HB3 HIS A 54 22.700 -35.848 11.015 1.00 27.85 H new ATOM 0 HD2 HIS A 54 20.430 -36.861 13.728 1.00 48.00 H new ATOM 0 HE1 HIS A 54 24.039 -38.006 14.911 1.00 46.08 H new ATOM 0 HE2 HIS A 54 21.720 -38.124 15.377 1.00 48.39 H new ATOM 413 N ALA A 55 22.289 -31.882 11.244 1.00 16.89 N ATOM 414 CA ALA A 55 22.267 -30.859 10.235 1.00 14.84 C ATOM 415 C ALA A 55 23.517 -29.979 10.362 1.00 20.44 C ATOM 416 O ALA A 55 24.502 -30.323 11.005 1.00 16.37 O ATOM 417 CB ALA A 55 20.972 -30.042 10.263 1.00 9.81 C ATOM 0 H ALA A 55 22.266 -31.587 12.052 1.00 16.89 H new ATOM 0 HA ALA A 55 22.284 -31.287 9.365 1.00 14.84 H new ATOM 0 HB1 ALA A 55 21.001 -29.366 9.568 1.00 9.81 H new ATOM 0 HB2 ALA A 55 20.215 -30.629 10.111 1.00 9.81 H new ATOM 0 HB3 ALA A 55 20.879 -29.612 11.128 1.00 9.81 H new ATOM 418 N VAL A 56 23.476 -28.807 9.760 1.00 13.21 N ATOM 419 CA VAL A 56 24.620 -27.937 9.830 1.00 14.34 C ATOM 420 C VAL A 56 24.176 -26.479 9.939 1.00 11.89 C ATOM 421 O VAL A 56 23.131 -26.135 9.404 1.00 14.74 O ATOM 422 CB VAL A 56 25.361 -28.285 8.531 1.00 26.40 C ATOM 423 CG1 VAL A 56 25.973 -27.107 7.817 1.00 22.85 C ATOM 424 CG2 VAL A 56 26.420 -29.321 8.877 1.00 32.60 C ATOM 0 H VAL A 56 22.807 -28.503 9.314 1.00 13.21 H new ATOM 0 HA VAL A 56 25.189 -28.053 10.607 1.00 14.34 H new ATOM 0 HB VAL A 56 24.709 -28.629 7.900 1.00 26.40 H new ATOM 0 HG11 VAL A 56 26.419 -27.413 7.012 1.00 22.85 H new ATOM 0 HG12 VAL A 56 25.277 -26.474 7.580 1.00 22.85 H new ATOM 0 HG13 VAL A 56 26.618 -26.675 8.399 1.00 22.85 H new ATOM 0 HG21 VAL A 56 26.909 -29.564 8.075 1.00 32.60 H new ATOM 0 HG22 VAL A 56 27.034 -28.951 9.530 1.00 32.60 H new ATOM 0 HG23 VAL A 56 25.993 -30.110 9.247 1.00 32.60 H new ATOM 425 N SER A 57 24.942 -25.622 10.632 1.00 8.88 N ATOM 426 CA SER A 57 24.581 -24.225 10.726 1.00 13.29 C ATOM 427 C SER A 57 25.076 -23.530 9.485 1.00 16.65 C ATOM 428 O SER A 57 26.243 -23.699 9.143 1.00 14.53 O ATOM 429 CB SER A 57 25.270 -23.526 11.897 1.00 18.81 C ATOM 430 OG SER A 57 25.474 -22.140 11.582 1.00 14.15 O ATOM 0 H SER A 57 25.664 -25.839 11.046 1.00 8.88 H new ATOM 0 HA SER A 57 23.619 -24.181 10.841 1.00 13.29 H new ATOM 0 HB2 SER A 57 24.729 -23.608 12.698 1.00 18.81 H new ATOM 0 HB3 SER A 57 26.121 -23.953 12.084 1.00 18.81 H new ATOM 0 HG SER A 57 25.235 -21.666 12.233 1.00 14.15 H new ATOM 431 N ALA A 58 24.234 -22.722 8.855 1.00 12.90 N ATOM 432 CA ALA A 58 24.656 -22.039 7.651 1.00 13.76 C ATOM 433 C ALA A 58 25.557 -20.884 7.953 1.00 21.47 C ATOM 434 O ALA A 58 26.216 -20.355 7.050 1.00 18.88 O ATOM 435 CB ALA A 58 23.500 -21.539 6.775 1.00 12.13 C ATOM 0 H ALA A 58 23.428 -22.560 9.106 1.00 12.90 H new ATOM 0 HA ALA A 58 25.135 -22.717 7.150 1.00 13.76 H new ATOM 0 HB1 ALA A 58 23.857 -21.094 5.991 1.00 12.13 H new ATOM 0 HB2 ALA A 58 22.954 -22.292 6.499 1.00 12.13 H new ATOM 0 HB3 ALA A 58 22.957 -20.915 7.281 1.00 12.13 H new ATOM 436 N CYS A 59 25.568 -20.485 9.219 1.00 10.71 N ATOM 437 CA CYS A 59 26.332 -19.299 9.598 1.00 19.32 C ATOM 438 C CYS A 59 27.837 -19.467 9.757 1.00 15.08 C ATOM 439 O CYS A 59 28.613 -18.586 9.414 1.00 14.94 O ATOM 440 CB CYS A 59 25.724 -18.601 10.870 1.00 20.91 C ATOM 441 SG CYS A 59 23.977 -18.131 10.688 1.00 22.21 S ATOM 0 H CYS A 59 25.151 -20.875 9.862 1.00 10.71 H new ATOM 0 HA CYS A 59 26.238 -18.729 8.819 1.00 19.32 H new ATOM 0 HB2 CYS A 59 25.812 -19.199 11.629 1.00 20.91 H new ATOM 0 HB3 CYS A 59 26.244 -17.807 11.072 1.00 20.91 H new ATOM 0 HG CYS A 59 23.816 -17.018 11.107 1.00 22.21 H new ATOM 442 N LEU A 60 28.194 -20.605 10.327 1.00 12.85 N ATOM 443 CA LEU A 60 29.552 -20.930 10.668 1.00 12.15 C ATOM 444 C LEU A 60 30.463 -20.879 9.449 1.00 23.45 C ATOM 445 O LEU A 60 30.349 -21.716 8.549 1.00 25.94 O ATOM 446 CB LEU A 60 29.493 -22.290 11.382 1.00 14.71 C ATOM 447 CG LEU A 60 30.812 -22.708 12.017 1.00 27.99 C ATOM 448 CD1 LEU A 60 31.517 -21.495 12.618 1.00 25.92 C ATOM 449 CD2 LEU A 60 30.529 -23.751 13.093 1.00 37.21 C ATOM 0 H LEU A 60 27.632 -21.224 10.530 1.00 12.85 H new ATOM 0 HA LEU A 60 29.953 -20.279 11.265 1.00 12.15 H new ATOM 0 HB2 LEU A 60 28.809 -22.256 12.069 1.00 14.71 H new ATOM 0 HB3 LEU A 60 29.221 -22.969 10.745 1.00 14.71 H new ATOM 0 HG LEU A 60 31.396 -23.089 11.342 1.00 27.99 H new ATOM 0 HD11 LEU A 60 32.355 -21.773 13.019 1.00 25.92 H new ATOM 0 HD12 LEU A 60 31.693 -20.844 11.920 1.00 25.92 H new ATOM 0 HD13 LEU A 60 30.951 -21.095 13.297 1.00 25.92 H new ATOM 0 HD21 LEU A 60 31.363 -24.025 13.505 1.00 37.21 H new ATOM 0 HD22 LEU A 60 29.945 -23.370 13.768 1.00 37.21 H new ATOM 0 HD23 LEU A 60 30.098 -24.522 12.691 1.00 37.21 H new ATOM 450 N GLY A 61 31.317 -19.860 9.373 1.00 17.91 N ATOM 451 CA GLY A 61 32.217 -19.737 8.236 1.00 19.28 C ATOM 452 C GLY A 61 31.698 -18.921 7.050 1.00 23.22 C ATOM 453 O GLY A 61 32.448 -18.656 6.111 1.00 25.22 O ATOM 0 H GLY A 61 31.389 -19.238 9.963 1.00 17.91 H new ATOM 0 HA2 GLY A 61 33.044 -19.335 8.544 1.00 19.28 H new ATOM 0 HA3 GLY A 61 32.434 -20.628 7.921 1.00 19.28 H new ATOM 454 N TYR A 62 30.418 -18.540 7.082 1.00 16.64 N ATOM 455 CA TYR A 62 29.818 -17.758 5.990 1.00 12.88 C ATOM 456 C TYR A 62 30.492 -16.402 5.935 1.00 16.56 C ATOM 457 O TYR A 62 30.414 -15.615 6.869 1.00 17.98 O ATOM 458 CB TYR A 62 28.322 -17.657 6.277 1.00 12.57 C ATOM 459 CG TYR A 62 27.558 -16.985 5.172 1.00 20.95 C ATOM 460 CD1 TYR A 62 27.289 -17.682 3.995 1.00 27.95 C ATOM 461 CD2 TYR A 62 27.071 -15.684 5.299 1.00 25.20 C ATOM 462 CE1 TYR A 62 26.551 -17.111 2.959 1.00 26.31 C ATOM 463 CE2 TYR A 62 26.327 -15.099 4.268 1.00 26.79 C ATOM 464 CZ TYR A 62 26.069 -15.810 3.093 1.00 32.04 C ATOM 465 OH TYR A 62 25.322 -15.255 2.061 1.00 42.93 O ATOM 0 H TYR A 62 29.878 -18.723 7.726 1.00 16.64 H new ATOM 0 HA TYR A 62 29.941 -18.175 5.123 1.00 12.88 H new ATOM 0 HB2 TYR A 62 27.963 -18.547 6.417 1.00 12.57 H new ATOM 0 HB3 TYR A 62 28.188 -17.165 7.102 1.00 12.57 H new ATOM 0 HD1 TYR A 62 27.610 -18.550 3.898 1.00 27.95 H new ATOM 0 HD2 TYR A 62 27.242 -15.201 6.075 1.00 25.20 H new ATOM 0 HE1 TYR A 62 26.381 -17.595 2.183 1.00 26.31 H new ATOM 0 HE2 TYR A 62 26.003 -14.233 4.365 1.00 26.79 H new ATOM 0 HH TYR A 62 24.548 -15.080 2.337 1.00 42.93 H new ATOM 466 N HIS A 63 31.212 -16.112 4.855 1.00 20.80 N ATOM 467 CA HIS A 63 31.965 -14.858 4.782 1.00 20.99 C ATOM 468 C HIS A 63 32.875 -14.717 6.011 1.00 25.72 C ATOM 469 O HIS A 63 33.222 -13.608 6.415 1.00 22.39 O ATOM 470 CB HIS A 63 31.098 -13.572 4.589 1.00 24.09 C ATOM 471 CG HIS A 63 30.365 -13.620 3.297 1.00 28.58 C ATOM 472 ND1 HIS A 63 30.966 -13.239 2.119 1.00 36.52 N ATOM 473 CD2 HIS A 63 29.116 -14.046 3.022 1.00 32.15 C ATOM 474 CE1 HIS A 63 30.068 -13.429 1.165 1.00 35.27 C ATOM 475 NE2 HIS A 63 28.955 -13.927 1.675 1.00 33.63 N ATOM 0 H HIS A 63 31.279 -16.617 4.162 1.00 20.80 H new ATOM 0 HA HIS A 63 32.496 -14.923 3.973 1.00 20.99 H new ATOM 0 HB2 HIS A 63 30.467 -13.489 5.321 1.00 24.09 H new ATOM 0 HB3 HIS A 63 31.667 -12.786 4.614 1.00 24.09 H new ATOM 0 HD2 HIS A 63 28.488 -14.359 3.632 1.00 32.15 H new ATOM 0 HE1 HIS A 63 30.201 -13.239 0.264 1.00 35.27 H new ATOM 0 HE2 HIS A 63 28.249 -14.140 1.232 1.00 33.63 H new ATOM 476 N GLY A 64 33.249 -15.842 6.638 1.00 20.14 N ATOM 477 CA GLY A 64 34.110 -15.754 7.805 1.00 18.85 C ATOM 478 C GLY A 64 33.381 -15.644 9.150 1.00 21.51 C ATOM 479 O GLY A 64 34.007 -15.626 10.210 1.00 16.34 O ATOM 0 H GLY A 64 33.019 -16.638 6.406 1.00 20.14 H new ATOM 0 HA2 GLY A 64 34.682 -16.537 7.827 1.00 18.85 H new ATOM 0 HA3 GLY A 64 34.689 -14.983 7.704 1.00 18.85 H new ATOM 480 N TYR A 65 32.063 -15.601 9.138 1.00 14.90 N ATOM 481 CA TYR A 65 31.317 -15.528 10.408 1.00 17.42 C ATOM 482 C TYR A 65 31.795 -16.672 11.302 1.00 18.33 C ATOM 483 O TYR A 65 31.806 -17.866 10.927 1.00 17.75 O ATOM 484 CB TYR A 65 29.784 -15.523 10.181 1.00 16.68 C ATOM 485 CG TYR A 65 29.003 -15.270 11.455 1.00 14.81 C ATOM 486 CD1 TYR A 65 28.766 -13.964 11.880 1.00 13.76 C ATOM 487 CD2 TYR A 65 28.499 -16.330 12.217 1.00 15.24 C ATOM 488 CE1 TYR A 65 28.063 -13.700 13.059 1.00 14.05 C ATOM 489 CE2 TYR A 65 27.787 -16.096 13.395 1.00 12.20 C ATOM 490 CZ TYR A 65 27.580 -14.775 13.807 1.00 14.34 C ATOM 491 OH TYR A 65 26.868 -14.521 14.938 1.00 16.46 O ATOM 0 H TYR A 65 31.578 -15.612 8.428 1.00 14.90 H new ATOM 0 HA TYR A 65 31.498 -14.687 10.856 1.00 17.42 H new ATOM 0 HB2 TYR A 65 29.560 -14.841 9.528 1.00 16.68 H new ATOM 0 HB3 TYR A 65 29.514 -16.375 9.805 1.00 16.68 H new ATOM 0 HD1 TYR A 65 29.082 -13.254 11.369 1.00 13.76 H new ATOM 0 HD2 TYR A 65 28.641 -17.205 11.934 1.00 15.24 H new ATOM 0 HE1 TYR A 65 27.920 -12.825 13.340 1.00 14.05 H new ATOM 0 HE2 TYR A 65 27.456 -16.806 13.897 1.00 12.20 H new ATOM 0 HH TYR A 65 26.433 -15.206 15.156 1.00 16.46 H new ATOM 492 N PRO A 66 32.227 -16.297 12.498 1.00 17.43 N ATOM 493 CA PRO A 66 32.833 -17.236 13.420 1.00 17.16 C ATOM 494 C PRO A 66 31.951 -18.117 14.292 1.00 21.72 C ATOM 495 O PRO A 66 32.482 -19.014 14.940 1.00 18.32 O ATOM 496 CB PRO A 66 33.656 -16.352 14.355 1.00 19.89 C ATOM 497 CG PRO A 66 32.884 -15.044 14.419 1.00 22.32 C ATOM 498 CD PRO A 66 32.103 -14.946 13.110 1.00 17.49 C ATOM 0 HA PRO A 66 33.294 -17.887 12.868 1.00 17.16 H new ATOM 0 HB2 PRO A 66 33.745 -16.753 15.234 1.00 19.89 H new ATOM 0 HB3 PRO A 66 34.554 -16.216 14.013 1.00 19.89 H new ATOM 0 HG2 PRO A 66 32.285 -15.032 15.182 1.00 22.32 H new ATOM 0 HG3 PRO A 66 33.487 -14.291 14.520 1.00 22.32 H new ATOM 0 HD2 PRO A 66 31.175 -14.715 13.269 1.00 17.49 H new ATOM 0 HD3 PRO A 66 32.471 -14.261 12.530 1.00 17.49 H new ATOM 499 N LYS A 67 30.650 -17.868 14.362 1.00 13.61 N ATOM 500 CA LYS A 67 29.794 -18.639 15.262 1.00 14.30 C ATOM 501 C LYS A 67 28.667 -19.357 14.538 1.00 16.31 C ATOM 502 O LYS A 67 28.527 -19.254 13.333 1.00 18.12 O ATOM 503 CB LYS A 67 29.178 -17.729 16.331 1.00 13.92 C ATOM 504 CG LYS A 67 30.207 -17.079 17.225 1.00 15.07 C ATOM 505 CD LYS A 67 30.857 -18.164 18.063 1.00 15.41 C ATOM 506 CE LYS A 67 31.904 -17.674 19.038 1.00 22.72 C ATOM 507 NZ LYS A 67 32.334 -18.772 19.939 1.00 29.78 N ATOM 0 H LYS A 67 30.244 -17.264 13.903 1.00 13.61 H new ATOM 0 HA LYS A 67 30.368 -19.307 15.668 1.00 14.30 H new ATOM 0 HB2 LYS A 67 28.654 -17.038 15.896 1.00 13.92 H new ATOM 0 HB3 LYS A 67 28.567 -18.248 16.876 1.00 13.92 H new ATOM 0 HG2 LYS A 67 30.874 -16.617 16.693 1.00 15.07 H new ATOM 0 HG3 LYS A 67 29.789 -16.415 17.796 1.00 15.07 H new ATOM 0 HD2 LYS A 67 30.165 -18.630 18.558 1.00 15.41 H new ATOM 0 HD3 LYS A 67 31.266 -18.812 17.469 1.00 15.41 H new ATOM 0 HE2 LYS A 67 32.669 -17.329 18.552 1.00 22.72 H new ATOM 0 HE3 LYS A 67 31.547 -16.940 19.562 1.00 22.72 H new ATOM 0 HZ1 LYS A 67 32.883 -18.449 20.560 1.00 29.78 H new ATOM 0 HZ2 LYS A 67 31.620 -19.131 20.332 1.00 29.78 H new ATOM 0 HZ3 LYS A 67 32.757 -19.396 19.466 1.00 29.78 H new ATOM 508 N SER A 68 27.841 -20.065 15.304 1.00 8.35 N ATOM 509 CA SER A 68 26.773 -20.826 14.684 1.00 7.70 C ATOM 510 C SER A 68 25.443 -20.136 14.505 1.00 22.82 C ATOM 511 O SER A 68 24.687 -20.529 13.627 1.00 19.23 O ATOM 512 CB SER A 68 26.542 -22.143 15.406 1.00 12.85 C ATOM 513 OG SER A 68 27.609 -22.988 15.061 1.00 41.62 O ATOM 0 H SER A 68 27.882 -20.116 16.162 1.00 8.35 H new ATOM 0 HA SER A 68 27.114 -20.958 13.785 1.00 7.70 H new ATOM 0 HB2 SER A 68 26.507 -22.007 16.366 1.00 12.85 H new ATOM 0 HB3 SER A 68 25.694 -22.535 15.144 1.00 12.85 H new ATOM 0 HG SER A 68 28.238 -22.883 15.608 1.00 41.62 H new ATOM 514 N VAL A 69 25.131 -19.177 15.371 1.00 14.42 N ATOM 515 CA VAL A 69 23.881 -18.429 15.332 1.00 8.28 C ATOM 516 C VAL A 69 24.218 -16.960 15.573 1.00 12.22 C ATOM 517 O VAL A 69 25.359 -16.595 15.935 1.00 12.17 O ATOM 518 CB VAL A 69 22.851 -18.954 16.394 1.00 14.84 C ATOM 519 CG1 VAL A 69 22.435 -20.435 16.196 1.00 9.63 C ATOM 520 CG2 VAL A 69 23.383 -18.826 17.815 1.00 12.40 C ATOM 0 H VAL A 69 25.653 -18.938 16.012 1.00 14.42 H new ATOM 0 HA VAL A 69 23.457 -18.544 14.467 1.00 8.28 H new ATOM 0 HB VAL A 69 22.074 -18.389 16.258 1.00 14.84 H new ATOM 0 HG11 VAL A 69 21.801 -20.688 16.885 1.00 9.63 H new ATOM 0 HG12 VAL A 69 22.024 -20.542 15.324 1.00 9.63 H new ATOM 0 HG13 VAL A 69 23.219 -21.002 16.255 1.00 9.63 H new ATOM 0 HG21 VAL A 69 22.720 -19.159 18.440 1.00 12.40 H new ATOM 0 HG22 VAL A 69 24.199 -19.343 17.903 1.00 12.40 H new ATOM 0 HG23 VAL A 69 23.569 -17.894 18.008 1.00 12.40 H new ATOM 521 N CYS A 70 23.230 -16.098 15.377 1.00 7.35 N ATOM 522 CA CYS A 70 23.408 -14.680 15.652 1.00 10.48 C ATOM 523 C CYS A 70 22.522 -14.344 16.823 1.00 17.10 C ATOM 524 O CYS A 70 21.332 -14.687 16.836 1.00 13.43 O ATOM 525 CB CYS A 70 22.977 -13.769 14.507 1.00 14.91 C ATOM 526 SG CYS A 70 23.958 -14.029 13.016 1.00 20.04 S ATOM 0 H CYS A 70 22.450 -16.313 15.086 1.00 7.35 H new ATOM 0 HA CYS A 70 24.354 -14.533 15.807 1.00 10.48 H new ATOM 0 HB2 CYS A 70 22.041 -13.926 14.307 1.00 14.91 H new ATOM 0 HB3 CYS A 70 23.056 -12.843 14.786 1.00 14.91 H new ATOM 0 HG CYS A 70 25.091 -14.279 13.321 1.00 20.04 H new ATOM 527 N ILE A 71 23.087 -13.647 17.798 1.00 11.33 N ATOM 528 CA ILE A 71 22.312 -13.282 18.983 1.00 11.86 C ATOM 529 C ILE A 71 22.429 -11.781 19.183 1.00 14.93 C ATOM 530 O ILE A 71 23.512 -11.303 19.452 1.00 13.90 O ATOM 531 CB ILE A 71 22.798 -14.056 20.211 1.00 10.90 C ATOM 532 CG1 ILE A 71 22.567 -15.556 19.968 1.00 13.46 C ATOM 533 CG2 ILE A 71 21.958 -13.622 21.419 1.00 7.18 C ATOM 534 CD1 ILE A 71 23.150 -16.487 21.037 1.00 12.39 C ATOM 0 H ILE A 71 23.904 -13.378 17.798 1.00 11.33 H new ATOM 0 HA ILE A 71 21.379 -13.517 18.858 1.00 11.86 H new ATOM 0 HB ILE A 71 23.739 -13.882 20.371 1.00 10.90 H new ATOM 0 HG12 ILE A 71 21.612 -15.716 19.906 1.00 13.46 H new ATOM 0 HG13 ILE A 71 22.951 -15.793 19.109 1.00 13.46 H new ATOM 0 HG21 ILE A 71 22.253 -14.103 22.208 1.00 7.18 H new ATOM 0 HG22 ILE A 71 22.066 -12.669 21.563 1.00 7.18 H new ATOM 0 HG23 ILE A 71 21.023 -13.819 21.251 1.00 7.18 H new ATOM 0 HD11 ILE A 71 22.958 -17.409 20.803 1.00 12.39 H new ATOM 0 HD12 ILE A 71 24.110 -16.360 21.088 1.00 12.39 H new ATOM 0 HD13 ILE A 71 22.751 -16.282 21.897 1.00 12.39 H new ATOM 535 N SER A 72 21.338 -11.054 19.036 1.00 7.84 N ATOM 536 CA SER A 72 21.390 -9.619 19.150 1.00 10.57 C ATOM 537 C SER A 72 20.606 -9.120 20.349 1.00 19.50 C ATOM 538 O SER A 72 19.412 -9.275 20.389 1.00 14.53 O ATOM 539 CB SER A 72 20.881 -8.937 17.873 1.00 10.61 C ATOM 540 OG SER A 72 21.333 -9.676 16.738 1.00 12.61 O ATOM 0 H SER A 72 20.558 -11.376 18.870 1.00 7.84 H new ATOM 0 HA SER A 72 22.322 -9.384 19.277 1.00 10.57 H new ATOM 0 HB2 SER A 72 19.912 -8.894 17.880 1.00 10.61 H new ATOM 0 HB3 SER A 72 21.205 -8.024 17.829 1.00 10.61 H new ATOM 0 HG SER A 72 20.804 -10.311 16.588 1.00 12.61 H new ATOM 541 N ILE A 73 21.304 -8.455 21.279 1.00 12.79 N ATOM 542 CA ILE A 73 20.686 -7.934 22.464 1.00 12.66 C ATOM 543 C ILE A 73 20.388 -6.459 22.405 1.00 10.33 C ATOM 544 O ILE A 73 21.240 -5.692 21.971 1.00 15.23 O ATOM 545 CB ILE A 73 21.608 -8.186 23.652 1.00 17.97 C ATOM 546 CG1 ILE A 73 21.866 -9.664 23.841 1.00 17.85 C ATOM 547 CG2 ILE A 73 20.956 -7.695 24.943 1.00 12.06 C ATOM 548 CD1 ILE A 73 23.123 -9.884 24.673 1.00 32.04 C ATOM 0 H ILE A 73 22.149 -8.302 21.225 1.00 12.79 H new ATOM 0 HA ILE A 73 19.835 -8.392 22.551 1.00 12.66 H new ATOM 0 HB ILE A 73 22.436 -7.714 23.468 1.00 17.97 H new ATOM 0 HG12 ILE A 73 21.105 -10.077 24.279 1.00 17.85 H new ATOM 0 HG13 ILE A 73 21.964 -10.094 22.977 1.00 17.85 H new ATOM 0 HG21 ILE A 73 21.552 -7.861 25.690 1.00 12.06 H new ATOM 0 HG22 ILE A 73 20.780 -6.743 24.875 1.00 12.06 H new ATOM 0 HG23 ILE A 73 20.121 -8.168 25.085 1.00 12.06 H new ATOM 0 HD11 ILE A 73 23.275 -10.835 24.785 1.00 32.04 H new ATOM 0 HD12 ILE A 73 23.884 -9.487 24.221 1.00 32.04 H new ATOM 0 HD13 ILE A 73 23.012 -9.470 25.543 1.00 32.04 H new ATOM 549 N ASN A 74 19.173 -6.090 22.842 1.00 7.53 N ATOM 550 CA ASN A 74 18.718 -4.712 22.990 1.00 8.98 C ATOM 551 C ASN A 74 18.920 -3.829 21.758 1.00 15.91 C ATOM 552 O ASN A 74 18.220 -3.969 20.760 1.00 18.17 O ATOM 553 CB ASN A 74 19.389 -4.061 24.231 1.00 11.39 C ATOM 554 CG ASN A 74 18.912 -4.705 25.539 1.00 24.37 C ATOM 555 OD1 ASN A 74 17.807 -5.251 25.612 1.00 14.73 O ATOM 556 ND2 ASN A 74 19.753 -4.735 26.570 1.00 15.52 N ATOM 0 H ASN A 74 18.574 -6.664 23.067 1.00 7.53 H new ATOM 0 HA ASN A 74 17.757 -4.769 23.109 1.00 8.98 H new ATOM 0 HB2 ASN A 74 20.353 -4.147 24.160 1.00 11.39 H new ATOM 0 HB3 ASN A 74 19.190 -3.112 24.246 1.00 11.39 H new ATOM 0 HD21 ASN A 74 19.529 -5.137 27.296 1.00 15.52 H new ATOM 0 HD22 ASN A 74 20.521 -4.352 26.510 1.00 15.52 H new ATOM 557 N GLU A 75 19.867 -2.893 21.856 1.00 11.58 N ATOM 558 CA GLU A 75 20.174 -1.964 20.764 1.00 13.33 C ATOM 559 C GLU A 75 20.881 -2.636 19.552 1.00 18.46 C ATOM 560 O GLU A 75 21.003 -2.077 18.467 1.00 14.70 O ATOM 561 CB GLU A 75 20.879 -0.693 21.260 1.00 15.25 C ATOM 562 CG GLU A 75 22.395 -0.850 21.503 1.00 16.14 C ATOM 563 CD GLU A 75 22.756 -1.582 22.757 1.00 35.85 C ATOM 564 OE1 GLU A 75 23.849 -2.069 22.913 1.00 60.15 O ATOM 565 OE2 GLU A 75 21.801 -1.627 23.658 1.00 28.16 O ATOM 0 H GLU A 75 20.350 -2.779 22.558 1.00 11.58 H new ATOM 0 HA GLU A 75 19.317 -1.675 20.413 1.00 13.33 H new ATOM 0 HB2 GLU A 75 20.739 0.014 20.611 1.00 15.25 H new ATOM 0 HB3 GLU A 75 20.459 -0.406 22.086 1.00 15.25 H new ATOM 0 HG2 GLU A 75 22.784 -1.317 20.747 1.00 16.14 H new ATOM 0 HG3 GLU A 75 22.799 0.032 21.530 1.00 16.14 H new ATOM 566 N VAL A 76 21.346 -3.870 19.708 1.00 11.88 N ATOM 567 CA VAL A 76 21.927 -4.528 18.564 1.00 13.66 C ATOM 568 C VAL A 76 20.763 -4.863 17.638 1.00 16.34 C ATOM 569 O VAL A 76 19.802 -5.523 18.071 1.00 13.99 O ATOM 570 CB VAL A 76 22.608 -5.839 18.911 1.00 16.64 C ATOM 571 CG1 VAL A 76 23.122 -6.490 17.623 1.00 15.36 C ATOM 572 CG2 VAL A 76 23.752 -5.572 19.862 1.00 19.86 C ATOM 0 H VAL A 76 21.334 -4.323 20.439 1.00 11.88 H new ATOM 0 HA VAL A 76 22.597 -3.943 18.177 1.00 13.66 H new ATOM 0 HB VAL A 76 21.980 -6.440 19.341 1.00 16.64 H new ATOM 0 HG11 VAL A 76 23.559 -7.329 17.836 1.00 15.36 H new ATOM 0 HG12 VAL A 76 22.377 -6.657 17.025 1.00 15.36 H new ATOM 0 HG13 VAL A 76 23.756 -5.897 17.191 1.00 15.36 H new ATOM 0 HG21 VAL A 76 24.189 -6.409 20.086 1.00 19.86 H new ATOM 0 HG22 VAL A 76 24.391 -4.976 19.441 1.00 19.86 H new ATOM 0 HG23 VAL A 76 23.411 -5.160 20.671 1.00 19.86 H new ATOM 573 N VAL A 77 20.889 -4.402 16.395 1.00 15.03 N ATOM 574 CA VAL A 77 19.886 -4.583 15.346 1.00 17.91 C ATOM 575 C VAL A 77 19.816 -5.999 14.825 1.00 16.12 C ATOM 576 O VAL A 77 18.735 -6.631 14.822 1.00 17.84 O ATOM 577 CB VAL A 77 20.026 -3.571 14.196 1.00 16.74 C ATOM 578 CG1 VAL A 77 18.990 -3.809 13.060 1.00 10.67 C ATOM 579 CG2 VAL A 77 19.883 -2.170 14.769 1.00 18.64 C ATOM 0 H VAL A 77 21.580 -3.963 16.131 1.00 15.03 H new ATOM 0 HA VAL A 77 19.038 -4.402 15.782 1.00 17.91 H new ATOM 0 HB VAL A 77 20.900 -3.685 13.791 1.00 16.74 H new ATOM 0 HG11 VAL A 77 19.118 -3.149 12.361 1.00 10.67 H new ATOM 0 HG12 VAL A 77 19.113 -4.698 12.691 1.00 10.67 H new ATOM 0 HG13 VAL A 77 18.092 -3.729 13.419 1.00 10.67 H new ATOM 0 HG21 VAL A 77 19.969 -1.518 14.056 1.00 18.64 H new ATOM 0 HG22 VAL A 77 19.013 -2.078 15.187 1.00 18.64 H new ATOM 0 HG23 VAL A 77 20.576 -2.018 15.430 1.00 18.64 H new ATOM 580 N CYS A 78 20.975 -6.448 14.361 1.00 12.10 N ATOM 581 CA CYS A 78 21.090 -7.790 13.841 1.00 12.80 C ATOM 582 C CYS A 78 22.527 -8.190 13.805 1.00 17.15 C ATOM 583 O CYS A 78 23.416 -7.356 13.969 1.00 14.78 O ATOM 584 CB CYS A 78 20.532 -7.886 12.410 1.00 13.91 C ATOM 585 SG CYS A 78 21.363 -6.773 11.227 1.00 21.01 S ATOM 0 H CYS A 78 21.702 -5.989 14.341 1.00 12.10 H new ATOM 0 HA CYS A 78 20.580 -8.376 14.422 1.00 12.80 H new ATOM 0 HB2 CYS A 78 20.618 -8.800 12.098 1.00 13.91 H new ATOM 0 HB3 CYS A 78 19.584 -7.680 12.426 1.00 13.91 H new ATOM 0 HG CYS A 78 20.875 -6.908 10.139 1.00 21.01 H new ATOM 586 N HIS A 79 22.728 -9.484 13.550 1.00 16.50 N ATOM 587 CA HIS A 79 24.056 -10.042 13.394 1.00 15.65 C ATOM 588 C HIS A 79 24.962 -10.003 14.593 1.00 21.82 C ATOM 589 O HIS A 79 26.177 -10.093 14.380 1.00 15.23 O ATOM 590 CB HIS A 79 24.767 -9.488 12.142 1.00 15.99 C ATOM 591 CG HIS A 79 23.869 -9.751 10.985 1.00 20.78 C ATOM 592 ND1 HIS A 79 24.055 -9.172 9.740 1.00 23.71 N ATOM 593 CD2 HIS A 79 22.758 -10.553 10.927 1.00 19.98 C ATOM 594 CE1 HIS A 79 23.070 -9.642 8.957 1.00 20.67 C ATOM 595 NE2 HIS A 79 22.268 -10.459 9.644 1.00 16.63 N ATOM 0 H HIS A 79 22.093 -10.057 13.464 1.00 16.50 H new ATOM 0 HA HIS A 79 23.875 -10.988 13.279 1.00 15.65 H new ATOM 0 HB2 HIS A 79 24.938 -8.538 12.236 1.00 15.99 H new ATOM 0 HB3 HIS A 79 25.626 -9.920 12.015 1.00 15.99 H new ATOM 0 HD2 HIS A 79 22.404 -11.062 11.620 1.00 19.98 H new ATOM 0 HE1 HIS A 79 22.961 -9.428 8.059 1.00 20.67 H new ATOM 0 HE2 HIS A 79 21.569 -10.856 9.339 1.00 16.63 H new ATOM 596 N GLY A 80 24.381 -9.895 15.810 1.00 16.15 N ATOM 597 CA GLY A 80 25.215 -9.867 16.997 1.00 11.81 C ATOM 598 C GLY A 80 25.989 -11.188 17.101 1.00 14.38 C ATOM 599 O GLY A 80 25.466 -12.285 16.917 1.00 14.63 O ATOM 0 H GLY A 80 23.534 -9.839 15.951 1.00 16.15 H new ATOM 0 HA2 GLY A 80 25.833 -9.120 16.954 1.00 11.81 H new ATOM 0 HA3 GLY A 80 24.668 -9.737 17.787 1.00 11.81 H new ATOM 600 N ILE A 81 27.259 -11.097 17.438 1.00 13.91 N ATOM 601 CA ILE A 81 28.109 -12.267 17.582 1.00 9.64 C ATOM 602 C ILE A 81 28.106 -12.837 18.998 1.00 14.92 C ATOM 603 O ILE A 81 28.423 -12.123 19.945 1.00 17.07 O ATOM 604 CB ILE A 81 29.534 -11.868 17.221 1.00 17.55 C ATOM 605 CG1 ILE A 81 29.568 -11.374 15.779 1.00 16.63 C ATOM 606 CG2 ILE A 81 30.467 -13.064 17.360 1.00 18.48 C ATOM 607 CD1 ILE A 81 30.961 -10.948 15.368 1.00 18.42 C ATOM 0 H ILE A 81 27.659 -10.351 17.592 1.00 13.91 H new ATOM 0 HA ILE A 81 27.762 -12.956 16.994 1.00 9.64 H new ATOM 0 HB ILE A 81 29.826 -11.165 17.822 1.00 17.55 H new ATOM 0 HG12 ILE A 81 29.256 -12.077 15.188 1.00 16.63 H new ATOM 0 HG13 ILE A 81 28.957 -10.627 15.678 1.00 16.63 H new ATOM 0 HG21 ILE A 81 31.371 -12.798 17.128 1.00 18.48 H new ATOM 0 HG22 ILE A 81 30.450 -13.384 18.276 1.00 18.48 H new ATOM 0 HG23 ILE A 81 30.176 -13.773 16.765 1.00 18.48 H new ATOM 0 HD11 ILE A 81 30.947 -10.640 14.448 1.00 18.42 H new ATOM 0 HD12 ILE A 81 31.263 -10.229 15.945 1.00 18.42 H new ATOM 0 HD13 ILE A 81 31.567 -11.702 15.447 1.00 18.42 H new ATOM 608 N PRO A 82 27.755 -14.124 19.159 1.00 16.20 N ATOM 609 CA PRO A 82 27.742 -14.677 20.506 1.00 13.05 C ATOM 610 C PRO A 82 29.108 -14.513 21.194 1.00 22.10 C ATOM 611 O PRO A 82 30.148 -14.545 20.559 1.00 18.32 O ATOM 612 CB PRO A 82 27.356 -16.152 20.354 1.00 12.51 C ATOM 613 CG PRO A 82 26.604 -16.239 19.031 1.00 21.47 C ATOM 614 CD PRO A 82 27.031 -15.043 18.201 1.00 13.73 C ATOM 0 HA PRO A 82 27.109 -14.209 21.073 1.00 13.05 H new ATOM 0 HB2 PRO A 82 28.142 -16.720 20.347 1.00 12.51 H new ATOM 0 HB3 PRO A 82 26.800 -16.446 21.092 1.00 12.51 H new ATOM 0 HG2 PRO A 82 26.812 -17.068 18.572 1.00 21.47 H new ATOM 0 HG3 PRO A 82 25.645 -16.230 19.179 1.00 21.47 H new ATOM 0 HD2 PRO A 82 27.610 -15.313 17.471 1.00 13.73 H new ATOM 0 HD3 PRO A 82 26.264 -14.601 17.805 1.00 13.73 H new ATOM 615 N ASP A 83 29.123 -14.367 22.510 1.00 16.45 N ATOM 616 CA ASP A 83 30.370 -14.160 23.200 1.00 19.70 C ATOM 617 C ASP A 83 30.210 -14.630 24.620 1.00 21.62 C ATOM 618 O ASP A 83 29.182 -14.357 25.248 1.00 18.99 O ATOM 619 CB ASP A 83 30.606 -12.622 23.152 1.00 24.21 C ATOM 620 CG ASP A 83 31.821 -12.066 23.854 1.00 43.76 C ATOM 621 OD1 ASP A 83 32.305 -12.552 24.853 1.00 31.90 O ATOM 622 OD2 ASP A 83 32.280 -10.974 23.286 1.00 81.33 O ATOM 0 H ASP A 83 28.426 -14.385 23.013 1.00 16.45 H new ATOM 0 HA ASP A 83 31.114 -14.642 22.807 1.00 19.70 H new ATOM 0 HB2 ASP A 83 30.656 -12.359 22.220 1.00 24.21 H new ATOM 0 HB3 ASP A 83 29.823 -12.190 23.528 1.00 24.21 H new ATOM 623 N ASP A 84 31.235 -15.319 25.112 1.00 20.58 N ATOM 624 CA ASP A 84 31.255 -15.861 26.478 1.00 21.78 C ATOM 625 C ASP A 84 31.154 -14.787 27.554 1.00 24.37 C ATOM 626 O ASP A 84 30.675 -15.034 28.644 1.00 27.10 O ATOM 627 CB ASP A 84 32.488 -16.766 26.724 1.00 22.83 C ATOM 628 CG ASP A 84 32.358 -18.114 26.065 1.00 50.71 C ATOM 629 OD1 ASP A 84 31.295 -18.573 25.688 1.00 45.85 O ATOM 630 OD2 ASP A 84 33.506 -18.733 25.923 1.00 78.98 O ATOM 0 H ASP A 84 31.948 -15.489 24.662 1.00 20.58 H new ATOM 0 HA ASP A 84 30.456 -16.407 26.550 1.00 21.78 H new ATOM 0 HB2 ASP A 84 33.283 -16.322 26.390 1.00 22.83 H new ATOM 0 HB3 ASP A 84 32.611 -16.887 27.679 1.00 22.83 H new ATOM 631 N ALA A 85 31.582 -13.587 27.208 1.00 30.47 N ATOM 632 CA ALA A 85 31.595 -12.424 28.081 1.00 33.83 C ATOM 633 C ALA A 85 30.277 -11.667 28.182 1.00 38.16 C ATOM 634 O ALA A 85 30.091 -10.901 29.139 1.00 37.45 O ATOM 635 CB ALA A 85 32.672 -11.455 27.590 1.00 33.65 C ATOM 0 H ALA A 85 31.887 -13.418 26.422 1.00 30.47 H new ATOM 0 HA ALA A 85 31.772 -12.768 28.970 1.00 33.83 H new ATOM 0 HB1 ALA A 85 32.691 -10.674 28.165 1.00 33.65 H new ATOM 0 HB2 ALA A 85 33.537 -11.894 27.613 1.00 33.65 H new ATOM 0 HB3 ALA A 85 32.472 -11.182 26.681 1.00 33.65 H new ATOM 636 N LYS A 86 29.388 -11.830 27.184 1.00 25.09 N ATOM 637 CA LYS A 86 28.101 -11.143 27.176 1.00 23.32 C ATOM 638 C LYS A 86 27.010 -11.906 27.949 1.00 20.38 C ATOM 639 O LYS A 86 26.472 -12.898 27.465 1.00 17.28 O ATOM 640 CB LYS A 86 27.658 -10.757 25.768 1.00 25.59 C ATOM 641 CG LYS A 86 26.633 -9.641 25.833 1.00 26.68 C ATOM 0 H LYS A 86 29.521 -12.339 26.503 1.00 25.09 H new ATOM 0 HA LYS A 86 28.237 -10.313 27.659 1.00 23.32 H new ATOM 0 HB2 LYS A 86 28.425 -10.472 25.247 1.00 25.59 H new ATOM 0 HB3 LYS A 86 27.279 -11.528 25.317 1.00 25.59 H new ATOM 642 N LEU A 87 26.717 -11.444 29.170 1.00 16.54 N ATOM 643 CA LEU A 87 25.716 -12.064 30.040 1.00 19.14 C ATOM 644 C LEU A 87 24.374 -11.337 29.947 1.00 20.53 C ATOM 645 O LEU A 87 24.307 -10.098 29.871 1.00 17.54 O ATOM 646 CB LEU A 87 26.147 -12.132 31.540 1.00 22.51 C ATOM 647 CG LEU A 87 27.333 -13.041 31.875 1.00 25.01 C ATOM 0 H LEU A 87 27.098 -10.756 29.517 1.00 16.54 H new ATOM 0 HA LEU A 87 25.629 -12.974 29.715 1.00 19.14 H new ATOM 0 HB2 LEU A 87 26.362 -11.233 31.834 1.00 22.51 H new ATOM 0 HB3 LEU A 87 25.384 -12.426 32.061 1.00 22.51 H new ATOM 648 N LEU A 88 23.299 -12.135 29.967 1.00 18.94 N ATOM 649 CA LEU A 88 21.943 -11.604 29.905 1.00 15.49 C ATOM 650 C LEU A 88 21.499 -11.137 31.277 1.00 15.56 C ATOM 651 O LEU A 88 21.890 -11.743 32.284 1.00 16.41 O ATOM 652 CB LEU A 88 20.957 -12.662 29.376 1.00 13.96 C ATOM 653 CG LEU A 88 21.396 -13.287 28.058 1.00 19.80 C ATOM 654 CD1 LEU A 88 20.309 -14.269 27.607 1.00 13.81 C ATOM 655 CD2 LEU A 88 21.618 -12.195 27.027 1.00 25.61 C ATOM 0 H LEU A 88 23.341 -12.993 30.017 1.00 18.94 H new ATOM 0 HA LEU A 88 21.946 -10.851 29.293 1.00 15.49 H new ATOM 0 HB2 LEU A 88 20.855 -13.361 30.040 1.00 13.96 H new ATOM 0 HB3 LEU A 88 20.085 -12.253 29.259 1.00 13.96 H new ATOM 0 HG LEU A 88 22.232 -13.767 28.164 1.00 19.80 H new ATOM 0 HD11 LEU A 88 20.571 -14.678 26.767 1.00 13.81 H new ATOM 0 HD12 LEU A 88 20.195 -14.958 28.280 1.00 13.81 H new ATOM 0 HD13 LEU A 88 19.472 -13.793 27.487 1.00 13.81 H new ATOM 0 HD21 LEU A 88 21.898 -12.594 26.188 1.00 25.61 H new ATOM 0 HD22 LEU A 88 20.792 -11.704 26.892 1.00 25.61 H new ATOM 0 HD23 LEU A 88 22.306 -11.588 27.341 1.00 25.61 H new ATOM 656 N LYS A 89 20.677 -10.081 31.286 1.00 16.37 N ATOM 657 CA LYS A 89 20.161 -9.430 32.502 1.00 16.31 C ATOM 658 C LYS A 89 18.651 -9.337 32.425 1.00 22.53 C ATOM 659 O LYS A 89 18.053 -9.415 31.354 1.00 15.99 O ATOM 660 CB LYS A 89 20.586 -7.944 32.560 1.00 22.93 C ATOM 661 CG LYS A 89 22.060 -7.629 32.782 1.00 32.21 C ATOM 0 H LYS A 89 20.395 -9.711 30.563 1.00 16.37 H new ATOM 0 HA LYS A 89 20.493 -9.948 33.252 1.00 16.31 H new ATOM 0 HB2 LYS A 89 20.315 -7.525 31.728 1.00 22.93 H new ATOM 0 HB3 LYS A 89 20.081 -7.518 33.270 1.00 22.93 H new ATOM 662 N ASP A 90 18.032 -9.104 33.574 1.00 15.88 N ATOM 663 CA ASP A 90 16.600 -8.954 33.633 1.00 18.08 C ATOM 664 C ASP A 90 16.227 -7.786 32.749 1.00 20.60 C ATOM 665 O ASP A 90 16.918 -6.769 32.781 1.00 20.66 O ATOM 666 CB ASP A 90 16.166 -8.602 35.072 1.00 22.33 C ATOM 667 CG ASP A 90 15.000 -9.397 35.565 1.00 40.73 C ATOM 668 OD1 ASP A 90 15.023 -10.602 35.671 1.00 47.16 O ATOM 669 OD2 ASP A 90 13.975 -8.648 35.896 1.00 69.64 O ATOM 0 H ASP A 90 18.432 -9.030 34.332 1.00 15.88 H new ATOM 0 HA ASP A 90 16.172 -9.778 33.352 1.00 18.08 H new ATOM 0 HB2 ASP A 90 16.917 -8.741 35.670 1.00 22.33 H new ATOM 0 HB3 ASP A 90 15.943 -7.659 35.111 1.00 22.33 H new ATOM 670 N GLY A 91 15.160 -7.932 31.969 1.00 19.76 N ATOM 671 CA GLY A 91 14.743 -6.838 31.142 1.00 18.43 C ATOM 672 C GLY A 91 15.340 -6.825 29.759 1.00 25.19 C ATOM 673 O GLY A 91 14.821 -6.126 28.905 1.00 20.78 O ATOM 0 H GLY A 91 14.681 -8.644 31.912 1.00 19.76 H new ATOM 0 HA2 GLY A 91 13.776 -6.860 31.063 1.00 18.43 H new ATOM 0 HA3 GLY A 91 14.973 -6.007 31.587 1.00 18.43 H new ATOM 674 N ASP A 92 16.422 -7.562 29.509 1.00 18.65 N ATOM 675 CA ASP A 92 16.975 -7.573 28.144 1.00 13.46 C ATOM 676 C ASP A 92 15.976 -8.211 27.134 1.00 15.01 C ATOM 677 O ASP A 92 15.168 -9.093 27.457 1.00 15.05 O ATOM 678 CB ASP A 92 18.228 -8.438 28.136 1.00 9.06 C ATOM 679 CG ASP A 92 19.440 -7.751 28.689 1.00 15.57 C ATOM 680 OD1 ASP A 92 19.531 -6.558 28.925 1.00 11.61 O ATOM 681 OD2 ASP A 92 20.424 -8.585 28.850 1.00 13.73 O ATOM 0 H ASP A 92 16.840 -8.045 30.085 1.00 18.65 H new ATOM 0 HA ASP A 92 17.158 -6.656 27.886 1.00 13.46 H new ATOM 0 HB2 ASP A 92 18.059 -9.242 28.651 1.00 9.06 H new ATOM 0 HB3 ASP A 92 18.412 -8.718 27.226 1.00 9.06 H new ATOM 682 N ILE A 93 16.019 -7.765 25.890 1.00 12.93 N ATOM 683 CA ILE A 93 15.210 -8.375 24.836 1.00 15.70 C ATOM 684 C ILE A 93 16.287 -8.959 23.938 1.00 21.24 C ATOM 685 O ILE A 93 17.313 -8.326 23.665 1.00 20.66 O ATOM 686 CB ILE A 93 14.238 -7.483 24.061 1.00 14.85 C ATOM 687 CG1 ILE A 93 14.995 -6.411 23.272 1.00 17.92 C ATOM 688 CG2 ILE A 93 13.268 -6.832 25.036 1.00 14.18 C ATOM 689 CD1 ILE A 93 14.101 -5.534 22.367 1.00 16.23 C ATOM 0 H ILE A 93 16.510 -7.109 25.629 1.00 12.93 H new ATOM 0 HA ILE A 93 14.574 -9.000 25.218 1.00 15.70 H new ATOM 0 HB ILE A 93 13.745 -8.029 23.428 1.00 14.85 H new ATOM 0 HG12 ILE A 93 15.466 -5.837 23.897 1.00 17.92 H new ATOM 0 HG13 ILE A 93 15.667 -6.844 22.722 1.00 17.92 H new ATOM 0 HG21 ILE A 93 12.650 -6.265 24.548 1.00 14.18 H new ATOM 0 HG22 ILE A 93 12.772 -7.520 25.507 1.00 14.18 H new ATOM 0 HG23 ILE A 93 13.763 -6.295 25.675 1.00 14.18 H new ATOM 0 HD11 ILE A 93 14.650 -4.883 21.903 1.00 16.23 H new ATOM 0 HD12 ILE A 93 13.648 -6.095 21.718 1.00 16.23 H new ATOM 0 HD13 ILE A 93 13.443 -5.073 22.911 1.00 16.23 H new ATOM 690 N VAL A 94 16.125 -10.188 23.520 1.00 13.93 N ATOM 691 CA VAL A 94 17.182 -10.743 22.737 1.00 11.79 C ATOM 692 C VAL A 94 16.639 -11.505 21.538 1.00 11.41 C ATOM 693 O VAL A 94 15.634 -12.210 21.613 1.00 11.70 O ATOM 694 CB VAL A 94 18.076 -11.585 23.661 1.00 23.49 C ATOM 695 CG1 VAL A 94 17.227 -12.695 24.216 1.00 29.14 C ATOM 696 CG2 VAL A 94 19.235 -12.237 22.911 1.00 23.82 C ATOM 0 H VAL A 94 15.446 -10.694 23.670 1.00 13.93 H new ATOM 0 HA VAL A 94 17.730 -10.041 22.353 1.00 11.79 H new ATOM 0 HB VAL A 94 18.442 -11.002 24.344 1.00 23.49 H new ATOM 0 HG11 VAL A 94 17.762 -13.248 24.806 1.00 29.14 H new ATOM 0 HG12 VAL A 94 16.485 -12.317 24.713 1.00 29.14 H new ATOM 0 HG13 VAL A 94 16.885 -13.237 23.487 1.00 29.14 H new ATOM 0 HG21 VAL A 94 19.771 -12.756 23.531 1.00 23.82 H new ATOM 0 HG22 VAL A 94 18.886 -12.820 22.219 1.00 23.82 H new ATOM 0 HG23 VAL A 94 19.786 -11.549 22.506 1.00 23.82 H new ATOM 697 N ASN A 95 17.311 -11.318 20.418 1.00 11.89 N ATOM 698 CA ASN A 95 16.917 -12.024 19.206 1.00 13.46 C ATOM 699 C ASN A 95 17.884 -13.171 18.975 1.00 13.14 C ATOM 700 O ASN A 95 19.094 -12.986 19.063 1.00 13.89 O ATOM 701 CB ASN A 95 16.975 -11.098 17.947 1.00 8.04 C ATOM 702 CG ASN A 95 16.582 -11.827 16.669 1.00 14.79 C ATOM 703 OD1 ASN A 95 17.396 -12.552 16.090 1.00 11.37 O ATOM 704 ND2 ASN A 95 15.326 -11.662 16.239 1.00 11.63 N ATOM 0 H ASN A 95 17.989 -10.796 20.334 1.00 11.89 H new ATOM 0 HA ASN A 95 16.006 -12.334 19.327 1.00 13.46 H new ATOM 0 HB2 ASN A 95 16.384 -10.340 18.079 1.00 8.04 H new ATOM 0 HB3 ASN A 95 17.873 -10.744 17.851 1.00 8.04 H new ATOM 0 HD21 ASN A 95 15.057 -12.070 15.532 1.00 11.63 H new ATOM 0 HD22 ASN A 95 14.788 -11.148 16.670 1.00 11.63 H new ATOM 705 N ILE A 96 17.358 -14.347 18.667 1.00 9.54 N ATOM 706 CA ILE A 96 18.210 -15.475 18.311 1.00 6.82 C ATOM 707 C ILE A 96 17.830 -15.802 16.862 1.00 12.21 C ATOM 708 O ILE A 96 16.670 -16.074 16.594 1.00 8.80 O ATOM 709 CB ILE A 96 18.089 -16.704 19.190 1.00 10.62 C ATOM 710 CG1 ILE A 96 18.497 -16.304 20.616 1.00 14.41 C ATOM 711 CG2 ILE A 96 19.040 -17.755 18.596 1.00 9.49 C ATOM 712 CD1 ILE A 96 18.354 -17.407 21.684 1.00 14.12 C ATOM 0 H ILE A 96 16.515 -14.514 18.657 1.00 9.54 H new ATOM 0 HA ILE A 96 19.138 -15.220 18.434 1.00 6.82 H new ATOM 0 HB ILE A 96 17.189 -17.065 19.226 1.00 10.62 H new ATOM 0 HG12 ILE A 96 19.421 -16.009 20.600 1.00 14.41 H new ATOM 0 HG13 ILE A 96 17.961 -15.542 20.887 1.00 14.41 H new ATOM 0 HG21 ILE A 96 18.999 -18.566 19.127 1.00 9.49 H new ATOM 0 HG22 ILE A 96 18.775 -17.952 17.684 1.00 9.49 H new ATOM 0 HG23 ILE A 96 19.947 -17.411 18.602 1.00 9.49 H new ATOM 0 HD11 ILE A 96 18.634 -17.061 22.546 1.00 14.12 H new ATOM 0 HD12 ILE A 96 17.428 -17.690 21.735 1.00 14.12 H new ATOM 0 HD13 ILE A 96 18.910 -18.164 21.444 1.00 14.12 H new ATOM 713 N ASP A 97 18.775 -15.688 15.940 1.00 7.68 N ATOM 714 CA ASP A 97 18.542 -15.923 14.525 1.00 7.55 C ATOM 715 C ASP A 97 19.281 -17.164 14.103 1.00 8.21 C ATOM 716 O ASP A 97 20.489 -17.275 14.240 1.00 10.45 O ATOM 717 CB ASP A 97 18.941 -14.657 13.698 1.00 8.01 C ATOM 718 CG ASP A 97 18.591 -14.800 12.236 1.00 9.85 C ATOM 719 OD1 ASP A 97 18.121 -15.800 11.721 1.00 12.77 O ATOM 720 OD2 ASP A 97 18.739 -13.690 11.609 1.00 12.71 O ATOM 0 H ASP A 97 19.586 -15.467 16.124 1.00 7.68 H new ATOM 0 HA ASP A 97 17.599 -16.075 14.354 1.00 7.55 H new ATOM 0 HB2 ASP A 97 18.491 -13.879 14.062 1.00 8.01 H new ATOM 0 HB3 ASP A 97 19.894 -14.501 13.787 1.00 8.01 H new ATOM 721 N VAL A 98 18.537 -18.149 13.646 1.00 7.98 N ATOM 722 CA VAL A 98 19.131 -19.424 13.259 1.00 11.02 C ATOM 723 C VAL A 98 18.928 -19.736 11.775 1.00 19.43 C ATOM 724 O VAL A 98 17.854 -19.518 11.200 1.00 15.11 O ATOM 725 CB VAL A 98 18.384 -20.543 14.007 1.00 19.92 C ATOM 726 CG1 VAL A 98 18.992 -21.903 13.646 1.00 21.17 C ATOM 727 CG2 VAL A 98 18.448 -20.337 15.524 1.00 22.05 C ATOM 0 H VAL A 98 17.684 -18.106 13.549 1.00 7.98 H new ATOM 0 HA VAL A 98 20.078 -19.371 13.461 1.00 11.02 H new ATOM 0 HB VAL A 98 17.453 -20.517 13.736 1.00 19.92 H new ATOM 0 HG11 VAL A 98 18.519 -22.605 14.119 1.00 21.17 H new ATOM 0 HG12 VAL A 98 18.915 -22.049 12.690 1.00 21.17 H new ATOM 0 HG13 VAL A 98 19.928 -21.917 13.900 1.00 21.17 H new ATOM 0 HG21 VAL A 98 17.970 -21.055 15.969 1.00 22.05 H new ATOM 0 HG22 VAL A 98 19.374 -20.338 15.812 1.00 22.05 H new ATOM 0 HG23 VAL A 98 18.040 -19.487 15.753 1.00 22.05 H new ATOM 728 N THR A 99 19.938 -20.307 11.147 1.00 8.76 N ATOM 729 CA THR A 99 19.788 -20.722 9.740 1.00 9.81 C ATOM 730 C THR A 99 20.437 -22.080 9.651 1.00 12.77 C ATOM 731 O THR A 99 21.629 -22.235 9.920 1.00 14.00 O ATOM 732 CB THR A 99 20.428 -19.753 8.726 1.00 7.72 C ATOM 733 OG1 THR A 99 19.740 -18.519 8.864 1.00 9.32 O ATOM 734 CG2 THR A 99 20.197 -20.333 7.332 1.00 9.37 C ATOM 0 H THR A 99 20.707 -20.466 11.496 1.00 8.76 H new ATOM 0 HA THR A 99 18.847 -20.731 9.504 1.00 9.81 H new ATOM 0 HB THR A 99 21.379 -19.627 8.869 1.00 7.72 H new ATOM 0 HG1 THR A 99 19.928 -18.019 8.215 1.00 9.32 H new ATOM 0 HG21 THR A 99 20.589 -19.745 6.668 1.00 9.37 H new ATOM 0 HG22 THR A 99 20.611 -21.208 7.273 1.00 9.37 H new ATOM 0 HG23 THR A 99 19.244 -20.414 7.169 1.00 9.37 H new ATOM 735 N VAL A 100 19.646 -23.073 9.348 1.00 7.80 N ATOM 736 CA VAL A 100 20.141 -24.434 9.286 1.00 7.40 C ATOM 737 C VAL A 100 20.126 -24.942 7.847 1.00 17.36 C ATOM 738 O VAL A 100 19.240 -24.560 7.059 1.00 17.38 O ATOM 739 CB VAL A 100 19.153 -25.266 10.100 1.00 15.19 C ATOM 740 CG1 VAL A 100 19.252 -26.763 9.841 1.00 21.30 C ATOM 741 CG2 VAL A 100 19.344 -24.963 11.585 1.00 15.99 C ATOM 0 H VAL A 100 18.809 -22.988 9.172 1.00 7.80 H new ATOM 0 HA VAL A 100 21.050 -24.490 9.620 1.00 7.40 H new ATOM 0 HB VAL A 100 18.262 -25.011 9.814 1.00 15.19 H new ATOM 0 HG11 VAL A 100 18.600 -27.230 10.387 1.00 21.30 H new ATOM 0 HG12 VAL A 100 19.076 -26.942 8.904 1.00 21.30 H new ATOM 0 HG13 VAL A 100 20.143 -27.072 10.067 1.00 21.30 H new ATOM 0 HG21 VAL A 100 18.718 -25.490 12.106 1.00 15.99 H new ATOM 0 HG22 VAL A 100 20.251 -25.187 11.847 1.00 15.99 H new ATOM 0 HG23 VAL A 100 19.185 -24.020 11.746 1.00 15.99 H new ATOM 742 N ILE A 101 21.099 -25.799 7.538 1.00 9.50 N ATOM 743 CA ILE A 101 21.199 -26.460 6.249 1.00 11.99 C ATOM 744 C ILE A 101 20.984 -27.964 6.438 1.00 22.60 C ATOM 745 O ILE A 101 21.659 -28.619 7.234 1.00 19.66 O ATOM 746 CB ILE A 101 22.507 -26.254 5.503 1.00 14.30 C ATOM 747 CG1 ILE A 101 22.941 -24.812 5.432 1.00 16.55 C ATOM 748 CG2 ILE A 101 22.372 -26.774 4.077 1.00 19.43 C ATOM 749 CD1 ILE A 101 24.342 -24.713 4.831 1.00 17.11 C ATOM 0 H ILE A 101 21.728 -26.013 8.085 1.00 9.50 H new ATOM 0 HA ILE A 101 20.513 -26.048 5.701 1.00 11.99 H new ATOM 0 HB ILE A 101 23.180 -26.742 6.003 1.00 14.30 H new ATOM 0 HG12 ILE A 101 22.314 -24.304 4.893 1.00 16.55 H new ATOM 0 HG13 ILE A 101 22.934 -24.421 6.320 1.00 16.55 H new ATOM 0 HG21 ILE A 101 23.208 -26.641 3.603 1.00 19.43 H new ATOM 0 HG22 ILE A 101 22.158 -27.720 4.096 1.00 19.43 H new ATOM 0 HG23 ILE A 101 21.663 -26.292 3.622 1.00 19.43 H new ATOM 0 HD11 ILE A 101 24.612 -23.782 4.790 1.00 17.11 H new ATOM 0 HD12 ILE A 101 24.967 -25.206 5.385 1.00 17.11 H new ATOM 0 HD13 ILE A 101 24.338 -25.088 3.936 1.00 17.11 H new ATOM 750 N LYS A 102 20.031 -28.512 5.685 1.00 16.99 N ATOM 751 CA LYS A 102 19.701 -29.916 5.661 1.00 13.38 C ATOM 752 C LYS A 102 19.422 -30.347 4.200 1.00 21.24 C ATOM 753 O LYS A 102 18.610 -29.764 3.440 1.00 15.32 O ATOM 754 CB LYS A 102 18.555 -30.247 6.610 1.00 16.38 C ATOM 755 CG LYS A 102 18.227 -31.743 6.672 1.00 13.69 C ATOM 756 CD LYS A 102 19.340 -32.505 7.366 1.00 17.08 C ATOM 757 CE LYS A 102 19.007 -33.956 7.660 1.00 29.50 C ATOM 758 NZ LYS A 102 20.148 -34.640 8.272 1.00 76.56 N ATOM 0 H LYS A 102 19.542 -28.046 5.153 1.00 16.99 H new ATOM 0 HA LYS A 102 20.456 -30.429 5.988 1.00 13.38 H new ATOM 0 HB2 LYS A 102 18.781 -29.935 7.500 1.00 16.38 H new ATOM 0 HB3 LYS A 102 17.763 -29.761 6.332 1.00 16.38 H new ATOM 0 HG2 LYS A 102 17.392 -31.877 7.147 1.00 13.69 H new ATOM 0 HG3 LYS A 102 18.102 -32.089 5.775 1.00 13.69 H new ATOM 0 HD2 LYS A 102 20.136 -32.472 6.812 1.00 17.08 H new ATOM 0 HD3 LYS A 102 19.555 -32.057 8.199 1.00 17.08 H new ATOM 0 HE2 LYS A 102 18.241 -34.002 8.253 1.00 29.50 H new ATOM 0 HE3 LYS A 102 18.757 -34.407 6.839 1.00 29.50 H new ATOM 0 HZ1 LYS A 102 19.854 -35.235 8.866 1.00 76.56 H new ATOM 0 HZ2 LYS A 102 20.617 -35.058 7.641 1.00 76.56 H new ATOM 0 HZ3 LYS A 102 20.667 -34.044 8.681 1.00 76.56 H new ATOM 759 N ASP A 103 20.121 -31.392 3.801 1.00 15.87 N ATOM 760 CA ASP A 103 20.028 -31.917 2.456 1.00 14.96 C ATOM 761 C ASP A 103 20.193 -30.830 1.442 1.00 20.06 C ATOM 762 O ASP A 103 19.467 -30.794 0.478 1.00 24.62 O ATOM 763 CB ASP A 103 18.741 -32.700 2.238 1.00 19.15 C ATOM 764 CG ASP A 103 18.895 -34.023 2.933 1.00 36.99 C ATOM 765 OD1 ASP A 103 19.975 -34.455 3.321 1.00 48.94 O ATOM 766 OD2 ASP A 103 17.760 -34.635 3.125 1.00 50.86 O ATOM 0 H ASP A 103 20.668 -31.820 4.308 1.00 15.87 H new ATOM 0 HA ASP A 103 20.759 -32.544 2.338 1.00 14.96 H new ATOM 0 HB2 ASP A 103 17.981 -32.214 2.594 1.00 19.15 H new ATOM 0 HB3 ASP A 103 18.576 -32.829 1.291 1.00 19.15 H new ATOM 767 N GLY A 104 21.122 -29.920 1.722 1.00 14.27 N ATOM 768 CA GLY A 104 21.447 -28.827 0.857 1.00 13.99 C ATOM 769 C GLY A 104 20.452 -27.657 0.846 1.00 24.29 C ATOM 770 O GLY A 104 20.702 -26.685 0.114 1.00 21.21 O ATOM 0 H GLY A 104 21.587 -29.934 2.445 1.00 14.27 H new ATOM 0 HA2 GLY A 104 22.318 -28.485 1.111 1.00 13.99 H new ATOM 0 HA3 GLY A 104 21.529 -29.167 -0.048 1.00 13.99 H new ATOM 771 N PHE A 105 19.335 -27.728 1.625 1.00 17.37 N ATOM 772 CA PHE A 105 18.372 -26.600 1.618 1.00 16.03 C ATOM 773 C PHE A 105 18.453 -25.812 2.915 1.00 17.31 C ATOM 774 O PHE A 105 18.681 -26.405 3.957 1.00 12.35 O ATOM 775 CB PHE A 105 16.910 -27.019 1.343 1.00 16.20 C ATOM 776 CG PHE A 105 16.736 -27.398 -0.113 1.00 17.83 C ATOM 777 CD1 PHE A 105 16.221 -26.474 -1.024 1.00 27.41 C ATOM 778 CD2 PHE A 105 17.140 -28.652 -0.571 1.00 17.99 C ATOM 779 CE1 PHE A 105 16.073 -26.782 -2.377 1.00 26.33 C ATOM 780 CE2 PHE A 105 16.992 -28.986 -1.915 1.00 23.90 C ATOM 781 CZ PHE A 105 16.461 -28.050 -2.802 1.00 20.65 C ATOM 0 H PHE A 105 19.130 -28.388 2.137 1.00 17.37 H new ATOM 0 HA PHE A 105 18.638 -26.038 0.873 1.00 16.03 H new ATOM 0 HB2 PHE A 105 16.670 -27.769 1.910 1.00 16.20 H new ATOM 0 HB3 PHE A 105 16.311 -26.290 1.568 1.00 16.20 H new ATOM 0 HD1 PHE A 105 15.970 -25.631 -0.721 1.00 27.41 H new ATOM 0 HD2 PHE A 105 17.509 -29.266 0.022 1.00 17.99 H new ATOM 0 HE1 PHE A 105 15.726 -26.160 -2.976 1.00 26.33 H new ATOM 0 HE2 PHE A 105 17.246 -29.828 -2.219 1.00 23.90 H new ATOM 0 HZ PHE A 105 16.364 -28.278 -3.698 1.00 20.65 H new ATOM 782 N HIS A 106 18.250 -24.505 2.822 1.00 12.51 N ATOM 783 CA HIS A 106 18.305 -23.626 3.974 1.00 15.57 C ATOM 784 C HIS A 106 16.928 -23.322 4.606 1.00 21.78 C ATOM 785 O HIS A 106 15.888 -23.240 3.925 1.00 16.38 O ATOM 786 CB HIS A 106 18.926 -22.267 3.571 1.00 11.26 C ATOM 787 CG HIS A 106 20.350 -22.309 3.144 1.00 13.99 C ATOM 788 ND1 HIS A 106 20.740 -22.901 1.954 1.00 17.92 N ATOM 789 CD2 HIS A 106 21.453 -21.798 3.758 1.00 17.26 C ATOM 790 CE1 HIS A 106 22.066 -22.742 1.864 1.00 19.54 C ATOM 791 NE2 HIS A 106 22.525 -22.061 2.931 1.00 17.02 N ATOM 0 H HIS A 106 18.075 -24.103 2.082 1.00 12.51 H new ATOM 0 HA HIS A 106 18.840 -24.101 4.629 1.00 15.57 H new ATOM 0 HB2 HIS A 106 18.400 -21.892 2.848 1.00 11.26 H new ATOM 0 HB3 HIS A 106 18.849 -21.659 4.323 1.00 11.26 H new ATOM 0 HD1 HIS A 106 20.230 -23.294 1.384 1.00 17.92 H new ATOM 0 HD2 HIS A 106 21.478 -21.357 4.576 1.00 17.26 H new ATOM 0 HE1 HIS A 106 22.594 -23.056 1.166 1.00 19.54 H new ATOM 792 N GLY A 107 16.946 -23.127 5.929 1.00 12.33 N ATOM 793 CA GLY A 107 15.778 -22.720 6.732 1.00 12.04 C ATOM 794 C GLY A 107 16.269 -21.529 7.599 1.00 19.53 C ATOM 795 O GLY A 107 17.192 -21.706 8.388 1.00 16.56 O ATOM 0 H GLY A 107 17.658 -23.230 6.400 1.00 12.33 H new ATOM 0 HA2 GLY A 107 15.037 -22.457 6.164 1.00 12.04 H new ATOM 0 HA3 GLY A 107 15.464 -23.451 7.287 1.00 12.04 H new ATOM 796 N ASP A 108 15.721 -20.310 7.436 1.00 16.72 N ATOM 797 CA ASP A 108 16.162 -19.100 8.160 1.00 15.09 C ATOM 798 C ASP A 108 15.036 -18.516 9.025 1.00 13.38 C ATOM 799 O ASP A 108 13.982 -18.220 8.497 1.00 8.15 O ATOM 800 CB ASP A 108 16.639 -18.066 7.108 1.00 12.21 C ATOM 801 CG ASP A 108 17.366 -16.839 7.568 1.00 11.92 C ATOM 802 OD1 ASP A 108 17.707 -15.954 6.776 1.00 10.32 O ATOM 803 OD2 ASP A 108 17.565 -16.799 8.878 1.00 12.37 O ATOM 0 H ASP A 108 15.072 -20.162 6.892 1.00 16.72 H new ATOM 0 HA ASP A 108 16.885 -19.328 8.765 1.00 15.09 H new ATOM 0 HB2 ASP A 108 17.217 -18.531 6.483 1.00 12.21 H new ATOM 0 HB3 ASP A 108 15.859 -17.774 6.611 1.00 12.21 H new ATOM 804 N THR A 109 15.254 -18.358 10.336 1.00 5.83 N ATOM 805 CA THR A 109 14.197 -17.854 11.189 1.00 7.74 C ATOM 806 C THR A 109 14.765 -17.267 12.463 1.00 10.57 C ATOM 807 O THR A 109 15.862 -17.628 12.886 1.00 11.31 O ATOM 808 CB THR A 109 13.111 -18.958 11.462 1.00 13.01 C ATOM 809 OG1 THR A 109 11.985 -18.467 12.190 1.00 12.09 O ATOM 810 CG2 THR A 109 13.659 -20.207 12.153 1.00 9.48 C ATOM 0 H THR A 109 15.994 -18.535 10.736 1.00 5.83 H new ATOM 0 HA THR A 109 13.745 -17.132 10.724 1.00 7.74 H new ATOM 0 HB THR A 109 12.818 -19.216 10.574 1.00 13.01 H new ATOM 0 HG1 THR A 109 11.784 -17.701 11.911 1.00 12.09 H new ATOM 0 HG21 THR A 109 12.940 -20.843 12.290 1.00 9.48 H new ATOM 0 HG22 THR A 109 14.345 -20.610 11.598 1.00 9.48 H new ATOM 0 HG23 THR A 109 14.041 -19.962 13.010 1.00 9.48 H new ATOM 811 N SER A 110 13.989 -16.367 13.074 1.00 11.48 N ATOM 812 CA SER A 110 14.407 -15.710 14.309 1.00 9.95 C ATOM 813 C SER A 110 13.210 -15.268 15.120 1.00 15.40 C ATOM 814 O SER A 110 12.088 -15.121 14.617 1.00 10.44 O ATOM 815 CB SER A 110 15.310 -14.483 14.080 1.00 10.55 C ATOM 816 OG SER A 110 14.509 -13.378 13.674 1.00 11.01 O ATOM 0 H SER A 110 13.216 -16.125 12.786 1.00 11.48 H new ATOM 0 HA SER A 110 14.922 -16.378 14.788 1.00 9.95 H new ATOM 0 HB2 SER A 110 15.790 -14.266 14.894 1.00 10.55 H new ATOM 0 HB3 SER A 110 15.975 -14.680 13.402 1.00 10.55 H new ATOM 0 HG SER A 110 14.927 -12.923 13.104 1.00 11.01 H new ATOM 817 N LYS A 111 13.464 -15.061 16.404 1.00 10.09 N ATOM 818 CA LYS A 111 12.429 -14.558 17.299 1.00 11.25 C ATOM 819 C LYS A 111 13.065 -13.832 18.454 1.00 7.75 C ATOM 820 O LYS A 111 14.264 -14.004 18.732 1.00 9.34 O ATOM 821 CB LYS A 111 11.468 -15.610 17.812 1.00 15.10 C ATOM 822 CG LYS A 111 12.166 -16.539 18.790 1.00 16.82 C ATOM 823 CD LYS A 111 11.221 -17.497 19.494 1.00 13.75 C ATOM 824 CE LYS A 111 10.592 -16.956 20.763 1.00 20.95 C ATOM 825 NZ LYS A 111 9.627 -17.935 21.324 1.00 20.58 N ATOM 0 H LYS A 111 14.225 -15.204 16.777 1.00 10.09 H new ATOM 0 HA LYS A 111 11.889 -13.954 16.766 1.00 11.25 H new ATOM 0 HB2 LYS A 111 10.714 -15.182 18.247 1.00 15.10 H new ATOM 0 HB3 LYS A 111 11.114 -16.122 17.068 1.00 15.10 H new ATOM 0 HG2 LYS A 111 12.839 -17.051 18.315 1.00 16.82 H new ATOM 0 HG3 LYS A 111 12.631 -16.007 19.455 1.00 16.82 H new ATOM 0 HD2 LYS A 111 10.514 -17.744 18.878 1.00 13.75 H new ATOM 0 HD3 LYS A 111 11.706 -18.309 19.710 1.00 13.75 H new ATOM 0 HE2 LYS A 111 11.283 -16.764 21.416 1.00 20.95 H new ATOM 0 HE3 LYS A 111 10.139 -16.119 20.575 1.00 20.95 H new ATOM 0 HZ1 LYS A 111 9.365 -17.665 22.130 1.00 20.58 H new ATOM 0 HZ2 LYS A 111 8.920 -17.996 20.787 1.00 20.58 H new ATOM 0 HZ3 LYS A 111 10.017 -18.732 21.391 1.00 20.58 H new ATOM 826 N MET A 112 12.253 -13.009 19.105 1.00 9.17 N ATOM 827 CA MET A 112 12.730 -12.280 20.259 1.00 7.69 C ATOM 828 C MET A 112 12.393 -13.069 21.531 1.00 16.93 C ATOM 829 O MET A 112 11.367 -13.765 21.645 1.00 14.15 O ATOM 830 CB MET A 112 11.965 -10.962 20.389 1.00 9.65 C ATOM 831 CG MET A 112 12.107 -10.080 19.169 1.00 12.38 C ATOM 832 SD MET A 112 13.840 -9.662 18.889 1.00 12.39 S ATOM 833 CE MET A 112 14.302 -8.616 20.312 1.00 15.01 C ATOM 0 H MET A 112 11.432 -12.863 18.894 1.00 9.17 H new ATOM 0 HA MET A 112 13.684 -12.138 20.154 1.00 7.69 H new ATOM 0 HB2 MET A 112 11.026 -11.151 20.539 1.00 9.65 H new ATOM 0 HB3 MET A 112 12.285 -10.482 21.169 1.00 9.65 H new ATOM 0 HG2 MET A 112 11.749 -10.535 18.391 1.00 12.38 H new ATOM 0 HG3 MET A 112 11.588 -9.269 19.287 1.00 12.38 H new ATOM 0 HE1 MET A 112 14.775 -7.830 19.996 1.00 15.01 H new ATOM 0 HE2 MET A 112 13.501 -8.342 20.786 1.00 15.01 H new ATOM 0 HE3 MET A 112 14.875 -9.119 20.911 1.00 15.01 H new ATOM 834 N PHE A 113 13.267 -12.944 22.494 1.00 12.22 N ATOM 835 CA PHE A 113 13.043 -13.533 23.798 1.00 11.08 C ATOM 836 C PHE A 113 13.180 -12.391 24.781 1.00 16.43 C ATOM 837 O PHE A 113 13.993 -11.482 24.557 1.00 15.37 O ATOM 838 CB PHE A 113 14.070 -14.579 24.195 1.00 8.47 C ATOM 839 CG PHE A 113 14.019 -15.817 23.332 1.00 12.19 C ATOM 840 CD1 PHE A 113 14.718 -15.854 22.126 1.00 13.59 C ATOM 841 CD2 PHE A 113 13.263 -16.921 23.730 1.00 12.46 C ATOM 842 CE1 PHE A 113 14.703 -17.005 21.342 1.00 11.12 C ATOM 843 CE2 PHE A 113 13.238 -18.084 22.962 1.00 11.02 C ATOM 844 CZ PHE A 113 13.968 -18.107 21.777 1.00 8.34 C ATOM 0 H PHE A 113 14.010 -12.517 22.418 1.00 12.22 H new ATOM 0 HA PHE A 113 12.180 -13.976 23.788 1.00 11.08 H new ATOM 0 HB2 PHE A 113 14.957 -14.190 24.141 1.00 8.47 H new ATOM 0 HB3 PHE A 113 13.926 -14.831 25.121 1.00 8.47 H new ATOM 0 HD1 PHE A 113 15.196 -15.108 21.844 1.00 13.59 H new ATOM 0 HD2 PHE A 113 12.770 -16.880 24.517 1.00 12.46 H new ATOM 0 HE1 PHE A 113 15.175 -17.038 20.542 1.00 11.12 H new ATOM 0 HE2 PHE A 113 12.747 -18.825 23.234 1.00 11.02 H new ATOM 0 HZ PHE A 113 13.965 -18.880 21.260 1.00 8.34 H new ATOM 845 N ILE A 114 12.370 -12.406 25.824 1.00 13.57 N ATOM 846 CA ILE A 114 12.455 -11.375 26.856 1.00 17.96 C ATOM 847 C ILE A 114 13.072 -12.027 28.086 1.00 16.44 C ATOM 848 O ILE A 114 12.597 -13.065 28.521 1.00 14.20 O ATOM 849 CB ILE A 114 11.107 -10.728 27.148 1.00 25.82 C ATOM 850 CG1 ILE A 114 10.713 -10.015 25.866 1.00 26.31 C ATOM 851 CG2 ILE A 114 11.274 -9.687 28.237 1.00 25.78 C ATOM 852 CD1 ILE A 114 9.505 -9.118 26.004 1.00 24.21 C ATOM 0 H ILE A 114 11.763 -13.001 25.958 1.00 13.57 H new ATOM 0 HA ILE A 114 13.012 -10.641 26.552 1.00 17.96 H new ATOM 0 HB ILE A 114 10.449 -11.382 27.432 1.00 25.82 H new ATOM 0 HG12 ILE A 114 11.464 -9.484 25.559 1.00 26.31 H new ATOM 0 HG13 ILE A 114 10.535 -10.678 25.181 1.00 26.31 H new ATOM 0 HG21 ILE A 114 10.417 -9.274 28.424 1.00 25.78 H new ATOM 0 HG22 ILE A 114 11.611 -10.111 29.042 1.00 25.78 H new ATOM 0 HG23 ILE A 114 11.902 -9.009 27.943 1.00 25.78 H new ATOM 0 HD11 ILE A 114 9.314 -8.699 25.150 1.00 24.21 H new ATOM 0 HD12 ILE A 114 8.740 -9.645 26.283 1.00 24.21 H new ATOM 0 HD13 ILE A 114 9.684 -8.433 26.667 1.00 24.21 H new ATOM 853 N VAL A 115 14.162 -11.463 28.598 1.00 15.92 N ATOM 854 CA VAL A 115 14.830 -12.072 29.740 1.00 14.71 C ATOM 855 C VAL A 115 14.259 -11.593 31.066 1.00 16.99 C ATOM 856 O VAL A 115 14.149 -10.379 31.319 1.00 17.62 O ATOM 857 CB VAL A 115 16.336 -11.814 29.707 1.00 16.43 C ATOM 858 CG1 VAL A 115 17.050 -12.467 30.895 1.00 15.15 C ATOM 859 CG2 VAL A 115 16.961 -12.219 28.357 1.00 16.45 C ATOM 0 H VAL A 115 14.525 -10.741 28.304 1.00 15.92 H new ATOM 0 HA VAL A 115 14.670 -13.026 29.670 1.00 14.71 H new ATOM 0 HB VAL A 115 16.463 -10.856 29.795 1.00 16.43 H new ATOM 0 HG11 VAL A 115 18.001 -12.283 30.842 1.00 15.15 H new ATOM 0 HG12 VAL A 115 16.697 -12.106 31.723 1.00 15.15 H new ATOM 0 HG13 VAL A 115 16.905 -13.426 30.873 1.00 15.15 H new ATOM 0 HG21 VAL A 115 17.914 -12.041 28.375 1.00 16.45 H new ATOM 0 HG22 VAL A 115 16.812 -13.165 28.202 1.00 16.45 H new ATOM 0 HG23 VAL A 115 16.550 -11.706 27.643 1.00 16.45 H new ATOM 860 N GLY A 116 13.934 -12.574 31.895 1.00 15.46 N ATOM 861 CA GLY A 116 13.385 -12.269 33.199 1.00 25.01 C ATOM 862 C GLY A 116 12.164 -11.344 33.139 1.00 29.95 C ATOM 863 O GLY A 116 11.219 -11.564 32.385 1.00 26.26 O ATOM 0 H GLY A 116 14.023 -13.412 31.722 1.00 15.46 H new ATOM 0 HA2 GLY A 116 13.135 -13.096 33.640 1.00 25.01 H new ATOM 0 HA3 GLY A 116 14.072 -11.853 33.743 1.00 25.01 H new ATOM 864 N LYS A 117 12.181 -10.285 33.944 1.00 25.50 N ATOM 865 CA LYS A 117 11.068 -9.348 33.977 1.00 24.38 C ATOM 866 C LYS A 117 11.149 -8.318 32.869 1.00 22.80 C ATOM 867 O LYS A 117 12.099 -7.524 32.780 1.00 28.79 O ATOM 868 CB LYS A 117 10.966 -8.658 35.325 1.00 35.98 C ATOM 0 H LYS A 117 12.828 -10.093 34.477 1.00 25.50 H new ATOM 0 HA LYS A 117 10.265 -9.873 33.834 1.00 24.38 H new ATOM 869 N PRO A 118 10.135 -8.345 32.009 1.00 28.71 N ATOM 870 CA PRO A 118 10.082 -7.437 30.870 1.00 26.78 C ATOM 871 C PRO A 118 9.884 -6.010 31.278 1.00 26.33 C ATOM 872 O PRO A 118 9.358 -5.737 32.365 1.00 25.11 O ATOM 873 CB PRO A 118 8.866 -7.843 30.030 1.00 25.12 C ATOM 874 CG PRO A 118 8.001 -8.692 30.945 1.00 29.73 C ATOM 875 CD PRO A 118 8.906 -9.179 32.076 1.00 25.43 C ATOM 0 HA PRO A 118 10.923 -7.499 30.391 1.00 26.78 H new ATOM 0 HB2 PRO A 118 8.382 -7.063 29.718 1.00 25.12 H new ATOM 0 HB3 PRO A 118 9.137 -8.342 29.244 1.00 25.12 H new ATOM 0 HG2 PRO A 118 7.259 -8.175 31.296 1.00 29.73 H new ATOM 0 HG3 PRO A 118 7.620 -9.442 30.461 1.00 29.73 H new ATOM 0 HD2 PRO A 118 8.468 -9.083 32.936 1.00 25.43 H new ATOM 0 HD3 PRO A 118 9.119 -10.119 31.969 1.00 25.43 H new ATOM 876 N THR A 119 10.318 -5.128 30.375 1.00 19.95 N ATOM 877 CA THR A 119 10.147 -3.686 30.520 1.00 16.99 C ATOM 878 C THR A 119 8.938 -3.368 29.647 1.00 21.20 C ATOM 879 O THR A 119 8.561 -4.180 28.786 1.00 16.05 O ATOM 880 CB THR A 119 11.359 -2.842 30.080 1.00 24.58 C ATOM 881 OG1 THR A 119 11.462 -2.850 28.682 1.00 20.70 O ATOM 882 CG2 THR A 119 12.642 -3.448 30.635 1.00 39.03 C ATOM 0 H THR A 119 10.725 -5.356 29.653 1.00 19.95 H new ATOM 0 HA THR A 119 10.039 -3.459 31.457 1.00 16.99 H new ATOM 0 HB THR A 119 11.236 -1.938 30.410 1.00 24.58 H new ATOM 0 HG1 THR A 119 11.602 -3.634 28.416 1.00 20.70 H new ATOM 0 HG21 THR A 119 13.401 -2.913 30.355 1.00 39.03 H new ATOM 0 HG22 THR A 119 12.599 -3.465 31.604 1.00 39.03 H new ATOM 0 HG23 THR A 119 12.744 -4.353 30.300 1.00 39.03 H new ATOM 883 N ILE A 120 8.321 -2.228 29.870 1.00 18.30 N ATOM 884 CA ILE A 120 7.148 -1.881 29.096 1.00 17.68 C ATOM 885 C ILE A 120 7.498 -1.711 27.599 1.00 15.88 C ATOM 886 O ILE A 120 6.852 -2.265 26.700 1.00 15.92 O ATOM 887 CB ILE A 120 6.377 -0.734 29.746 1.00 18.09 C ATOM 888 CG1 ILE A 120 5.742 -1.124 31.105 1.00 18.66 C ATOM 889 CG2 ILE A 120 5.300 -0.181 28.822 1.00 12.75 C ATOM 0 H ILE A 120 8.559 -1.646 30.457 1.00 18.30 H new ATOM 0 HA ILE A 120 6.517 -2.618 29.105 1.00 17.68 H new ATOM 0 HB ILE A 120 7.038 -0.044 29.914 1.00 18.09 H new ATOM 0 HG21 ILE A 120 4.833 0.543 29.267 1.00 12.75 H new ATOM 0 HG22 ILE A 120 5.711 0.151 28.008 1.00 12.75 H new ATOM 0 HG23 ILE A 120 4.670 -0.885 28.602 1.00 12.75 H new ATOM 890 N MET A 121 8.550 -0.962 27.343 1.00 15.37 N ATOM 891 CA MET A 121 9.054 -0.687 26.000 1.00 23.17 C ATOM 892 C MET A 121 9.435 -1.987 25.300 1.00 22.77 C ATOM 893 O MET A 121 9.104 -2.294 24.150 1.00 22.55 O ATOM 894 CB MET A 121 10.362 0.123 26.129 1.00 28.91 C ATOM 895 CG MET A 121 10.354 1.438 25.387 1.00 41.91 C ATOM 896 SD MET A 121 9.597 1.324 23.749 1.00 52.44 S ATOM 897 CE MET A 121 8.017 2.188 24.009 1.00 41.96 C ATOM 0 H MET A 121 9.011 -0.583 27.962 1.00 15.37 H new ATOM 0 HA MET A 121 8.367 -0.216 25.503 1.00 23.17 H new ATOM 0 HB2 MET A 121 10.532 0.295 27.068 1.00 28.91 H new ATOM 0 HB3 MET A 121 11.098 -0.417 25.801 1.00 28.91 H new ATOM 0 HG2 MET A 121 9.875 2.097 25.913 1.00 41.91 H new ATOM 0 HG3 MET A 121 11.266 1.757 25.295 1.00 41.91 H new ATOM 0 HE1 MET A 121 7.352 1.839 23.395 1.00 41.96 H new ATOM 0 HE2 MET A 121 7.719 2.050 24.922 1.00 41.96 H new ATOM 0 HE3 MET A 121 8.137 3.137 23.849 1.00 41.96 H new ATOM 898 N GLY A 122 10.182 -2.780 26.022 1.00 15.63 N ATOM 899 CA GLY A 122 10.626 -4.034 25.454 1.00 13.25 C ATOM 900 C GLY A 122 9.457 -4.909 24.986 1.00 20.11 C ATOM 901 O GLY A 122 9.460 -5.409 23.866 1.00 17.49 O ATOM 0 H GLY A 122 10.442 -2.622 26.826 1.00 15.63 H new ATOM 0 HA2 GLY A 122 11.214 -3.856 24.704 1.00 13.25 H new ATOM 0 HA3 GLY A 122 11.146 -4.519 26.114 1.00 13.25 H new ATOM 902 N GLU A 123 8.475 -5.133 25.848 1.00 12.44 N ATOM 903 CA GLU A 123 7.350 -5.960 25.476 1.00 13.05 C ATOM 904 C GLU A 123 6.566 -5.368 24.309 1.00 17.80 C ATOM 905 O GLU A 123 6.231 -6.030 23.315 1.00 17.56 O ATOM 906 CB GLU A 123 6.494 -6.126 26.712 1.00 18.53 C ATOM 907 CG GLU A 123 5.149 -6.801 26.451 1.00 31.29 C ATOM 908 CD GLU A 123 4.353 -6.898 27.730 1.00100.00 C ATOM 909 OE1 GLU A 123 3.172 -6.579 27.812 1.00100.00 O ATOM 910 OE2 GLU A 123 5.080 -7.321 28.749 1.00 52.14 O ATOM 0 H GLU A 123 8.445 -4.816 26.647 1.00 12.44 H new ATOM 0 HA GLU A 123 7.656 -6.825 25.161 1.00 13.05 H new ATOM 0 HB2 GLU A 123 6.985 -6.647 27.367 1.00 18.53 H new ATOM 0 HB3 GLU A 123 6.336 -5.253 27.105 1.00 18.53 H new ATOM 0 HG2 GLU A 123 4.650 -6.296 25.790 1.00 31.29 H new ATOM 0 HG3 GLU A 123 5.291 -7.687 26.083 1.00 31.29 H new ATOM 911 N ARG A 124 6.294 -4.083 24.429 1.00 10.12 N ATOM 912 CA ARG A 124 5.604 -3.411 23.386 1.00 7.68 C ATOM 913 C ARG A 124 6.320 -3.541 22.038 1.00 17.13 C ATOM 914 O ARG A 124 5.705 -3.849 20.997 1.00 11.71 O ATOM 915 CB ARG A 124 5.559 -1.942 23.688 1.00 13.45 C ATOM 916 CG ARG A 124 4.664 -1.291 22.663 1.00 16.27 C ATOM 917 CD ARG A 124 4.187 0.099 22.994 1.00 23.58 C ATOM 918 NE ARG A 124 3.229 0.418 21.964 1.00 26.71 N ATOM 919 CZ ARG A 124 3.428 1.429 21.192 1.00 25.10 C ATOM 920 NH1 ARG A 124 4.491 2.197 21.386 1.00 39.84 N ATOM 921 NH2 ARG A 124 2.554 1.679 20.223 1.00 25.68 N ATOM 0 H ARG A 124 6.504 -3.596 25.106 1.00 10.12 H new ATOM 0 HA ARG A 124 4.723 -3.813 23.333 1.00 7.68 H new ATOM 0 HB2 ARG A 124 5.219 -1.789 24.583 1.00 13.45 H new ATOM 0 HB3 ARG A 124 6.450 -1.560 23.654 1.00 13.45 H new ATOM 0 HG2 ARG A 124 5.139 -1.258 21.818 1.00 16.27 H new ATOM 0 HG3 ARG A 124 3.888 -1.858 22.530 1.00 16.27 H new ATOM 0 HD2 ARG A 124 3.781 0.131 23.874 1.00 23.58 H new ATOM 0 HD3 ARG A 124 4.922 0.731 22.998 1.00 23.58 H new ATOM 0 HE ARG A 124 2.525 -0.067 21.866 1.00 26.71 H new ATOM 0 HH11 ARG A 124 5.040 2.018 22.023 1.00 39.84 H new ATOM 0 HH12 ARG A 124 4.631 2.874 20.875 1.00 39.84 H new ATOM 0 HH21 ARG A 124 1.869 1.169 20.120 1.00 25.68 H new ATOM 0 HH22 ARG A 124 2.673 2.351 19.699 1.00 25.68 H new ATOM 922 N LEU A 125 7.622 -3.263 22.038 1.00 11.64 N ATOM 923 CA LEU A 125 8.383 -3.323 20.798 1.00 12.59 C ATOM 924 C LEU A 125 8.371 -4.710 20.157 1.00 17.09 C ATOM 925 O LEU A 125 8.259 -4.856 18.934 1.00 15.80 O ATOM 926 CB LEU A 125 9.816 -2.788 20.977 1.00 11.66 C ATOM 927 CG LEU A 125 10.704 -2.825 19.720 1.00 11.29 C ATOM 928 CD1 LEU A 125 10.246 -1.831 18.661 1.00 11.56 C ATOM 929 CD2 LEU A 125 12.134 -2.475 20.135 1.00 10.41 C ATOM 0 H LEU A 125 8.075 -3.041 22.734 1.00 11.64 H new ATOM 0 HA LEU A 125 7.929 -2.734 20.176 1.00 12.59 H new ATOM 0 HB2 LEU A 125 9.765 -1.871 21.290 1.00 11.66 H new ATOM 0 HB3 LEU A 125 10.251 -3.302 21.675 1.00 11.66 H new ATOM 0 HG LEU A 125 10.648 -3.714 19.335 1.00 11.29 H new ATOM 0 HD11 LEU A 125 10.831 -1.888 17.889 1.00 11.56 H new ATOM 0 HD12 LEU A 125 9.337 -2.039 18.393 1.00 11.56 H new ATOM 0 HD13 LEU A 125 10.278 -0.932 19.025 1.00 11.56 H new ATOM 0 HD21 LEU A 125 12.711 -2.493 19.355 1.00 10.41 H new ATOM 0 HD22 LEU A 125 12.149 -1.588 20.528 1.00 10.41 H new ATOM 0 HD23 LEU A 125 12.450 -3.122 20.785 1.00 10.41 H new ATOM 930 N CYS A 126 8.517 -5.740 20.981 1.00 10.99 N ATOM 931 CA CYS A 126 8.505 -7.074 20.438 1.00 9.75 C ATOM 932 C CYS A 126 7.141 -7.378 19.833 1.00 18.32 C ATOM 933 O CYS A 126 6.988 -7.943 18.743 1.00 12.16 O ATOM 934 CB CYS A 126 8.854 -8.132 21.512 1.00 11.60 C ATOM 935 SG CYS A 126 10.602 -8.005 21.990 1.00 14.95 S ATOM 0 H CYS A 126 8.621 -5.685 21.833 1.00 10.99 H new ATOM 0 HA CYS A 126 9.184 -7.118 19.747 1.00 9.75 H new ATOM 0 HB2 CYS A 126 8.290 -8.007 22.292 1.00 11.60 H new ATOM 0 HB3 CYS A 126 8.671 -9.021 21.169 1.00 11.60 H new ATOM 0 HG CYS A 126 10.745 -7.083 22.745 1.00 14.95 H new ATOM 936 N ARG A 127 6.113 -7.027 20.577 1.00 12.60 N ATOM 937 CA ARG A 127 4.786 -7.306 20.051 1.00 14.01 C ATOM 938 C ARG A 127 4.479 -6.684 18.687 1.00 10.42 C ATOM 939 O ARG A 127 3.921 -7.302 17.762 1.00 11.66 O ATOM 940 CB ARG A 127 3.765 -6.802 21.039 1.00 16.37 C ATOM 941 CG ARG A 127 2.385 -7.337 20.707 1.00 12.80 C ATOM 942 CD ARG A 127 1.380 -6.940 21.781 1.00 24.97 C ATOM 943 NE ARG A 127 1.169 -5.516 21.657 1.00 34.02 N ATOM 944 CZ ARG A 127 1.450 -4.581 22.542 1.00 48.72 C ATOM 945 NH1 ARG A 127 1.961 -4.848 23.763 1.00 31.17 N ATOM 946 NH2 ARG A 127 1.171 -3.324 22.153 1.00 26.89 N ATOM 0 H ARG A 127 6.149 -6.647 21.348 1.00 12.60 H new ATOM 0 HA ARG A 127 4.750 -8.267 19.922 1.00 14.01 H new ATOM 0 HB2 ARG A 127 4.015 -7.074 21.936 1.00 16.37 H new ATOM 0 HB3 ARG A 127 3.751 -5.832 21.030 1.00 16.37 H new ATOM 0 HG2 ARG A 127 2.098 -6.993 19.846 1.00 12.80 H new ATOM 0 HG3 ARG A 127 2.418 -8.303 20.630 1.00 12.80 H new ATOM 0 HD2 ARG A 127 0.546 -7.422 21.665 1.00 24.97 H new ATOM 0 HD3 ARG A 127 1.716 -7.162 22.664 1.00 24.97 H new ATOM 0 HE ARG A 127 0.819 -5.247 20.919 1.00 34.02 H new ATOM 0 HH11 ARG A 127 2.118 -5.661 23.995 1.00 31.17 H new ATOM 0 HH12 ARG A 127 2.129 -4.205 24.309 1.00 31.17 H new ATOM 0 HH21 ARG A 127 0.834 -3.179 21.375 1.00 26.89 H new ATOM 0 HH22 ARG A 127 1.330 -2.665 22.682 1.00 26.89 H new ATOM 947 N ILE A 128 4.776 -5.411 18.585 1.00 10.14 N ATOM 948 CA ILE A 128 4.505 -4.671 17.379 1.00 12.44 C ATOM 949 C ILE A 128 5.308 -5.205 16.195 1.00 16.75 C ATOM 950 O ILE A 128 4.835 -5.244 15.055 1.00 15.36 O ATOM 951 CB ILE A 128 4.805 -3.193 17.533 1.00 19.05 C ATOM 952 CG1 ILE A 128 3.882 -2.469 18.524 1.00 23.76 C ATOM 953 CG2 ILE A 128 4.828 -2.535 16.159 1.00 14.91 C ATOM 954 CD1 ILE A 128 2.398 -2.714 18.305 1.00 24.49 C ATOM 0 H ILE A 128 5.141 -4.950 19.212 1.00 10.14 H new ATOM 0 HA ILE A 128 3.557 -4.787 17.209 1.00 12.44 H new ATOM 0 HB ILE A 128 5.684 -3.113 17.935 1.00 19.05 H new ATOM 0 HG12 ILE A 128 4.114 -2.746 19.424 1.00 23.76 H new ATOM 0 HG13 ILE A 128 4.052 -1.516 18.468 1.00 23.76 H new ATOM 0 HG21 ILE A 128 5.020 -1.589 16.256 1.00 14.91 H new ATOM 0 HG22 ILE A 128 5.514 -2.949 15.613 1.00 14.91 H new ATOM 0 HG23 ILE A 128 3.964 -2.647 15.732 1.00 14.91 H new ATOM 0 HD11 ILE A 128 1.888 -2.224 18.968 1.00 24.49 H new ATOM 0 HD12 ILE A 128 2.148 -2.413 17.418 1.00 24.49 H new ATOM 0 HD13 ILE A 128 2.210 -3.662 18.389 1.00 24.49 H new ATOM 955 N THR A 129 6.541 -5.610 16.488 1.00 12.22 N ATOM 956 CA THR A 129 7.411 -6.167 15.475 1.00 4.77 C ATOM 957 C THR A 129 6.844 -7.489 14.947 1.00 9.22 C ATOM 958 O THR A 129 6.763 -7.748 13.738 1.00 10.01 O ATOM 959 CB THR A 129 8.838 -6.319 16.000 1.00 9.80 C ATOM 960 OG1 THR A 129 9.305 -5.043 16.396 1.00 13.32 O ATOM 961 CG2 THR A 129 9.733 -6.836 14.875 1.00 18.20 C ATOM 0 H THR A 129 6.888 -5.568 17.274 1.00 12.22 H new ATOM 0 HA THR A 129 7.451 -5.550 14.728 1.00 4.77 H new ATOM 0 HB THR A 129 8.855 -6.938 16.747 1.00 9.80 H new ATOM 0 HG1 THR A 129 9.026 -4.870 17.169 1.00 13.32 H new ATOM 0 HG21 THR A 129 10.641 -6.934 15.203 1.00 18.20 H new ATOM 0 HG22 THR A 129 9.405 -7.696 14.570 1.00 18.20 H new ATOM 0 HG23 THR A 129 9.723 -6.206 14.137 1.00 18.20 H new ATOM 962 N GLN A 130 6.409 -8.343 15.853 1.00 8.40 N ATOM 963 CA GLN A 130 5.831 -9.583 15.407 1.00 7.16 C ATOM 964 C GLN A 130 4.565 -9.330 14.571 1.00 15.90 C ATOM 965 O GLN A 130 4.335 -9.937 13.531 1.00 12.29 O ATOM 966 CB GLN A 130 5.438 -10.460 16.606 1.00 10.16 C ATOM 967 CG GLN A 130 5.161 -11.892 16.078 1.00 7.86 C ATOM 968 CD GLN A 130 4.849 -12.844 17.194 1.00 15.34 C ATOM 969 OE1 GLN A 130 4.156 -12.440 18.116 1.00 19.90 O ATOM 970 NE2 GLN A 130 5.347 -14.080 17.134 1.00 11.75 N ATOM 0 H GLN A 130 6.438 -8.227 16.705 1.00 8.40 H new ATOM 0 HA GLN A 130 6.500 -10.033 14.867 1.00 7.16 H new ATOM 0 HB2 GLN A 130 6.150 -10.473 17.265 1.00 10.16 H new ATOM 0 HB3 GLN A 130 4.651 -10.102 17.045 1.00 10.16 H new ATOM 0 HG2 GLN A 130 4.418 -11.869 15.455 1.00 7.86 H new ATOM 0 HG3 GLN A 130 5.934 -12.211 15.587 1.00 7.86 H new ATOM 0 HE21 GLN A 130 5.830 -14.317 16.463 1.00 11.75 H new ATOM 0 HE22 GLN A 130 5.185 -14.640 17.766 1.00 11.75 H new ATOM 971 N GLU A 131 3.700 -8.425 15.046 1.00 13.80 N ATOM 972 CA GLU A 131 2.451 -8.086 14.344 1.00 8.31 C ATOM 973 C GLU A 131 2.740 -7.567 12.967 1.00 16.30 C ATOM 974 O GLU A 131 2.001 -7.826 12.046 1.00 14.89 O ATOM 975 CB GLU A 131 1.689 -6.993 15.119 1.00 6.01 C ATOM 976 CG GLU A 131 1.083 -7.577 16.417 1.00 10.95 C ATOM 977 CD GLU A 131 0.199 -6.597 17.171 1.00 24.56 C ATOM 978 OE1 GLU A 131 -0.005 -5.454 16.792 1.00 38.62 O ATOM 979 OE2 GLU A 131 -0.324 -7.106 18.263 1.00 82.03 O ATOM 0 H GLU A 131 3.819 -7.992 15.780 1.00 13.80 H new ATOM 0 HA GLU A 131 1.916 -8.893 14.284 1.00 8.31 H new ATOM 0 HB2 GLU A 131 2.290 -6.263 15.335 1.00 6.01 H new ATOM 0 HB3 GLU A 131 0.984 -6.625 14.563 1.00 6.01 H new ATOM 0 HG2 GLU A 131 0.563 -8.366 16.196 1.00 10.95 H new ATOM 0 HG3 GLU A 131 1.803 -7.866 17.000 1.00 10.95 H new ATOM 980 N SER A 132 3.822 -6.802 12.832 1.00 11.76 N ATOM 981 CA SER A 132 4.151 -6.284 11.498 1.00 9.18 C ATOM 982 C SER A 132 4.582 -7.415 10.574 1.00 16.40 C ATOM 983 O SER A 132 4.371 -7.370 9.360 1.00 14.99 O ATOM 984 CB SER A 132 5.185 -5.189 11.540 1.00 12.67 C ATOM 985 OG SER A 132 6.471 -5.762 11.739 1.00 15.91 O ATOM 0 H SER A 132 4.358 -6.577 13.466 1.00 11.76 H new ATOM 0 HA SER A 132 3.343 -5.884 11.141 1.00 9.18 H new ATOM 0 HB2 SER A 132 5.170 -4.684 10.712 1.00 12.67 H new ATOM 0 HB3 SER A 132 4.983 -4.567 12.256 1.00 12.67 H new ATOM 0 HG SER A 132 6.435 -6.323 12.363 1.00 15.91 H new ATOM 986 N LEU A 133 5.185 -8.449 11.147 1.00 12.59 N ATOM 987 CA LEU A 133 5.573 -9.547 10.296 1.00 10.84 C ATOM 988 C LEU A 133 4.320 -10.356 9.922 1.00 15.79 C ATOM 989 O LEU A 133 4.134 -10.830 8.788 1.00 13.02 O ATOM 990 CB LEU A 133 6.627 -10.442 10.990 1.00 11.25 C ATOM 991 CG LEU A 133 6.746 -11.845 10.378 1.00 16.88 C ATOM 992 CD1 LEU A 133 7.496 -11.808 9.036 1.00 11.60 C ATOM 993 CD2 LEU A 133 7.571 -12.679 11.329 1.00 15.54 C ATOM 0 H LEU A 133 5.369 -8.529 11.983 1.00 12.59 H new ATOM 0 HA LEU A 133 5.982 -9.198 9.488 1.00 10.84 H new ATOM 0 HB2 LEU A 133 7.491 -10.004 10.945 1.00 11.25 H new ATOM 0 HB3 LEU A 133 6.400 -10.526 11.929 1.00 11.25 H new ATOM 0 HG LEU A 133 5.856 -12.204 10.233 1.00 16.88 H new ATOM 0 HD11 LEU A 133 7.556 -12.706 8.674 1.00 11.60 H new ATOM 0 HD12 LEU A 133 7.017 -11.240 8.413 1.00 11.60 H new ATOM 0 HD13 LEU A 133 8.389 -11.455 9.174 1.00 11.60 H new ATOM 0 HD21 LEU A 133 7.667 -13.576 10.973 1.00 15.54 H new ATOM 0 HD22 LEU A 133 8.448 -12.278 11.435 1.00 15.54 H new ATOM 0 HD23 LEU A 133 7.129 -12.720 12.191 1.00 15.54 H new ATOM 994 N TYR A 134 3.442 -10.527 10.888 1.00 7.09 N ATOM 995 CA TYR A 134 2.243 -11.294 10.597 1.00 8.48 C ATOM 996 C TYR A 134 1.408 -10.599 9.515 1.00 16.73 C ATOM 997 O TYR A 134 0.809 -11.192 8.608 1.00 18.58 O ATOM 998 CB TYR A 134 1.431 -11.405 11.879 1.00 9.20 C ATOM 999 CG TYR A 134 1.914 -12.518 12.766 1.00 12.11 C ATOM 1000 CD1 TYR A 134 3.032 -13.279 12.435 1.00 14.61 C ATOM 1001 CD2 TYR A 134 1.210 -12.861 13.920 1.00 18.65 C ATOM 1002 CE1 TYR A 134 3.436 -14.343 13.244 1.00 10.55 C ATOM 1003 CE2 TYR A 134 1.590 -13.919 14.747 1.00 17.82 C ATOM 1004 CZ TYR A 134 2.716 -14.659 14.400 1.00 15.17 C ATOM 1005 OH TYR A 134 3.117 -15.682 15.212 1.00 18.02 O ATOM 0 H TYR A 134 3.511 -10.223 11.689 1.00 7.09 H new ATOM 0 HA TYR A 134 2.488 -12.174 10.270 1.00 8.48 H new ATOM 0 HB2 TYR A 134 1.478 -10.565 12.363 1.00 9.20 H new ATOM 0 HB3 TYR A 134 0.498 -11.553 11.657 1.00 9.20 H new ATOM 0 HD1 TYR A 134 3.515 -13.076 11.667 1.00 14.61 H new ATOM 0 HD2 TYR A 134 0.457 -12.365 14.148 1.00 18.65 H new ATOM 0 HE1 TYR A 134 4.186 -14.843 13.013 1.00 10.55 H new ATOM 0 HE2 TYR A 134 1.102 -14.124 15.512 1.00 17.82 H new ATOM 0 HH TYR A 134 3.788 -16.060 14.876 1.00 18.02 H new ATOM 1006 N LEU A 135 1.347 -9.297 9.623 1.00 10.49 N ATOM 1007 CA LEU A 135 0.561 -8.513 8.663 1.00 15.42 C ATOM 1008 C LEU A 135 1.044 -8.749 7.243 1.00 11.52 C ATOM 1009 O LEU A 135 0.263 -8.970 6.318 1.00 10.91 O ATOM 1010 CB LEU A 135 0.635 -7.029 9.093 1.00 20.57 C ATOM 1011 CG LEU A 135 0.697 -5.971 8.016 1.00 36.28 C ATOM 1012 CD1 LEU A 135 -0.619 -5.961 7.250 1.00 42.18 C ATOM 1013 CD2 LEU A 135 0.880 -4.645 8.736 1.00 45.18 C ATOM 0 H LEU A 135 1.743 -8.837 10.232 1.00 10.49 H new ATOM 0 HA LEU A 135 -0.368 -8.791 8.666 1.00 15.42 H new ATOM 0 HB2 LEU A 135 -0.140 -6.843 9.646 1.00 20.57 H new ATOM 0 HB3 LEU A 135 1.418 -6.923 9.656 1.00 20.57 H new ATOM 0 HG LEU A 135 1.418 -6.135 7.388 1.00 36.28 H new ATOM 0 HD11 LEU A 135 -0.585 -5.283 6.557 1.00 42.18 H new ATOM 0 HD12 LEU A 135 -0.764 -6.830 6.845 1.00 42.18 H new ATOM 0 HD13 LEU A 135 -1.347 -5.763 7.860 1.00 42.18 H new ATOM 0 HD21 LEU A 135 0.926 -3.927 8.085 1.00 45.18 H new ATOM 0 HD22 LEU A 135 0.129 -4.494 9.331 1.00 45.18 H new ATOM 0 HD23 LEU A 135 1.701 -4.667 9.251 1.00 45.18 H new ATOM 1014 N ALA A 136 2.362 -8.719 7.088 1.00 6.98 N ATOM 1015 CA ALA A 136 2.969 -8.966 5.796 1.00 9.24 C ATOM 1016 C ALA A 136 2.674 -10.374 5.305 1.00 22.49 C ATOM 1017 O ALA A 136 2.452 -10.625 4.103 1.00 14.89 O ATOM 1018 CB ALA A 136 4.474 -8.804 5.890 1.00 11.03 C ATOM 0 H ALA A 136 2.920 -8.557 7.722 1.00 6.98 H new ATOM 0 HA ALA A 136 2.594 -8.324 5.172 1.00 9.24 H new ATOM 0 HB1 ALA A 136 4.872 -8.971 5.022 1.00 11.03 H new ATOM 0 HB2 ALA A 136 4.685 -7.901 6.174 1.00 11.03 H new ATOM 0 HB3 ALA A 136 4.828 -9.436 6.535 1.00 11.03 H new ATOM 1019 N LEU A 137 2.703 -11.321 6.244 1.00 17.72 N ATOM 1020 CA LEU A 137 2.449 -12.696 5.856 1.00 13.43 C ATOM 1021 C LEU A 137 1.070 -12.869 5.273 1.00 18.06 C ATOM 1022 O LEU A 137 0.833 -13.649 4.339 1.00 13.62 O ATOM 1023 CB LEU A 137 2.632 -13.650 7.049 1.00 11.35 C ATOM 1024 CG LEU A 137 4.076 -13.684 7.510 1.00 14.53 C ATOM 1025 CD1 LEU A 137 4.186 -14.566 8.750 1.00 14.20 C ATOM 1026 CD2 LEU A 137 4.910 -14.324 6.422 1.00 18.46 C ATOM 0 H LEU A 137 2.862 -11.191 7.079 1.00 17.72 H new ATOM 0 HA LEU A 137 3.098 -12.918 5.170 1.00 13.43 H new ATOM 0 HB2 LEU A 137 2.063 -13.368 7.782 1.00 11.35 H new ATOM 0 HB3 LEU A 137 2.349 -14.543 6.798 1.00 11.35 H new ATOM 0 HG LEU A 137 4.379 -12.783 7.704 1.00 14.53 H new ATOM 0 HD11 LEU A 137 5.108 -14.591 9.049 1.00 14.20 H new ATOM 0 HD12 LEU A 137 3.628 -14.204 9.456 1.00 14.20 H new ATOM 0 HD13 LEU A 137 3.892 -15.465 8.535 1.00 14.20 H new ATOM 0 HD21 LEU A 137 5.839 -14.354 6.701 1.00 18.46 H new ATOM 0 HD22 LEU A 137 4.593 -15.226 6.259 1.00 18.46 H new ATOM 0 HD23 LEU A 137 4.834 -13.803 5.607 1.00 18.46 H new ATOM 1027 N ARG A 138 0.149 -12.145 5.878 1.00 13.94 N ATOM 1028 CA ARG A 138 -1.244 -12.228 5.455 1.00 17.54 C ATOM 1029 C ARG A 138 -1.515 -11.675 4.072 1.00 21.05 C ATOM 1030 O ARG A 138 -2.565 -11.930 3.495 1.00 20.86 O ATOM 1031 CB ARG A 138 -2.143 -11.527 6.445 1.00 14.49 C ATOM 1032 CG ARG A 138 -2.449 -12.497 7.577 1.00 27.95 C ATOM 1033 CD ARG A 138 -3.479 -11.975 8.572 1.00 57.17 C ATOM 1034 NE ARG A 138 -2.942 -10.995 9.512 1.00 47.18 N ATOM 1035 CZ ARG A 138 -3.236 -9.702 9.434 1.00 81.83 C ATOM 1036 NH1 ARG A 138 -4.042 -9.218 8.477 1.00 67.81 N ATOM 1037 NH2 ARG A 138 -2.708 -8.879 10.338 1.00 40.99 N ATOM 0 H ARG A 138 0.301 -11.604 6.529 1.00 13.94 H new ATOM 0 HA ARG A 138 -1.438 -13.178 5.420 1.00 17.54 H new ATOM 0 HB2 ARG A 138 -1.711 -10.730 6.790 1.00 14.49 H new ATOM 0 HB3 ARG A 138 -2.963 -11.241 6.014 1.00 14.49 H new ATOM 0 HG2 ARG A 138 -2.770 -13.331 7.199 1.00 27.95 H new ATOM 0 HG3 ARG A 138 -1.627 -12.698 8.051 1.00 27.95 H new ATOM 0 HD2 ARG A 138 -4.215 -11.574 8.083 1.00 57.17 H new ATOM 0 HD3 ARG A 138 -3.844 -12.723 9.070 1.00 57.17 H new ATOM 0 HE ARG A 138 -2.417 -11.264 10.138 1.00 47.18 H new ATOM 0 HH11 ARG A 138 -4.383 -9.749 7.893 1.00 67.81 H new ATOM 0 HH12 ARG A 138 -4.217 -8.377 8.447 1.00 67.81 H new ATOM 0 HH21 ARG A 138 -2.191 -9.189 10.952 1.00 40.99 H new ATOM 0 HH22 ARG A 138 -2.884 -8.038 10.308 1.00 40.99 H new ATOM 1038 N MET A 139 -0.583 -10.886 3.561 1.00 12.66 N ATOM 1039 CA MET A 139 -0.757 -10.296 2.259 1.00 13.38 C ATOM 1040 C MET A 139 -0.169 -11.121 1.118 1.00 21.67 C ATOM 1041 O MET A 139 -0.509 -10.929 -0.053 1.00 22.56 O ATOM 1042 CB MET A 139 -0.053 -8.951 2.253 1.00 13.06 C ATOM 1043 CG MET A 139 -0.776 -7.916 3.078 1.00 18.38 C ATOM 1044 SD MET A 139 0.299 -6.457 3.068 1.00 25.07 S ATOM 1045 CE MET A 139 0.049 -5.840 1.378 1.00 23.31 C ATOM 0 H MET A 139 0.154 -10.683 3.955 1.00 12.66 H new ATOM 0 HA MET A 139 -1.713 -10.232 2.109 1.00 13.38 H new ATOM 0 HB2 MET A 139 0.849 -9.060 2.594 1.00 13.06 H new ATOM 0 HB3 MET A 139 0.026 -8.635 1.339 1.00 13.06 H new ATOM 0 HG2 MET A 139 -1.646 -7.712 2.700 1.00 18.38 H new ATOM 0 HG3 MET A 139 -0.927 -8.233 3.982 1.00 18.38 H new ATOM 0 HE1 MET A 139 0.280 -4.899 1.340 1.00 23.31 H new ATOM 0 HE2 MET A 139 0.614 -6.336 0.765 1.00 23.31 H new ATOM 0 HE3 MET A 139 -0.880 -5.955 1.125 1.00 23.31 H new ATOM 1046 N VAL A 140 0.744 -12.007 1.447 1.00 11.94 N ATOM 1047 CA VAL A 140 1.406 -12.797 0.437 1.00 10.35 C ATOM 1048 C VAL A 140 0.485 -13.676 -0.426 1.00 19.57 C ATOM 1049 O VAL A 140 -0.258 -14.524 0.076 1.00 19.56 O ATOM 1050 CB VAL A 140 2.565 -13.629 1.021 1.00 11.04 C ATOM 1051 CG1 VAL A 140 3.115 -14.570 -0.046 1.00 10.33 C ATOM 1052 CG2 VAL A 140 3.705 -12.743 1.540 1.00 9.25 C ATOM 0 H VAL A 140 0.996 -12.167 2.253 1.00 11.94 H new ATOM 0 HA VAL A 140 1.766 -12.133 -0.172 1.00 10.35 H new ATOM 0 HB VAL A 140 2.210 -14.134 1.769 1.00 11.04 H new ATOM 0 HG11 VAL A 140 3.844 -15.091 0.326 1.00 10.33 H new ATOM 0 HG12 VAL A 140 2.411 -15.167 -0.345 1.00 10.33 H new ATOM 0 HG13 VAL A 140 3.440 -14.051 -0.798 1.00 10.33 H new ATOM 0 HG21 VAL A 140 4.412 -13.302 1.898 1.00 9.25 H new ATOM 0 HG22 VAL A 140 4.055 -12.206 0.812 1.00 9.25 H new ATOM 0 HG23 VAL A 140 3.369 -12.160 2.239 1.00 9.25 H new ATOM 1053 N LYS A 141 0.559 -13.490 -1.741 1.00 15.89 N ATOM 1054 CA LYS A 141 -0.187 -14.300 -2.684 1.00 13.38 C ATOM 1055 C LYS A 141 0.299 -14.006 -4.069 1.00 17.85 C ATOM 1056 O LYS A 141 0.918 -12.973 -4.332 1.00 12.77 O ATOM 1057 CB LYS A 141 -1.678 -14.154 -2.632 1.00 16.57 C ATOM 1058 CG LYS A 141 -2.070 -12.812 -3.199 1.00 18.19 C ATOM 1059 CD LYS A 141 -3.540 -12.510 -2.977 1.00 31.59 C ATOM 1060 CE LYS A 141 -3.920 -11.106 -3.414 1.00 38.85 C ATOM 1061 NZ LYS A 141 -5.039 -10.529 -2.651 1.00100.00 N ATOM 0 H LYS A 141 1.048 -12.885 -2.109 1.00 15.89 H new ATOM 0 HA LYS A 141 -0.019 -15.220 -2.425 1.00 13.38 H new ATOM 0 HB2 LYS A 141 -2.101 -14.866 -3.138 1.00 16.57 H new ATOM 0 HB3 LYS A 141 -1.989 -14.233 -1.717 1.00 16.57 H new ATOM 0 HG2 LYS A 141 -1.532 -12.118 -2.787 1.00 18.19 H new ATOM 0 HG3 LYS A 141 -1.877 -12.794 -4.149 1.00 18.19 H new ATOM 0 HD2 LYS A 141 -4.076 -13.154 -3.466 1.00 31.59 H new ATOM 0 HD3 LYS A 141 -3.751 -12.621 -2.037 1.00 31.59 H new ATOM 0 HE2 LYS A 141 -3.146 -10.528 -3.324 1.00 38.85 H new ATOM 0 HE3 LYS A 141 -4.155 -11.122 -4.355 1.00 38.85 H new ATOM 0 HZ1 LYS A 141 -5.213 -9.710 -2.953 1.00100.00 H new ATOM 0 HZ2 LYS A 141 -5.761 -11.041 -2.749 1.00100.00 H new ATOM 0 HZ3 LYS A 141 -4.821 -10.487 -1.789 1.00100.00 H new ATOM 1062 N PRO A 142 0.033 -14.920 -4.970 1.00 16.63 N ATOM 1063 CA PRO A 142 0.517 -14.698 -6.316 1.00 16.92 C ATOM 1064 C PRO A 142 -0.074 -13.458 -6.976 1.00 16.22 C ATOM 1065 O PRO A 142 -1.226 -13.105 -6.760 1.00 16.51 O ATOM 1066 CB PRO A 142 0.240 -15.986 -7.119 1.00 17.13 C ATOM 1067 CG PRO A 142 -0.242 -17.004 -6.105 1.00 21.38 C ATOM 1068 CD PRO A 142 -0.623 -16.247 -4.832 1.00 15.13 C ATOM 0 HA PRO A 142 1.469 -14.514 -6.291 1.00 16.92 H new ATOM 0 HB2 PRO A 142 -0.429 -15.833 -7.804 1.00 17.13 H new ATOM 0 HB3 PRO A 142 1.041 -16.295 -7.570 1.00 17.13 H new ATOM 0 HG2 PRO A 142 -1.004 -17.494 -6.451 1.00 21.38 H new ATOM 0 HG3 PRO A 142 0.453 -17.655 -5.919 1.00 21.38 H new ATOM 0 HD2 PRO A 142 -1.585 -16.157 -4.750 1.00 15.13 H new ATOM 0 HD3 PRO A 142 -0.313 -16.712 -4.039 1.00 15.13 H new ATOM 1069 N GLY A 143 0.730 -12.773 -7.788 1.00 13.48 N ATOM 1070 CA GLY A 143 0.232 -11.606 -8.498 1.00 14.21 C ATOM 1071 C GLY A 143 0.442 -10.274 -7.799 1.00 24.91 C ATOM 1072 O GLY A 143 0.329 -9.222 -8.431 1.00 22.52 O ATOM 0 H GLY A 143 1.554 -12.967 -7.938 1.00 13.48 H new ATOM 0 HA2 GLY A 143 0.661 -11.568 -9.367 1.00 14.21 H new ATOM 0 HA3 GLY A 143 -0.718 -11.724 -8.656 1.00 14.21 H new ATOM 1073 N ILE A 144 0.728 -10.314 -6.493 1.00 14.42 N ATOM 1074 CA ILE A 144 0.899 -9.083 -5.754 1.00 15.42 C ATOM 1075 C ILE A 144 2.340 -8.661 -5.923 1.00 24.02 C ATOM 1076 O ILE A 144 3.181 -9.555 -6.108 1.00 20.99 O ATOM 1077 CB ILE A 144 0.561 -9.378 -4.280 1.00 26.39 C ATOM 1078 CG1 ILE A 144 0.286 -8.148 -3.424 1.00 31.59 C ATOM 1079 CG2 ILE A 144 1.696 -10.160 -3.630 1.00 34.98 C ATOM 0 H ILE A 144 0.824 -11.034 -6.033 1.00 14.42 H new ATOM 0 HA ILE A 144 0.322 -8.368 -6.066 1.00 15.42 H new ATOM 0 HB ILE A 144 -0.263 -9.889 -4.313 1.00 26.39 H new ATOM 0 HG21 ILE A 144 1.475 -10.341 -2.703 1.00 34.98 H new ATOM 0 HG22 ILE A 144 1.823 -10.998 -4.101 1.00 34.98 H new ATOM 0 HG23 ILE A 144 2.513 -9.639 -3.671 1.00 34.98 H new ATOM 1080 N ASN A 145 2.600 -7.329 -5.865 1.00 16.33 N ATOM 1081 CA ASN A 145 3.945 -6.797 -5.942 1.00 14.91 C ATOM 1082 C ASN A 145 4.555 -6.674 -4.541 1.00 18.65 C ATOM 1083 O ASN A 145 3.922 -6.168 -3.579 1.00 15.50 O ATOM 1084 CB ASN A 145 3.944 -5.412 -6.593 1.00 23.82 C ATOM 1085 CG ASN A 145 5.312 -4.971 -7.095 1.00 28.93 C ATOM 1086 OD1 ASN A 145 6.293 -4.894 -6.366 1.00 20.37 O ATOM 1087 ND2 ASN A 145 5.396 -4.716 -8.387 1.00 38.60 N ATOM 0 H ASN A 145 1.990 -6.729 -5.780 1.00 16.33 H new ATOM 0 HA ASN A 145 4.472 -7.410 -6.479 1.00 14.91 H new ATOM 0 HB2 ASN A 145 3.321 -5.413 -7.336 1.00 23.82 H new ATOM 0 HB3 ASN A 145 3.619 -4.762 -5.951 1.00 23.82 H new ATOM 0 HD21 ASN A 145 6.151 -4.491 -8.733 1.00 38.60 H new ATOM 0 HD22 ASN A 145 4.696 -4.775 -8.883 1.00 38.60 H new ATOM 1088 N LEU A 146 5.818 -7.094 -4.438 1.00 20.36 N ATOM 1089 CA LEU A 146 6.545 -7.017 -3.157 1.00 22.45 C ATOM 1090 C LEU A 146 6.470 -5.620 -2.568 1.00 22.74 C ATOM 1091 O LEU A 146 6.415 -5.431 -1.358 1.00 19.23 O ATOM 1092 CB LEU A 146 8.033 -7.349 -3.318 1.00 25.92 C ATOM 1093 CG LEU A 146 8.456 -8.754 -2.932 1.00 28.28 C ATOM 1094 CD1 LEU A 146 9.982 -8.857 -3.118 1.00 17.74 C ATOM 1095 CD2 LEU A 146 8.009 -9.107 -1.508 1.00 22.91 C ATOM 0 H LEU A 146 6.272 -7.425 -5.089 1.00 20.36 H new ATOM 0 HA LEU A 146 6.119 -7.665 -2.575 1.00 22.45 H new ATOM 0 HB2 LEU A 146 8.279 -7.201 -4.245 1.00 25.92 H new ATOM 0 HB3 LEU A 146 8.544 -6.720 -2.785 1.00 25.92 H new ATOM 0 HG LEU A 146 8.021 -9.405 -3.505 1.00 28.28 H new ATOM 0 HD11 LEU A 146 10.278 -9.749 -2.877 1.00 17.74 H new ATOM 0 HD12 LEU A 146 10.208 -8.681 -4.045 1.00 17.74 H new ATOM 0 HD13 LEU A 146 10.422 -8.206 -2.549 1.00 17.74 H new ATOM 0 HD21 LEU A 146 8.294 -10.009 -1.293 1.00 22.91 H new ATOM 0 HD22 LEU A 146 8.407 -8.484 -0.880 1.00 22.91 H new ATOM 0 HD23 LEU A 146 7.042 -9.051 -1.449 1.00 22.91 H new ATOM 1096 N ARG A 147 6.490 -4.603 -3.447 1.00 23.80 N ATOM 1097 CA ARG A 147 6.422 -3.211 -2.973 1.00 24.82 C ATOM 1098 C ARG A 147 5.280 -2.993 -1.976 1.00 16.92 C ATOM 1099 O ARG A 147 5.433 -2.331 -0.965 1.00 18.15 O ATOM 1100 CB ARG A 147 6.299 -2.197 -4.111 1.00 27.01 C ATOM 1101 CG ARG A 147 6.237 -0.764 -3.587 1.00 30.40 C ATOM 1102 CD ARG A 147 6.289 0.308 -4.671 1.00 21.35 C ATOM 1103 NE ARG A 147 6.117 1.629 -4.085 1.00 21.56 N ATOM 1104 CZ ARG A 147 5.957 2.744 -4.775 1.00 30.82 C ATOM 1105 NH1 ARG A 147 5.958 2.727 -6.104 1.00 34.12 N ATOM 1106 NH2 ARG A 147 5.781 3.891 -4.114 1.00 26.27 N ATOM 0 H ARG A 147 6.541 -4.695 -4.301 1.00 23.80 H new ATOM 0 HA ARG A 147 7.268 -3.059 -2.523 1.00 24.82 H new ATOM 0 HB2 ARG A 147 7.056 -2.290 -4.711 1.00 27.01 H new ATOM 0 HB3 ARG A 147 5.501 -2.387 -4.629 1.00 27.01 H new ATOM 0 HG2 ARG A 147 5.419 -0.653 -3.077 1.00 30.40 H new ATOM 0 HG3 ARG A 147 6.975 -0.624 -2.973 1.00 30.40 H new ATOM 0 HD2 ARG A 147 7.138 0.263 -5.139 1.00 21.35 H new ATOM 0 HD3 ARG A 147 5.594 0.146 -5.328 1.00 21.35 H new ATOM 0 HE ARG A 147 6.120 1.688 -3.227 1.00 21.56 H new ATOM 0 HH11 ARG A 147 6.064 1.984 -6.524 1.00 34.12 H new ATOM 0 HH12 ARG A 147 5.853 3.459 -6.543 1.00 34.12 H new ATOM 0 HH21 ARG A 147 5.773 3.895 -3.254 1.00 26.27 H new ATOM 0 HH22 ARG A 147 5.675 4.626 -4.548 1.00 26.27 H new ATOM 1107 N GLU A 148 4.137 -3.566 -2.273 1.00 12.69 N ATOM 1108 CA GLU A 148 2.985 -3.397 -1.415 1.00 16.00 C ATOM 1109 C GLU A 148 3.229 -3.936 -0.017 1.00 17.94 C ATOM 1110 O GLU A 148 2.724 -3.431 0.951 1.00 14.23 O ATOM 1111 CB GLU A 148 1.796 -4.166 -2.013 1.00 17.15 C ATOM 1112 CG GLU A 148 1.405 -3.631 -3.397 1.00 38.26 C ATOM 1113 CD GLU A 148 0.199 -4.337 -3.960 1.00 80.85 C ATOM 1114 OE1 GLU A 148 -0.903 -4.292 -3.435 1.00100.00 O ATOM 1115 OE2 GLU A 148 0.455 -5.014 -5.062 1.00 40.06 O ATOM 0 H GLU A 148 4.004 -4.057 -2.966 1.00 12.69 H new ATOM 0 HA GLU A 148 2.805 -2.446 -1.355 1.00 16.00 H new ATOM 0 HB2 GLU A 148 2.022 -5.107 -2.083 1.00 17.15 H new ATOM 0 HB3 GLU A 148 1.035 -4.100 -1.415 1.00 17.15 H new ATOM 0 HG2 GLU A 148 1.222 -2.681 -3.335 1.00 38.26 H new ATOM 0 HG3 GLU A 148 2.153 -3.736 -4.006 1.00 38.26 H new ATOM 1116 N ILE A 149 3.976 -5.003 0.101 1.00 17.68 N ATOM 1117 CA ILE A 149 4.199 -5.541 1.422 1.00 15.16 C ATOM 1118 C ILE A 149 5.096 -4.652 2.277 1.00 20.07 C ATOM 1119 O ILE A 149 4.871 -4.433 3.465 1.00 17.20 O ATOM 1120 CB ILE A 149 4.752 -6.959 1.296 1.00 24.31 C ATOM 1121 CG1 ILE A 149 3.612 -7.902 0.944 1.00 26.20 C ATOM 1122 CG2 ILE A 149 5.429 -7.449 2.570 1.00 22.77 C ATOM 1123 CD1 ILE A 149 4.134 -9.085 0.154 1.00 22.86 C ATOM 0 H ILE A 149 4.355 -5.424 -0.546 1.00 17.68 H new ATOM 0 HA ILE A 149 3.349 -5.570 1.889 1.00 15.16 H new ATOM 0 HB ILE A 149 5.428 -6.946 0.600 1.00 24.31 H new ATOM 0 HG12 ILE A 149 3.178 -8.212 1.754 1.00 26.20 H new ATOM 0 HG13 ILE A 149 2.941 -7.430 0.426 1.00 26.20 H new ATOM 0 HG21 ILE A 149 5.760 -8.351 2.434 1.00 22.77 H new ATOM 0 HG22 ILE A 149 6.170 -6.862 2.789 1.00 22.77 H new ATOM 0 HG23 ILE A 149 4.789 -7.446 3.299 1.00 22.77 H new ATOM 0 HD11 ILE A 149 3.398 -9.679 -0.064 1.00 22.86 H new ATOM 0 HD12 ILE A 149 4.549 -8.770 -0.664 1.00 22.86 H new ATOM 0 HD13 ILE A 149 4.789 -9.565 0.684 1.00 22.86 H new ATOM 1124 N GLY A 150 6.145 -4.126 1.675 1.00 17.90 N ATOM 1125 CA GLY A 150 7.067 -3.270 2.409 1.00 14.82 C ATOM 1126 C GLY A 150 6.367 -2.030 2.876 1.00 23.15 C ATOM 1127 O GLY A 150 6.548 -1.576 4.016 1.00 23.47 O ATOM 0 H GLY A 150 6.344 -4.248 0.847 1.00 17.90 H new ATOM 0 HA2 GLY A 150 7.428 -3.751 3.170 1.00 14.82 H new ATOM 0 HA3 GLY A 150 7.817 -3.031 1.842 1.00 14.82 H new ATOM 1128 N ALA A 151 5.549 -1.496 1.975 1.00 12.89 N ATOM 1129 CA ALA A 151 4.808 -0.304 2.313 1.00 14.46 C ATOM 1130 C ALA A 151 3.821 -0.557 3.489 1.00 19.77 C ATOM 1131 O ALA A 151 3.613 0.266 4.406 1.00 17.89 O ATOM 1132 CB ALA A 151 4.124 0.274 1.060 1.00 14.83 C ATOM 0 H ALA A 151 5.415 -1.804 1.183 1.00 12.89 H new ATOM 0 HA ALA A 151 5.429 0.369 2.634 1.00 14.46 H new ATOM 0 HB1 ALA A 151 3.630 1.073 1.300 1.00 14.83 H new ATOM 0 HB2 ALA A 151 4.797 0.497 0.398 1.00 14.83 H new ATOM 0 HB3 ALA A 151 3.514 -0.384 0.692 1.00 14.83 H new ATOM 1133 N ALA A 152 3.162 -1.709 3.493 1.00 13.96 N ATOM 1134 CA ALA A 152 2.224 -1.982 4.591 1.00 16.30 C ATOM 1135 C ALA A 152 2.944 -2.092 5.960 1.00 18.44 C ATOM 1136 O ALA A 152 2.472 -1.625 6.986 1.00 13.21 O ATOM 1137 CB ALA A 152 1.444 -3.279 4.301 1.00 15.03 C ATOM 0 H ALA A 152 3.233 -2.327 2.899 1.00 13.96 H new ATOM 0 HA ALA A 152 1.610 -1.233 4.645 1.00 16.30 H new ATOM 0 HB1 ALA A 152 0.827 -3.455 5.028 1.00 15.03 H new ATOM 0 HB2 ALA A 152 0.948 -3.180 3.473 1.00 15.03 H new ATOM 0 HB3 ALA A 152 2.066 -4.019 4.219 1.00 15.03 H new ATOM 1138 N ILE A 153 4.098 -2.767 5.967 1.00 14.71 N ATOM 1139 CA ILE A 153 4.868 -2.928 7.163 1.00 10.51 C ATOM 1140 C ILE A 153 5.230 -1.545 7.664 1.00 15.78 C ATOM 1141 O ILE A 153 4.973 -1.189 8.793 1.00 14.65 O ATOM 1142 CB ILE A 153 6.116 -3.719 6.854 1.00 12.74 C ATOM 1143 CG1 ILE A 153 5.721 -5.153 6.598 1.00 10.44 C ATOM 1144 CG2 ILE A 153 7.098 -3.637 8.029 1.00 10.90 C ATOM 1145 CD1 ILE A 153 6.909 -6.017 6.147 1.00 12.49 C ATOM 0 H ILE A 153 4.441 -3.137 5.271 1.00 14.71 H new ATOM 0 HA ILE A 153 4.364 -3.406 7.840 1.00 10.51 H new ATOM 0 HB ILE A 153 6.555 -3.354 6.070 1.00 12.74 H new ATOM 0 HG12 ILE A 153 5.339 -5.530 7.406 1.00 10.44 H new ATOM 0 HG13 ILE A 153 5.029 -5.179 5.918 1.00 10.44 H new ATOM 0 HG21 ILE A 153 7.896 -4.148 7.821 1.00 10.90 H new ATOM 0 HG22 ILE A 153 7.340 -2.711 8.185 1.00 10.90 H new ATOM 0 HG23 ILE A 153 6.681 -4.000 8.826 1.00 10.90 H new ATOM 0 HD11 ILE A 153 6.609 -6.927 5.995 1.00 12.49 H new ATOM 0 HD12 ILE A 153 7.278 -5.657 5.325 1.00 12.49 H new ATOM 0 HD13 ILE A 153 7.592 -6.013 6.836 1.00 12.49 H new ATOM 1146 N GLN A 154 5.808 -0.748 6.783 1.00 11.28 N ATOM 1147 CA GLN A 154 6.195 0.590 7.160 1.00 12.38 C ATOM 1148 C GLN A 154 5.067 1.414 7.725 1.00 16.75 C ATOM 1149 O GLN A 154 5.193 2.073 8.761 1.00 18.75 O ATOM 1150 CB GLN A 154 6.804 1.340 5.960 1.00 16.33 C ATOM 1151 CG GLN A 154 7.276 2.771 6.303 1.00 12.57 C ATOM 1152 CD GLN A 154 7.968 3.482 5.165 1.00 26.01 C ATOM 1153 OE1 GLN A 154 7.881 3.064 3.988 1.00 25.94 O ATOM 1154 NE2 GLN A 154 8.662 4.555 5.527 1.00 23.71 N ATOM 0 H GLN A 154 5.983 -0.963 5.969 1.00 11.28 H new ATOM 0 HA GLN A 154 6.853 0.477 7.864 1.00 12.38 H new ATOM 0 HB2 GLN A 154 7.556 0.832 5.618 1.00 16.33 H new ATOM 0 HB3 GLN A 154 6.146 1.386 5.249 1.00 16.33 H new ATOM 0 HG2 GLN A 154 6.509 3.296 6.581 1.00 12.57 H new ATOM 0 HG3 GLN A 154 7.881 2.729 7.060 1.00 12.57 H new ATOM 0 HE21 GLN A 154 8.685 4.794 6.353 1.00 23.71 H new ATOM 0 HE22 GLN A 154 9.089 5.011 4.936 1.00 23.71 H new ATOM 1155 N LYS A 155 3.970 1.445 7.008 1.00 10.90 N ATOM 1156 CA LYS A 155 2.894 2.245 7.503 1.00 12.87 C ATOM 1157 C LYS A 155 2.447 1.789 8.882 1.00 19.56 C ATOM 1158 O LYS A 155 2.091 2.582 9.756 1.00 15.38 O ATOM 1159 CB LYS A 155 1.706 2.204 6.548 1.00 19.19 C ATOM 1160 CG LYS A 155 1.715 3.380 5.585 1.00 44.72 C ATOM 0 H LYS A 155 3.833 1.030 6.267 1.00 10.90 H new ATOM 0 HA LYS A 155 3.223 3.155 7.570 1.00 12.87 H new ATOM 0 HB2 LYS A 155 1.723 1.374 6.046 1.00 19.19 H new ATOM 0 HB3 LYS A 155 0.881 2.210 7.058 1.00 19.19 H new ATOM 1161 N PHE A 156 2.449 0.482 9.091 1.00 15.80 N ATOM 1162 CA PHE A 156 2.001 -0.063 10.359 1.00 11.02 C ATOM 1163 C PHE A 156 2.895 0.365 11.504 1.00 12.66 C ATOM 1164 O PHE A 156 2.511 0.883 12.546 1.00 13.59 O ATOM 1165 CB PHE A 156 1.924 -1.598 10.259 1.00 12.55 C ATOM 1166 CG PHE A 156 1.569 -2.250 11.581 1.00 21.00 C ATOM 1167 CD1 PHE A 156 0.273 -2.179 12.101 1.00 31.19 C ATOM 1168 CD2 PHE A 156 2.534 -2.922 12.336 1.00 17.93 C ATOM 1169 CE1 PHE A 156 -0.067 -2.774 13.320 1.00 26.72 C ATOM 1170 CE2 PHE A 156 2.213 -3.506 13.564 1.00 18.73 C ATOM 1171 CZ PHE A 156 0.914 -3.444 14.057 1.00 15.26 C ATOM 0 H PHE A 156 2.704 -0.103 8.515 1.00 15.80 H new ATOM 0 HA PHE A 156 1.117 0.289 10.549 1.00 11.02 H new ATOM 0 HB2 PHE A 156 1.262 -1.843 9.593 1.00 12.55 H new ATOM 0 HB3 PHE A 156 2.777 -1.942 9.951 1.00 12.55 H new ATOM 0 HD1 PHE A 156 -0.381 -1.723 11.623 1.00 31.19 H new ATOM 0 HD2 PHE A 156 3.405 -2.982 12.015 1.00 17.93 H new ATOM 0 HE1 PHE A 156 -0.939 -2.724 13.638 1.00 26.72 H new ATOM 0 HE2 PHE A 156 2.873 -3.939 14.055 1.00 18.73 H new ATOM 0 HZ PHE A 156 0.700 -3.844 14.869 1.00 15.26 H new ATOM 1172 N VAL A 157 4.141 0.103 11.289 1.00 12.35 N ATOM 1173 CA VAL A 157 5.164 0.412 12.266 1.00 14.09 C ATOM 1174 C VAL A 157 5.242 1.862 12.627 1.00 16.01 C ATOM 1175 O VAL A 157 5.369 2.173 13.789 1.00 14.86 O ATOM 1176 CB VAL A 157 6.520 -0.091 11.777 1.00 18.41 C ATOM 1177 CG1 VAL A 157 7.653 0.549 12.548 1.00 20.76 C ATOM 1178 CG2 VAL A 157 6.526 -1.601 11.915 1.00 14.65 C ATOM 0 H VAL A 157 4.437 -0.263 10.569 1.00 12.35 H new ATOM 0 HA VAL A 157 4.911 -0.049 13.081 1.00 14.09 H new ATOM 0 HB VAL A 157 6.656 0.154 10.848 1.00 18.41 H new ATOM 0 HG11 VAL A 157 8.500 0.212 12.217 1.00 20.76 H new ATOM 0 HG12 VAL A 157 7.621 1.511 12.432 1.00 20.76 H new ATOM 0 HG13 VAL A 157 7.566 0.334 13.490 1.00 20.76 H new ATOM 0 HG21 VAL A 157 7.378 -1.951 11.611 1.00 14.65 H new ATOM 0 HG22 VAL A 157 6.392 -1.842 12.845 1.00 14.65 H new ATOM 0 HG23 VAL A 157 5.812 -1.978 11.378 1.00 14.65 H new ATOM 1179 N GLU A 158 5.234 2.736 11.627 1.00 11.02 N ATOM 1180 CA GLU A 158 5.333 4.170 11.871 1.00 10.53 C ATOM 1181 C GLU A 158 4.123 4.693 12.616 1.00 17.22 C ATOM 1182 O GLU A 158 4.258 5.545 13.487 1.00 22.47 O ATOM 1183 CB GLU A 158 5.586 4.947 10.579 1.00 12.44 C ATOM 1184 CG GLU A 158 6.918 4.507 9.961 1.00 18.44 C ATOM 1185 CD GLU A 158 7.303 5.373 8.808 1.00 22.82 C ATOM 1186 OE1 GLU A 158 6.533 6.148 8.325 1.00 23.21 O ATOM 1187 OE2 GLU A 158 8.539 5.220 8.403 1.00 19.54 O ATOM 0 H GLU A 158 5.172 2.518 10.797 1.00 11.02 H new ATOM 0 HA GLU A 158 6.104 4.313 12.443 1.00 10.53 H new ATOM 0 HB2 GLU A 158 4.862 4.793 9.952 1.00 12.44 H new ATOM 0 HB3 GLU A 158 5.604 5.899 10.763 1.00 12.44 H new ATOM 0 HG2 GLU A 158 7.614 4.538 10.636 1.00 18.44 H new ATOM 0 HG3 GLU A 158 6.850 3.586 9.666 1.00 18.44 H new ATOM 1188 N ALA A 159 2.948 4.125 12.327 1.00 10.45 N ATOM 1189 CA ALA A 159 1.717 4.495 12.989 1.00 14.59 C ATOM 1190 C ALA A 159 1.798 4.191 14.465 1.00 18.18 C ATOM 1191 O ALA A 159 1.130 4.819 15.260 1.00 17.52 O ATOM 1192 CB ALA A 159 0.548 3.738 12.393 1.00 16.08 C ATOM 0 H ALA A 159 2.853 3.509 11.734 1.00 10.45 H new ATOM 0 HA ALA A 159 1.584 5.448 12.863 1.00 14.59 H new ATOM 0 HB1 ALA A 159 -0.270 3.996 12.846 1.00 16.08 H new ATOM 0 HB2 ALA A 159 0.474 3.948 11.449 1.00 16.08 H new ATOM 0 HB3 ALA A 159 0.690 2.785 12.502 1.00 16.08 H new ATOM 1193 N GLU A 160 2.641 3.226 14.838 1.00 17.59 N ATOM 1194 CA GLU A 160 2.789 2.865 16.229 1.00 11.58 C ATOM 1195 C GLU A 160 3.885 3.641 16.942 1.00 17.38 C ATOM 1196 O GLU A 160 4.206 3.323 18.071 1.00 19.87 O ATOM 1197 CB GLU A 160 3.064 1.379 16.344 1.00 11.81 C ATOM 1198 CG GLU A 160 1.926 0.549 15.752 1.00 18.17 C ATOM 1199 CD GLU A 160 0.708 0.696 16.616 1.00 60.20 C ATOM 1200 OE1 GLU A 160 0.790 0.937 17.812 1.00 32.87 O ATOM 1201 OE2 GLU A 160 -0.423 0.594 15.953 1.00 55.72 O ATOM 0 H GLU A 160 3.132 2.774 14.295 1.00 17.59 H new ATOM 0 HA GLU A 160 1.954 3.095 16.665 1.00 11.58 H new ATOM 0 HB2 GLU A 160 3.893 1.166 15.887 1.00 11.81 H new ATOM 0 HB3 GLU A 160 3.186 1.143 17.277 1.00 11.81 H new ATOM 0 HG2 GLU A 160 1.732 0.844 14.848 1.00 18.17 H new ATOM 0 HG3 GLU A 160 2.186 -0.384 15.697 1.00 18.17 H new ATOM 1202 N GLY A 161 4.477 4.617 16.274 1.00 18.00 N ATOM 1203 CA GLY A 161 5.506 5.460 16.816 1.00 14.37 C ATOM 1204 C GLY A 161 6.921 4.925 16.729 1.00 18.55 C ATOM 1205 O GLY A 161 7.838 5.467 17.362 1.00 14.40 O ATOM 0 H GLY A 161 4.277 4.808 15.460 1.00 18.00 H new ATOM 0 HA2 GLY A 161 5.474 6.314 16.357 1.00 14.37 H new ATOM 0 HA3 GLY A 161 5.301 5.631 17.749 1.00 14.37 H new ATOM 1206 N PHE A 162 7.115 3.864 15.960 1.00 9.05 N ATOM 1207 CA PHE A 162 8.434 3.267 15.811 1.00 5.55 C ATOM 1208 C PHE A 162 9.028 3.513 14.451 1.00 15.28 C ATOM 1209 O PHE A 162 8.434 4.166 13.630 1.00 16.70 O ATOM 1210 CB PHE A 162 8.408 1.770 16.065 1.00 8.68 C ATOM 1211 CG PHE A 162 8.018 1.463 17.487 1.00 17.33 C ATOM 1212 CD1 PHE A 162 8.509 2.227 18.545 1.00 17.20 C ATOM 1213 CD2 PHE A 162 7.187 0.382 17.783 1.00 15.03 C ATOM 1214 CE1 PHE A 162 8.160 1.925 19.859 1.00 17.77 C ATOM 1215 CE2 PHE A 162 6.845 0.063 19.095 1.00 16.36 C ATOM 1216 CZ PHE A 162 7.316 0.853 20.139 1.00 12.21 C ATOM 0 H PHE A 162 6.493 3.472 15.513 1.00 9.05 H new ATOM 0 HA PHE A 162 8.990 3.700 16.478 1.00 5.55 H new ATOM 0 HB2 PHE A 162 7.781 1.348 15.457 1.00 8.68 H new ATOM 0 HB3 PHE A 162 9.282 1.393 15.878 1.00 8.68 H new ATOM 0 HD1 PHE A 162 9.075 2.945 18.372 1.00 17.20 H new ATOM 0 HD2 PHE A 162 6.854 -0.138 17.088 1.00 15.03 H new ATOM 0 HE1 PHE A 162 8.493 2.444 20.555 1.00 17.77 H new ATOM 0 HE2 PHE A 162 6.305 -0.673 19.272 1.00 16.36 H new ATOM 0 HZ PHE A 162 7.069 0.667 21.016 1.00 12.21 H new ATOM 1217 N SER A 163 10.213 2.980 14.194 1.00 13.60 N ATOM 1218 CA SER A 163 10.813 3.196 12.885 1.00 12.24 C ATOM 1219 C SER A 163 11.306 1.894 12.256 1.00 16.70 C ATOM 1220 O SER A 163 11.596 0.912 12.962 1.00 17.03 O ATOM 1221 CB SER A 163 11.900 4.250 12.946 1.00 14.14 C ATOM 1222 OG SER A 163 12.964 3.737 13.679 1.00 25.29 O ATOM 0 H SER A 163 10.675 2.505 14.742 1.00 13.60 H new ATOM 0 HA SER A 163 10.117 3.534 12.300 1.00 12.24 H new ATOM 0 HB2 SER A 163 12.190 4.489 12.052 1.00 14.14 H new ATOM 0 HB3 SER A 163 11.563 5.060 13.361 1.00 14.14 H new ATOM 0 HG SER A 163 13.000 4.119 14.426 1.00 25.29 H new ATOM 1223 N VAL A 164 11.398 1.859 10.921 1.00 11.10 N ATOM 1224 CA VAL A 164 11.845 0.624 10.276 1.00 13.93 C ATOM 1225 C VAL A 164 13.233 0.754 9.712 1.00 14.96 C ATOM 1226 O VAL A 164 13.526 1.761 9.072 1.00 16.50 O ATOM 1227 CB VAL A 164 10.844 0.090 9.216 1.00 22.44 C ATOM 1228 CG1 VAL A 164 10.499 1.186 8.218 1.00 28.23 C ATOM 1229 CG2 VAL A 164 11.494 -1.030 8.418 1.00 19.56 C ATOM 0 H VAL A 164 11.214 2.511 10.392 1.00 11.10 H new ATOM 0 HA VAL A 164 11.876 -0.044 10.979 1.00 13.93 H new ATOM 0 HB VAL A 164 10.051 -0.217 9.683 1.00 22.44 H new ATOM 0 HG11 VAL A 164 9.874 0.841 7.562 1.00 28.23 H new ATOM 0 HG12 VAL A 164 10.096 1.934 8.685 1.00 28.23 H new ATOM 0 HG13 VAL A 164 11.307 1.482 7.770 1.00 28.23 H new ATOM 0 HG21 VAL A 164 10.867 -1.362 7.756 1.00 19.56 H new ATOM 0 HG22 VAL A 164 12.286 -0.692 7.971 1.00 19.56 H new ATOM 0 HG23 VAL A 164 11.744 -1.751 9.017 1.00 19.56 H new ATOM 1230 N VAL A 165 14.091 -0.254 9.949 1.00 8.95 N ATOM 1231 CA VAL A 165 15.463 -0.226 9.435 1.00 8.84 C ATOM 1232 C VAL A 165 15.468 -0.399 7.931 1.00 16.92 C ATOM 1233 O VAL A 165 14.816 -1.306 7.417 1.00 13.61 O ATOM 1234 CB VAL A 165 16.284 -1.315 10.079 1.00 15.09 C ATOM 1235 CG1 VAL A 165 17.620 -1.432 9.372 1.00 11.25 C ATOM 1236 CG2 VAL A 165 16.459 -0.929 11.544 1.00 19.06 C ATOM 0 H VAL A 165 13.894 -0.957 10.403 1.00 8.95 H new ATOM 0 HA VAL A 165 15.854 0.635 9.652 1.00 8.84 H new ATOM 0 HB VAL A 165 15.849 -2.180 10.014 1.00 15.09 H new ATOM 0 HG11 VAL A 165 18.146 -2.133 9.788 1.00 11.25 H new ATOM 0 HG12 VAL A 165 17.474 -1.649 8.438 1.00 11.25 H new ATOM 0 HG13 VAL A 165 18.096 -0.589 9.437 1.00 11.25 H new ATOM 0 HG21 VAL A 165 16.984 -1.607 11.997 1.00 19.06 H new ATOM 0 HG22 VAL A 165 16.915 -0.075 11.602 1.00 19.06 H new ATOM 0 HG23 VAL A 165 15.589 -0.859 11.967 1.00 19.06 H new ATOM 1237 N ARG A 166 16.194 0.467 7.212 1.00 12.36 N ATOM 1238 CA ARG A 166 16.161 0.365 5.756 1.00 15.17 C ATOM 1239 C ARG A 166 17.142 -0.571 5.127 1.00 19.69 C ATOM 1240 O ARG A 166 16.841 -1.234 4.138 1.00 20.50 O ATOM 1241 CB ARG A 166 16.370 1.718 5.095 1.00 17.27 C ATOM 1242 CG ARG A 166 15.600 2.829 5.760 1.00 19.17 C ATOM 1243 CD ARG A 166 14.231 3.108 5.156 1.00 28.94 C ATOM 1244 NE ARG A 166 13.324 3.202 6.272 1.00 59.15 N ATOM 1245 CZ ARG A 166 12.437 4.135 6.527 1.00 52.21 C ATOM 1246 NH1 ARG A 166 12.193 5.170 5.729 1.00 30.08 N ATOM 1247 NH2 ARG A 166 11.749 3.984 7.643 1.00 47.29 N ATOM 0 H ARG A 166 16.689 1.092 7.534 1.00 12.36 H new ATOM 0 HA ARG A 166 15.274 0.003 5.602 1.00 15.17 H new ATOM 0 HB2 ARG A 166 17.315 1.935 5.108 1.00 17.27 H new ATOM 0 HB3 ARG A 166 16.105 1.661 4.164 1.00 17.27 H new ATOM 0 HG2 ARG A 166 15.487 2.610 6.698 1.00 19.17 H new ATOM 0 HG3 ARG A 166 16.129 3.641 5.720 1.00 19.17 H new ATOM 0 HD2 ARG A 166 14.238 3.931 4.642 1.00 28.94 H new ATOM 0 HD3 ARG A 166 13.966 2.398 4.551 1.00 28.94 H new ATOM 0 HE ARG A 166 13.370 2.563 6.846 1.00 59.15 H new ATOM 0 HH11 ARG A 166 12.629 5.258 4.993 1.00 30.08 H new ATOM 0 HH12 ARG A 166 11.599 5.751 5.949 1.00 30.08 H new ATOM 0 HH21 ARG A 166 11.896 3.305 8.150 1.00 47.29 H new ATOM 0 HH22 ARG A 166 11.153 4.564 7.863 1.00 47.29 H new ATOM 1248 N GLU A 167 18.313 -0.577 5.716 1.00 18.46 N ATOM 1249 CA GLU A 167 19.476 -1.327 5.249 1.00 22.57 C ATOM 1250 C GLU A 167 19.460 -2.830 5.143 1.00 24.84 C ATOM 1251 O GLU A 167 20.114 -3.412 4.269 1.00 26.31 O ATOM 1252 CB GLU A 167 20.756 -0.918 5.986 1.00 18.80 C ATOM 1253 CG GLU A 167 21.064 0.543 5.720 1.00 21.43 C ATOM 1254 CD GLU A 167 20.339 1.454 6.661 1.00 29.19 C ATOM 1255 OE1 GLU A 167 19.386 1.143 7.380 1.00 23.79 O ATOM 1256 OE2 GLU A 167 20.857 2.635 6.595 1.00 30.38 O ATOM 0 H GLU A 167 18.470 -0.127 6.432 1.00 18.46 H new ATOM 0 HA GLU A 167 19.440 -1.051 4.320 1.00 22.57 H new ATOM 0 HB2 GLU A 167 20.651 -1.066 6.939 1.00 18.80 H new ATOM 0 HB3 GLU A 167 21.497 -1.471 5.693 1.00 18.80 H new ATOM 0 HG2 GLU A 167 22.019 0.690 5.801 1.00 21.43 H new ATOM 0 HG3 GLU A 167 20.820 0.762 4.807 1.00 21.43 H new ATOM 1257 N TYR A 168 18.837 -3.476 6.078 1.00 15.54 N ATOM 1258 CA TYR A 168 18.880 -4.918 5.989 1.00 16.64 C ATOM 1259 C TYR A 168 17.487 -5.336 5.629 1.00 24.63 C ATOM 1260 O TYR A 168 16.557 -4.573 5.942 1.00 22.99 O ATOM 1261 CB TYR A 168 19.441 -5.591 7.260 1.00 25.55 C ATOM 1262 CG TYR A 168 20.919 -5.288 7.446 1.00 28.83 C ATOM 1263 CD1 TYR A 168 21.898 -6.214 7.080 1.00 28.60 C ATOM 1264 CD2 TYR A 168 21.329 -4.053 7.949 1.00 26.13 C ATOM 1265 CE1 TYR A 168 23.253 -5.920 7.231 1.00 31.10 C ATOM 1266 CE2 TYR A 168 22.681 -3.736 8.089 1.00 26.29 C ATOM 1267 CZ TYR A 168 23.647 -4.679 7.736 1.00 30.41 C ATOM 1268 OH TYR A 168 24.985 -4.372 7.892 1.00 55.25 O ATOM 0 H TYR A 168 18.405 -3.137 6.740 1.00 15.54 H new ATOM 0 HA TYR A 168 19.507 -5.215 5.311 1.00 16.64 H new ATOM 0 HB2 TYR A 168 18.946 -5.283 8.036 1.00 25.55 H new ATOM 0 HB3 TYR A 168 19.311 -6.551 7.203 1.00 25.55 H new ATOM 0 HD1 TYR A 168 21.643 -7.038 6.731 1.00 28.60 H new ATOM 0 HD2 TYR A 168 20.687 -3.427 8.197 1.00 26.13 H new ATOM 0 HE1 TYR A 168 23.894 -6.551 6.995 1.00 31.10 H new ATOM 0 HE2 TYR A 168 22.936 -2.903 8.415 1.00 26.29 H new ATOM 0 HH TYR A 168 25.060 -3.595 8.203 1.00 55.25 H new ATOM 1269 N CYS A 169 17.350 -6.480 4.942 1.00 17.99 N ATOM 1270 CA CYS A 169 16.035 -6.884 4.494 1.00 26.96 C ATOM 1271 C CYS A 169 15.905 -8.384 4.318 1.00 21.97 C ATOM 1272 O CYS A 169 16.880 -9.096 4.519 1.00 18.82 O ATOM 1273 CB CYS A 169 15.721 -6.136 3.162 1.00 35.18 C ATOM 1274 SG CYS A 169 17.055 -6.281 1.955 1.00 44.33 S ATOM 0 H CYS A 169 17.992 -7.014 4.736 1.00 17.99 H new ATOM 0 HA CYS A 169 15.391 -6.645 5.178 1.00 26.96 H new ATOM 0 HB2 CYS A 169 14.903 -6.492 2.780 1.00 35.18 H new ATOM 0 HB3 CYS A 169 15.561 -5.198 3.351 1.00 35.18 H new ATOM 0 HG CYS A 169 16.756 -5.690 0.955 1.00 44.33 H new ATOM 1275 N GLY A 170 14.700 -8.842 3.940 1.00 11.02 N ATOM 1276 CA GLY A 170 14.428 -10.248 3.692 1.00 12.60 C ATOM 1277 C GLY A 170 15.086 -10.648 2.372 1.00 16.70 C ATOM 1278 O GLY A 170 15.626 -9.810 1.663 1.00 11.85 O ATOM 0 H GLY A 170 14.018 -8.332 3.822 1.00 11.02 H new ATOM 0 HA2 GLY A 170 14.773 -10.791 4.418 1.00 12.60 H new ATOM 0 HA3 GLY A 170 13.471 -10.404 3.652 1.00 12.60 H new ATOM 1279 N HIS A 171 15.049 -11.922 2.012 1.00 17.88 N ATOM 1280 CA HIS A 171 15.743 -12.322 0.812 1.00 11.78 C ATOM 1281 C HIS A 171 15.251 -13.674 0.333 1.00 12.54 C ATOM 1282 O HIS A 171 14.725 -14.479 1.089 1.00 11.02 O ATOM 1283 CB HIS A 171 17.247 -12.509 1.221 1.00 7.08 C ATOM 1284 CG HIS A 171 17.373 -13.307 2.500 1.00 10.98 C ATOM 1285 ND1 HIS A 171 17.558 -14.679 2.504 1.00 10.33 N ATOM 1286 CD2 HIS A 171 17.263 -12.913 3.823 1.00 13.63 C ATOM 1287 CE1 HIS A 171 17.577 -15.081 3.788 1.00 14.49 C ATOM 1288 NE2 HIS A 171 17.400 -14.048 4.598 1.00 11.30 N ATOM 0 H HIS A 171 14.641 -12.549 2.436 1.00 17.88 H new ATOM 0 HA HIS A 171 15.606 -11.663 0.114 1.00 11.78 H new ATOM 0 HB2 HIS A 171 17.725 -12.960 0.507 1.00 7.08 H new ATOM 0 HB3 HIS A 171 17.663 -11.641 1.337 1.00 7.08 H new ATOM 0 HD1 HIS A 171 17.645 -15.182 1.812 1.00 10.33 H new ATOM 0 HD2 HIS A 171 17.123 -12.047 4.132 1.00 13.63 H new ATOM 0 HE1 HIS A 171 17.697 -15.960 4.067 1.00 14.49 H new ATOM 1289 N GLY A 172 15.501 -13.962 -0.932 1.00 12.99 N ATOM 1290 CA GLY A 172 15.139 -15.262 -1.403 1.00 9.23 C ATOM 1291 C GLY A 172 16.058 -16.225 -0.667 1.00 16.93 C ATOM 1292 O GLY A 172 17.101 -15.842 -0.143 1.00 14.21 O ATOM 0 H GLY A 172 15.865 -13.436 -1.507 1.00 12.99 H new ATOM 0 HA2 GLY A 172 14.207 -15.455 -1.216 1.00 9.23 H new ATOM 0 HA3 GLY A 172 15.256 -15.332 -2.363 1.00 9.23 H new ATOM 1293 N ILE A 173 15.687 -17.484 -0.641 1.00 11.53 N ATOM 1294 CA ILE A 173 16.467 -18.489 0.057 1.00 13.26 C ATOM 1295 C ILE A 173 16.139 -19.844 -0.514 1.00 14.45 C ATOM 1296 O ILE A 173 15.014 -20.063 -0.954 1.00 14.57 O ATOM 1297 CB ILE A 173 16.102 -18.458 1.559 1.00 12.12 C ATOM 1298 CG1 ILE A 173 16.912 -19.478 2.342 1.00 12.77 C ATOM 1299 CG2 ILE A 173 14.610 -18.752 1.754 1.00 15.15 C ATOM 1300 CD1 ILE A 173 16.864 -19.229 3.866 1.00 15.40 C ATOM 0 H ILE A 173 14.979 -17.785 -1.025 1.00 11.53 H new ATOM 0 HA ILE A 173 17.414 -18.310 -0.050 1.00 13.26 H new ATOM 0 HB ILE A 173 16.307 -17.570 1.890 1.00 12.12 H new ATOM 0 HG12 ILE A 173 16.576 -20.368 2.152 1.00 12.77 H new ATOM 0 HG13 ILE A 173 17.834 -19.453 2.042 1.00 12.77 H new ATOM 0 HG21 ILE A 173 14.396 -18.729 2.700 1.00 15.15 H new ATOM 0 HG22 ILE A 173 14.085 -18.083 1.288 1.00 15.15 H new ATOM 0 HG23 ILE A 173 14.404 -19.630 1.398 1.00 15.15 H new ATOM 0 HD11 ILE A 173 17.393 -19.903 4.321 1.00 15.40 H new ATOM 0 HD12 ILE A 173 17.223 -18.349 4.062 1.00 15.40 H new ATOM 0 HD13 ILE A 173 15.945 -19.278 4.173 1.00 15.40 H new ATOM 1301 N GLY A 174 17.089 -20.767 -0.506 1.00 11.19 N ATOM 1302 CA GLY A 174 16.816 -22.101 -1.024 1.00 10.71 C ATOM 1303 C GLY A 174 18.090 -22.921 -0.890 1.00 21.67 C ATOM 1304 O GLY A 174 18.528 -23.221 0.223 1.00 16.23 O ATOM 0 H GLY A 174 17.887 -20.646 -0.210 1.00 11.19 H new ATOM 0 HA2 GLY A 174 16.091 -22.516 -0.530 1.00 10.71 H new ATOM 0 HA3 GLY A 174 16.537 -22.055 -1.952 1.00 10.71 H new ATOM 1305 N GLN A 175 18.682 -23.244 -2.038 1.00 19.01 N ATOM 1306 CA GLN A 175 19.944 -23.929 -2.085 1.00 18.51 C ATOM 1307 C GLN A 175 20.974 -22.896 -1.676 1.00 16.10 C ATOM 1308 O GLN A 175 22.042 -23.176 -1.145 1.00 19.36 O ATOM 1309 CB GLN A 175 20.249 -24.488 -3.495 1.00 17.15 C ATOM 1310 CG GLN A 175 19.419 -25.744 -3.783 1.00 41.01 C ATOM 1311 CD GLN A 175 20.113 -26.668 -4.746 1.00 86.85 C ATOM 1312 OE1 GLN A 175 20.200 -26.359 -5.946 1.00100.00 O ATOM 1313 NE2 GLN A 175 20.626 -27.781 -4.217 1.00 67.43 N ATOM 0 H GLN A 175 18.351 -23.065 -2.811 1.00 19.01 H new ATOM 0 HA GLN A 175 19.945 -24.700 -1.496 1.00 18.51 H new ATOM 0 HB2 GLN A 175 20.058 -23.811 -4.163 1.00 17.15 H new ATOM 0 HB3 GLN A 175 21.193 -24.698 -3.566 1.00 17.15 H new ATOM 0 HG2 GLN A 175 19.246 -26.214 -2.952 1.00 41.01 H new ATOM 0 HG3 GLN A 175 18.558 -25.485 -4.147 1.00 41.01 H new ATOM 0 HE21 GLN A 175 20.533 -27.940 -3.377 1.00 67.43 H new ATOM 0 HE22 GLN A 175 21.050 -28.339 -4.716 1.00 67.43 H new ATOM 1314 N GLY A 176 20.646 -21.655 -1.942 1.00 14.18 N ATOM 1315 CA GLY A 176 21.495 -20.529 -1.578 1.00 13.44 C ATOM 1316 C GLY A 176 20.966 -19.903 -0.265 1.00 17.10 C ATOM 1317 O GLY A 176 19.784 -19.987 0.076 1.00 17.48 O ATOM 0 H GLY A 176 19.919 -21.431 -2.343 1.00 14.18 H new ATOM 0 HA2 GLY A 176 22.412 -20.824 -1.463 1.00 13.44 H new ATOM 0 HA3 GLY A 176 21.497 -19.868 -2.288 1.00 13.44 H new ATOM 1318 N PHE A 177 21.836 -19.297 0.510 1.00 17.54 N ATOM 1319 CA PHE A 177 21.417 -18.677 1.757 1.00 14.33 C ATOM 1320 C PHE A 177 20.672 -17.385 1.472 1.00 16.11 C ATOM 1321 O PHE A 177 19.584 -17.132 1.960 1.00 18.03 O ATOM 1322 CB PHE A 177 22.679 -18.357 2.555 1.00 13.76 C ATOM 1323 CG PHE A 177 22.520 -17.965 4.010 1.00 15.56 C ATOM 1324 CD1 PHE A 177 21.282 -17.619 4.554 1.00 11.89 C ATOM 1325 CD2 PHE A 177 23.657 -17.903 4.828 1.00 18.28 C ATOM 1326 CE1 PHE A 177 21.162 -17.251 5.900 1.00 14.21 C ATOM 1327 CE2 PHE A 177 23.561 -17.518 6.170 1.00 17.51 C ATOM 1328 CZ PHE A 177 22.307 -17.202 6.701 1.00 11.95 C ATOM 0 H PHE A 177 22.676 -19.230 0.338 1.00 17.54 H new ATOM 0 HA PHE A 177 20.830 -19.273 2.248 1.00 14.33 H new ATOM 0 HB2 PHE A 177 23.259 -19.134 2.518 1.00 13.76 H new ATOM 0 HB3 PHE A 177 23.142 -17.635 2.102 1.00 13.76 H new ATOM 0 HD1 PHE A 177 20.525 -17.633 4.014 1.00 11.89 H new ATOM 0 HD2 PHE A 177 24.488 -18.121 4.473 1.00 18.28 H new ATOM 0 HE1 PHE A 177 20.329 -17.041 6.257 1.00 14.21 H new ATOM 0 HE2 PHE A 177 24.322 -17.473 6.702 1.00 17.51 H new ATOM 0 HZ PHE A 177 22.234 -16.957 7.595 1.00 11.95 H new ATOM 1329 N HIS A 178 21.282 -16.533 0.666 1.00 10.76 N ATOM 1330 CA HIS A 178 20.668 -15.279 0.335 1.00 10.45 C ATOM 1331 C HIS A 178 20.481 -15.166 -1.158 1.00 24.30 C ATOM 1332 O HIS A 178 21.422 -14.828 -1.845 1.00 27.56 O ATOM 1333 CB HIS A 178 21.578 -14.147 0.808 1.00 13.40 C ATOM 1334 CG HIS A 178 21.604 -14.087 2.307 1.00 20.79 C ATOM 1335 ND1 HIS A 178 22.650 -14.652 3.030 1.00 21.24 N ATOM 1336 CD2 HIS A 178 20.699 -13.558 3.178 1.00 16.80 C ATOM 1337 CE1 HIS A 178 22.371 -14.438 4.319 1.00 23.70 C ATOM 1338 NE2 HIS A 178 21.200 -13.794 4.440 1.00 20.12 N ATOM 0 H HIS A 178 22.050 -16.668 0.304 1.00 10.76 H new ATOM 0 HA HIS A 178 19.802 -15.223 0.768 1.00 10.45 H new ATOM 0 HB2 HIS A 178 22.476 -14.283 0.468 1.00 13.40 H new ATOM 0 HB3 HIS A 178 21.265 -13.302 0.450 1.00 13.40 H new ATOM 0 HD2 HIS A 178 19.904 -13.125 2.964 1.00 16.80 H new ATOM 0 HE1 HIS A 178 22.911 -14.698 5.030 1.00 23.70 H new ATOM 0 HE2 HIS A 178 20.825 -13.567 5.180 1.00 20.12 H new ATOM 1339 N GLU A 179 19.303 -15.484 -1.661 1.00 15.04 N ATOM 1340 CA GLU A 179 19.048 -15.399 -3.087 1.00 12.03 C ATOM 1341 C GLU A 179 18.164 -14.195 -3.409 1.00 21.95 C ATOM 1342 O GLU A 179 17.655 -13.507 -2.531 1.00 18.10 O ATOM 1343 CB GLU A 179 18.276 -16.643 -3.568 1.00 9.90 C ATOM 1344 CG GLU A 179 18.922 -18.005 -3.242 1.00 14.71 C ATOM 1345 CD GLU A 179 18.064 -19.187 -3.656 1.00 15.76 C ATOM 1346 OE1 GLU A 179 16.850 -19.137 -3.813 1.00 26.86 O ATOM 1347 OE2 GLU A 179 18.724 -20.316 -3.710 1.00 19.27 O ATOM 0 H GLU A 179 18.634 -15.753 -1.192 1.00 15.04 H new ATOM 0 HA GLU A 179 19.910 -15.325 -3.526 1.00 12.03 H new ATOM 0 HB2 GLU A 179 17.389 -16.623 -3.176 1.00 9.90 H new ATOM 0 HB3 GLU A 179 18.163 -16.580 -4.529 1.00 9.90 H new ATOM 0 HG2 GLU A 179 19.781 -18.064 -3.688 1.00 14.71 H new ATOM 0 HG3 GLU A 179 19.094 -18.055 -2.289 1.00 14.71 H new ATOM 1348 N GLU A 180 17.937 -13.953 -4.696 1.00 15.13 N ATOM 1349 CA GLU A 180 17.043 -12.882 -5.089 1.00 16.84 C ATOM 1350 C GLU A 180 15.675 -13.378 -4.705 1.00 15.83 C ATOM 1351 O GLU A 180 15.426 -14.583 -4.686 1.00 18.97 O ATOM 1352 CB GLU A 180 17.086 -12.747 -6.620 1.00 20.69 C ATOM 1353 CG GLU A 180 18.340 -12.005 -7.068 1.00 30.05 C ATOM 1354 CD GLU A 180 18.352 -11.792 -8.548 1.00 77.50 C ATOM 1355 OE1 GLU A 180 19.368 -11.867 -9.210 1.00100.00 O ATOM 1356 OE2 GLU A 180 17.161 -11.529 -9.039 1.00 83.57 O ATOM 0 H GLU A 180 18.287 -14.393 -5.346 1.00 15.13 H new ATOM 0 HA GLU A 180 17.272 -12.032 -4.682 1.00 16.84 H new ATOM 0 HB2 GLU A 180 17.065 -13.627 -7.026 1.00 20.69 H new ATOM 0 HB3 GLU A 180 16.298 -12.273 -6.929 1.00 20.69 H new ATOM 0 HG2 GLU A 180 18.389 -11.148 -6.616 1.00 30.05 H new ATOM 0 HG3 GLU A 180 19.126 -12.509 -6.806 1.00 30.05 H new ATOM 1357 N PRO A 181 14.781 -12.483 -4.390 1.00 12.92 N ATOM 1358 CA PRO A 181 15.027 -11.083 -4.417 1.00 14.14 C ATOM 1359 C PRO A 181 15.302 -10.526 -3.032 1.00 20.08 C ATOM 1360 O PRO A 181 15.172 -11.235 -2.022 1.00 22.18 O ATOM 1361 CB PRO A 181 13.624 -10.539 -4.717 1.00 17.25 C ATOM 1362 CG PRO A 181 12.613 -11.533 -4.148 1.00 17.40 C ATOM 1363 CD PRO A 181 13.363 -12.847 -4.176 1.00 14.20 C ATOM 0 HA PRO A 181 15.762 -10.870 -5.013 1.00 14.14 H new ATOM 0 HB2 PRO A 181 13.505 -9.664 -4.316 1.00 17.25 H new ATOM 0 HB3 PRO A 181 13.497 -10.433 -5.673 1.00 17.25 H new ATOM 0 HG2 PRO A 181 12.344 -11.294 -3.247 1.00 17.40 H new ATOM 0 HG3 PRO A 181 11.806 -11.570 -4.685 1.00 17.40 H new ATOM 0 HD2 PRO A 181 13.248 -13.333 -3.345 1.00 14.20 H new ATOM 0 HD3 PRO A 181 13.038 -13.421 -4.887 1.00 14.20 H new ATOM 1364 N GLN A 182 15.601 -9.214 -3.017 1.00 16.25 N ATOM 1365 CA GLN A 182 15.773 -8.443 -1.782 1.00 15.55 C ATOM 1366 C GLN A 182 14.344 -8.100 -1.328 1.00 21.99 C ATOM 1367 O GLN A 182 13.542 -7.576 -2.110 1.00 22.80 O ATOM 1368 CB GLN A 182 16.409 -7.054 -2.003 1.00 15.39 C ATOM 1369 CG GLN A 182 17.940 -6.926 -1.909 1.00 51.84 C ATOM 1370 CD GLN A 182 18.381 -5.459 -2.007 1.00100.00 C ATOM 1371 OE1 GLN A 182 19.578 -5.139 -2.082 1.00100.00 O ATOM 1372 NE2 GLN A 182 17.407 -4.544 -2.017 1.00 78.06 N ATOM 0 H GLN A 182 15.709 -8.749 -3.732 1.00 16.25 H new ATOM 0 HA GLN A 182 16.327 -8.964 -1.179 1.00 15.55 H new ATOM 0 HB2 GLN A 182 16.140 -6.742 -2.881 1.00 15.39 H new ATOM 0 HB3 GLN A 182 16.021 -6.445 -1.355 1.00 15.39 H new ATOM 0 HG2 GLN A 182 18.248 -7.304 -1.070 1.00 51.84 H new ATOM 0 HG3 GLN A 182 18.354 -7.439 -2.620 1.00 51.84 H new ATOM 0 HE21 GLN A 182 16.585 -4.791 -1.964 1.00 78.06 H new ATOM 0 HE22 GLN A 182 17.602 -3.709 -2.077 1.00 78.06 H new ATOM 1373 N VAL A 183 14.000 -8.393 -0.085 1.00 15.32 N ATOM 1374 CA VAL A 183 12.668 -8.079 0.407 1.00 13.17 C ATOM 1375 C VAL A 183 12.775 -6.903 1.329 1.00 19.08 C ATOM 1376 O VAL A 183 13.166 -7.073 2.484 1.00 18.17 O ATOM 1377 CB VAL A 183 12.043 -9.255 1.123 1.00 16.52 C ATOM 1378 CG1 VAL A 183 10.647 -8.870 1.607 1.00 15.78 C ATOM 1379 CG2 VAL A 183 11.991 -10.442 0.168 1.00 11.40 C ATOM 0 H VAL A 183 14.518 -8.771 0.488 1.00 15.32 H new ATOM 0 HA VAL A 183 12.093 -7.870 -0.345 1.00 13.17 H new ATOM 0 HB VAL A 183 12.572 -9.503 1.897 1.00 16.52 H new ATOM 0 HG11 VAL A 183 10.244 -9.623 2.067 1.00 15.78 H new ATOM 0 HG12 VAL A 183 10.711 -8.117 2.216 1.00 15.78 H new ATOM 0 HG13 VAL A 183 10.097 -8.624 0.847 1.00 15.78 H new ATOM 0 HG21 VAL A 183 11.591 -11.203 0.618 1.00 11.40 H new ATOM 0 HG22 VAL A 183 11.458 -10.210 -0.609 1.00 11.40 H new ATOM 0 HG23 VAL A 183 12.891 -10.670 -0.114 1.00 11.40 H new ATOM 1380 N LEU A 184 12.453 -5.709 0.810 1.00 14.86 N ATOM 1381 CA LEU A 184 12.526 -4.469 1.602 1.00 17.06 C ATOM 1382 C LEU A 184 11.357 -4.373 2.575 1.00 17.47 C ATOM 1383 O LEU A 184 10.228 -4.757 2.234 1.00 11.41 O ATOM 1384 CB LEU A 184 12.473 -3.202 0.716 1.00 17.04 C ATOM 1385 CG LEU A 184 13.828 -2.723 0.242 1.00 23.61 C ATOM 1386 CD1 LEU A 184 14.592 -3.885 -0.337 1.00 22.48 C ATOM 1387 CD2 LEU A 184 13.613 -1.656 -0.827 1.00 20.74 C ATOM 0 H LEU A 184 12.189 -5.595 -0.001 1.00 14.86 H new ATOM 0 HA LEU A 184 13.374 -4.509 2.072 1.00 17.06 H new ATOM 0 HB2 LEU A 184 11.916 -3.383 -0.057 1.00 17.04 H new ATOM 0 HB3 LEU A 184 12.044 -2.488 1.214 1.00 17.04 H new ATOM 0 HG LEU A 184 14.335 -2.351 0.981 1.00 23.61 H new ATOM 0 HD11 LEU A 184 15.461 -3.581 -0.642 1.00 22.48 H new ATOM 0 HD12 LEU A 184 14.708 -4.567 0.343 1.00 22.48 H new ATOM 0 HD13 LEU A 184 14.099 -4.256 -1.085 1.00 22.48 H new ATOM 0 HD21 LEU A 184 14.473 -1.337 -1.143 1.00 20.74 H new ATOM 0 HD22 LEU A 184 13.117 -2.036 -1.569 1.00 20.74 H new ATOM 0 HD23 LEU A 184 13.112 -0.916 -0.450 1.00 20.74 H new ATOM 1388 N HIS A 185 11.617 -3.835 3.766 1.00 11.16 N ATOM 1389 CA HIS A 185 10.540 -3.697 4.756 1.00 14.44 C ATOM 1390 C HIS A 185 9.938 -2.299 4.784 1.00 16.56 C ATOM 1391 O HIS A 185 9.335 -1.863 5.767 1.00 16.42 O ATOM 1392 CB HIS A 185 10.944 -4.209 6.172 1.00 17.50 C ATOM 1393 CG HIS A 185 11.582 -5.564 6.131 1.00 14.07 C ATOM 1394 ND1 HIS A 185 12.948 -5.714 6.283 1.00 12.49 N ATOM 1395 CD2 HIS A 185 11.037 -6.794 5.944 1.00 12.98 C ATOM 1396 CE1 HIS A 185 13.213 -7.017 6.201 1.00 13.24 C ATOM 1397 NE2 HIS A 185 12.103 -7.699 5.976 1.00 13.83 N ATOM 0 H HIS A 185 12.388 -3.550 4.019 1.00 11.16 H new ATOM 0 HA HIS A 185 9.831 -4.287 4.455 1.00 14.44 H new ATOM 0 HB2 HIS A 185 11.558 -3.578 6.578 1.00 17.50 H new ATOM 0 HB3 HIS A 185 10.157 -4.242 6.738 1.00 17.50 H new ATOM 0 HD1 HIS A 185 13.520 -5.084 6.407 1.00 12.49 H new ATOM 0 HD2 HIS A 185 10.137 -6.994 5.820 1.00 12.98 H new ATOM 0 HE1 HIS A 185 14.059 -7.393 6.289 1.00 13.24 H new ATOM 1398 N TYR A 186 10.100 -1.569 3.683 1.00 15.73 N ATOM 1399 CA TYR A 186 9.537 -0.240 3.590 1.00 15.47 C ATOM 1400 C TYR A 186 9.105 0.054 2.167 1.00 17.11 C ATOM 1401 O TYR A 186 9.409 -0.706 1.247 1.00 14.94 O ATOM 1402 CB TYR A 186 10.465 0.853 4.104 1.00 15.34 C ATOM 1403 CG TYR A 186 11.752 0.871 3.333 1.00 17.63 C ATOM 1404 CD1 TYR A 186 12.018 1.908 2.442 1.00 21.49 C ATOM 1405 CD2 TYR A 186 12.727 -0.110 3.517 1.00 24.21 C ATOM 1406 CE1 TYR A 186 13.216 1.950 1.725 1.00 20.77 C ATOM 1407 CE2 TYR A 186 13.930 -0.087 2.806 1.00 21.58 C ATOM 1408 CZ TYR A 186 14.170 0.947 1.901 1.00 26.82 C ATOM 1409 OH TYR A 186 15.346 1.000 1.181 1.00 42.47 O ATOM 0 H TYR A 186 10.531 -1.829 2.986 1.00 15.73 H new ATOM 0 HA TYR A 186 8.762 -0.232 4.173 1.00 15.47 H new ATOM 0 HB2 TYR A 186 10.027 1.715 4.029 1.00 15.34 H new ATOM 0 HB3 TYR A 186 10.650 0.709 5.045 1.00 15.34 H new ATOM 0 HD1 TYR A 186 11.389 2.582 2.323 1.00 21.49 H new ATOM 0 HD2 TYR A 186 12.573 -0.795 4.127 1.00 24.21 H new ATOM 0 HE1 TYR A 186 13.378 2.646 1.130 1.00 20.77 H new ATOM 0 HE2 TYR A 186 14.564 -0.755 2.935 1.00 21.58 H new ATOM 0 HH TYR A 186 15.828 0.342 1.382 1.00 42.47 H new ATOM 1410 N ASP A 187 8.385 1.163 2.035 1.00 13.84 N ATOM 1411 CA ASP A 187 7.906 1.604 0.733 1.00 14.43 C ATOM 1412 C ASP A 187 9.021 2.189 -0.111 1.00 22.60 C ATOM 1413 O ASP A 187 9.668 3.155 0.298 1.00 21.34 O ATOM 1414 CB ASP A 187 6.769 2.617 0.801 1.00 12.51 C ATOM 1415 CG ASP A 187 6.193 2.928 -0.572 1.00 26.77 C ATOM 1416 OD1 ASP A 187 6.312 2.215 -1.536 1.00 28.80 O ATOM 1417 OD2 ASP A 187 5.545 4.047 -0.615 1.00 49.42 O ATOM 0 H ASP A 187 8.163 1.675 2.690 1.00 13.84 H new ATOM 0 HA ASP A 187 7.562 0.797 0.320 1.00 14.43 H new ATOM 0 HB2 ASP A 187 6.066 2.274 1.375 1.00 12.51 H new ATOM 0 HB3 ASP A 187 7.092 3.436 1.208 1.00 12.51 H new ATOM 1418 N SER A 188 9.231 1.606 -1.295 1.00 19.17 N ATOM 1419 CA SER A 188 10.268 2.093 -2.186 1.00 19.95 C ATOM 1420 C SER A 188 9.843 1.988 -3.629 1.00 20.32 C ATOM 1421 O SER A 188 9.370 0.934 -4.061 1.00 17.29 O ATOM 1422 CB SER A 188 11.547 1.289 -1.991 1.00 26.19 C ATOM 1423 OG SER A 188 12.502 1.645 -2.971 1.00 30.03 O ATOM 0 H SER A 188 8.785 0.934 -1.592 1.00 19.17 H new ATOM 0 HA SER A 188 10.425 3.026 -1.971 1.00 19.95 H new ATOM 0 HB2 SER A 188 11.907 1.451 -1.105 1.00 26.19 H new ATOM 0 HB3 SER A 188 11.353 0.340 -2.049 1.00 26.19 H new ATOM 0 HG SER A 188 13.269 1.422 -2.709 1.00 30.03 H new ATOM 1424 N ARG A 189 10.045 3.069 -4.375 1.00 16.12 N ATOM 1425 CA ARG A 189 9.692 3.079 -5.792 1.00 16.47 C ATOM 1426 C ARG A 189 10.620 2.202 -6.590 1.00 23.46 C ATOM 1427 O ARG A 189 10.333 1.805 -7.713 1.00 25.06 O ATOM 1428 CB ARG A 189 9.697 4.479 -6.359 1.00 29.86 C ATOM 1429 CG ARG A 189 8.739 5.399 -5.621 1.00 49.04 C ATOM 0 H ARG A 189 10.383 3.804 -4.083 1.00 16.12 H new ATOM 0 HA ARG A 189 8.791 2.726 -5.860 1.00 16.47 H new ATOM 0 HB2 ARG A 189 10.595 4.843 -6.310 1.00 29.86 H new ATOM 0 HB3 ARG A 189 9.454 4.447 -7.298 1.00 29.86 H new ATOM 1430 N GLU A 190 11.744 1.858 -5.973 1.00 17.43 N ATOM 1431 CA GLU A 190 12.709 0.961 -6.600 1.00 17.20 C ATOM 1432 C GLU A 190 12.215 -0.482 -6.685 1.00 30.58 C ATOM 1433 O GLU A 190 12.717 -1.273 -7.474 1.00 30.73 O ATOM 1434 CB GLU A 190 14.017 0.935 -5.789 1.00 17.09 C ATOM 1435 CG GLU A 190 14.689 2.291 -5.878 1.00 27.39 C ATOM 1436 CD GLU A 190 15.923 2.333 -5.055 1.00 40.79 C ATOM 1437 OE1 GLU A 190 16.095 3.141 -4.141 1.00 35.01 O ATOM 1438 OE2 GLU A 190 16.750 1.390 -5.428 1.00 27.64 O ATOM 0 H GLU A 190 11.968 2.133 -5.190 1.00 17.43 H new ATOM 0 HA GLU A 190 12.843 1.306 -7.497 1.00 17.20 H new ATOM 0 HB2 GLU A 190 13.831 0.715 -4.863 1.00 17.09 H new ATOM 0 HB3 GLU A 190 14.608 0.246 -6.131 1.00 17.09 H new ATOM 0 HG2 GLU A 190 14.907 2.487 -6.803 1.00 27.39 H new ATOM 0 HG3 GLU A 190 14.074 2.980 -5.580 1.00 27.39 H new ATOM 1439 N THR A 191 11.263 -0.853 -5.828 1.00 28.51 N ATOM 1440 CA THR A 191 10.773 -2.230 -5.786 1.00 26.85 C ATOM 1441 C THR A 191 9.706 -2.541 -6.814 1.00 29.45 C ATOM 1442 O THR A 191 8.659 -1.913 -6.796 1.00 22.95 O ATOM 1443 CB THR A 191 10.184 -2.547 -4.385 1.00 23.37 C ATOM 1444 OG1 THR A 191 11.072 -2.151 -3.344 1.00 26.90 O ATOM 1445 CG2 THR A 191 9.860 -4.029 -4.265 1.00 12.77 C ATOM 0 H THR A 191 10.889 -0.323 -5.264 1.00 28.51 H new ATOM 0 HA THR A 191 11.547 -2.780 -5.987 1.00 26.85 H new ATOM 0 HB THR A 191 9.365 -2.037 -4.289 1.00 23.37 H new ATOM 0 HG1 THR A 191 10.633 -1.995 -2.645 1.00 26.90 H new ATOM 0 HG21 THR A 191 9.494 -4.210 -3.385 1.00 12.77 H new ATOM 0 HG22 THR A 191 9.210 -4.274 -4.942 1.00 12.77 H new ATOM 0 HG23 THR A 191 10.669 -4.549 -4.391 1.00 12.77 H new ATOM 1446 N ASN A 192 9.966 -3.531 -7.672 1.00 25.76 N ATOM 1447 CA ASN A 192 8.993 -3.966 -8.671 1.00 25.58 C ATOM 1448 C ASN A 192 9.135 -5.468 -8.916 1.00 32.34 C ATOM 1449 O ASN A 192 9.815 -5.914 -9.838 1.00 32.41 O ATOM 1450 CB ASN A 192 9.055 -3.173 -9.999 1.00 29.07 C ATOM 1451 CG ASN A 192 7.749 -3.259 -10.758 1.00 51.06 C ATOM 1452 OD1 ASN A 192 7.376 -2.349 -11.502 1.00 91.90 O ATOM 1453 ND2 ASN A 192 7.024 -4.348 -10.547 1.00 28.97 N ATOM 0 H ASN A 192 10.708 -3.966 -7.689 1.00 25.76 H new ATOM 0 HA ASN A 192 8.115 -3.776 -8.304 1.00 25.58 H new ATOM 0 HB2 ASN A 192 9.262 -2.244 -9.813 1.00 29.07 H new ATOM 0 HB3 ASN A 192 9.774 -3.519 -10.550 1.00 29.07 H new ATOM 0 HD21 ASN A 192 6.262 -4.439 -10.936 1.00 28.97 H new ATOM 0 HD22 ASN A 192 7.315 -4.963 -10.021 1.00 28.97 H new ATOM 1454 N VAL A 193 8.504 -6.253 -8.046 1.00 29.40 N ATOM 1455 CA VAL A 193 8.561 -7.702 -8.114 1.00 23.25 C ATOM 1456 C VAL A 193 7.195 -8.303 -7.865 1.00 22.82 C ATOM 1457 O VAL A 193 6.590 -8.130 -6.808 1.00 21.92 O ATOM 1458 CB VAL A 193 9.568 -8.249 -7.101 1.00 23.58 C ATOM 1459 CG1 VAL A 193 9.397 -9.754 -6.909 1.00 25.19 C ATOM 1460 CG2 VAL A 193 10.995 -7.920 -7.525 1.00 22.52 C ATOM 0 H VAL A 193 8.028 -5.953 -7.396 1.00 29.40 H new ATOM 0 HA VAL A 193 8.851 -7.950 -9.006 1.00 23.25 H new ATOM 0 HB VAL A 193 9.395 -7.818 -6.249 1.00 23.58 H new ATOM 0 HG11 VAL A 193 10.046 -10.074 -6.263 1.00 25.19 H new ATOM 0 HG12 VAL A 193 8.502 -9.939 -6.585 1.00 25.19 H new ATOM 0 HG13 VAL A 193 9.534 -10.206 -7.756 1.00 25.19 H new ATOM 0 HG21 VAL A 193 11.617 -8.275 -6.871 1.00 22.52 H new ATOM 0 HG22 VAL A 193 11.175 -8.318 -8.391 1.00 22.52 H new ATOM 0 HG23 VAL A 193 11.102 -6.958 -7.583 1.00 22.52 H new ATOM 1461 N VAL A 194 6.722 -9.023 -8.867 1.00 17.67 N ATOM 1462 CA VAL A 194 5.443 -9.677 -8.794 1.00 20.42 C ATOM 1463 C VAL A 194 5.634 -11.102 -8.305 1.00 19.31 C ATOM 1464 O VAL A 194 6.416 -11.889 -8.868 1.00 18.15 O ATOM 1465 CB VAL A 194 4.711 -9.641 -10.150 1.00 22.32 C ATOM 1466 CG1 VAL A 194 3.435 -10.457 -10.041 1.00 15.86 C ATOM 1467 CG2 VAL A 194 4.396 -8.199 -10.556 1.00 22.13 C ATOM 0 H VAL A 194 7.139 -9.143 -9.609 1.00 17.67 H new ATOM 0 HA VAL A 194 4.883 -9.199 -8.163 1.00 20.42 H new ATOM 0 HB VAL A 194 5.282 -10.022 -10.836 1.00 22.32 H new ATOM 0 HG11 VAL A 194 2.967 -10.441 -10.890 1.00 15.86 H new ATOM 0 HG12 VAL A 194 3.655 -11.373 -9.811 1.00 15.86 H new ATOM 0 HG13 VAL A 194 2.867 -10.079 -9.352 1.00 15.86 H new ATOM 0 HG21 VAL A 194 3.936 -8.196 -11.410 1.00 22.13 H new ATOM 0 HG22 VAL A 194 3.830 -7.790 -9.883 1.00 22.13 H new ATOM 0 HG23 VAL A 194 5.222 -7.696 -10.632 1.00 22.13 H new ATOM 1468 N LEU A 195 4.891 -11.462 -7.279 1.00 14.53 N ATOM 1469 CA LEU A 195 5.028 -12.814 -6.753 1.00 12.18 C ATOM 1470 C LEU A 195 4.393 -13.896 -7.609 1.00 19.73 C ATOM 1471 O LEU A 195 3.340 -13.727 -8.243 1.00 17.52 O ATOM 1472 CB LEU A 195 4.341 -12.891 -5.384 1.00 14.62 C ATOM 1473 CG LEU A 195 5.244 -12.466 -4.246 1.00 26.81 C ATOM 1474 CD1 LEU A 195 6.399 -11.641 -4.760 1.00 22.26 C ATOM 1475 CD2 LEU A 195 4.458 -11.770 -3.145 1.00 27.72 C ATOM 0 H LEU A 195 4.317 -10.962 -6.879 1.00 14.53 H new ATOM 0 HA LEU A 195 5.983 -12.978 -6.721 1.00 12.18 H new ATOM 0 HB2 LEU A 195 3.551 -12.328 -5.392 1.00 14.62 H new ATOM 0 HB3 LEU A 195 4.040 -13.800 -5.229 1.00 14.62 H new ATOM 0 HG LEU A 195 5.626 -13.260 -3.841 1.00 26.81 H new ATOM 0 HD11 LEU A 195 6.965 -11.379 -4.017 1.00 22.26 H new ATOM 0 HD12 LEU A 195 6.916 -12.166 -5.391 1.00 22.26 H new ATOM 0 HD13 LEU A 195 6.059 -10.848 -5.203 1.00 22.26 H new ATOM 0 HD21 LEU A 195 5.061 -11.510 -2.431 1.00 27.72 H new ATOM 0 HD22 LEU A 195 4.025 -10.980 -3.506 1.00 27.72 H new ATOM 0 HD23 LEU A 195 3.786 -12.375 -2.795 1.00 27.72 H new ATOM 1476 N LYS A 196 5.032 -15.050 -7.575 1.00 15.90 N ATOM 1477 CA LYS A 196 4.542 -16.221 -8.297 1.00 21.71 C ATOM 1478 C LYS A 196 4.703 -17.465 -7.455 1.00 19.97 C ATOM 1479 O LYS A 196 5.577 -17.533 -6.638 1.00 20.51 O ATOM 1480 CB LYS A 196 5.049 -16.351 -9.720 1.00 24.24 C ATOM 1481 CG LYS A 196 6.438 -16.886 -9.871 1.00 30.57 C ATOM 1482 CD LYS A 196 6.934 -16.673 -11.298 1.00 34.70 C ATOM 1483 CE LYS A 196 6.310 -17.590 -12.369 1.00 38.80 C ATOM 1484 NZ LYS A 196 5.481 -18.697 -11.844 1.00 87.42 N ATOM 0 H LYS A 196 5.760 -15.183 -7.136 1.00 15.90 H new ATOM 0 HA LYS A 196 3.591 -16.090 -8.436 1.00 21.71 H new ATOM 0 HB2 LYS A 196 4.443 -16.929 -10.210 1.00 24.24 H new ATOM 0 HB3 LYS A 196 5.010 -15.478 -10.140 1.00 24.24 H new ATOM 0 HG2 LYS A 196 7.032 -16.442 -9.246 1.00 30.57 H new ATOM 0 HG3 LYS A 196 6.453 -17.831 -9.654 1.00 30.57 H new ATOM 0 HD2 LYS A 196 6.764 -15.751 -11.547 1.00 34.70 H new ATOM 0 HD3 LYS A 196 7.896 -16.798 -11.310 1.00 34.70 H new ATOM 0 HE2 LYS A 196 5.764 -17.048 -12.960 1.00 38.80 H new ATOM 0 HE3 LYS A 196 7.023 -17.966 -12.908 1.00 38.80 H new ATOM 0 HZ1 LYS A 196 5.329 -19.288 -12.492 1.00 87.42 H new ATOM 0 HZ2 LYS A 196 5.909 -19.097 -11.174 1.00 87.42 H new ATOM 0 HZ3 LYS A 196 4.706 -18.374 -11.550 1.00 87.42 H new ATOM 1485 N PRO A 197 3.853 -18.442 -7.606 1.00 18.54 N ATOM 1486 CA PRO A 197 3.957 -19.610 -6.780 1.00 17.91 C ATOM 1487 C PRO A 197 5.290 -20.320 -6.938 1.00 24.09 C ATOM 1488 O PRO A 197 5.876 -20.356 -8.026 1.00 17.49 O ATOM 1489 CB PRO A 197 2.804 -20.527 -7.186 1.00 21.62 C ATOM 1490 CG PRO A 197 1.984 -19.757 -8.208 1.00 20.82 C ATOM 1491 CD PRO A 197 2.789 -18.545 -8.632 1.00 18.30 C ATOM 0 HA PRO A 197 3.907 -19.359 -5.844 1.00 17.91 H new ATOM 0 HB2 PRO A 197 3.138 -21.356 -7.564 1.00 21.62 H new ATOM 0 HB3 PRO A 197 2.263 -20.764 -6.416 1.00 21.62 H new ATOM 0 HG2 PRO A 197 1.784 -20.317 -8.974 1.00 20.82 H new ATOM 0 HG3 PRO A 197 1.135 -19.484 -7.826 1.00 20.82 H new ATOM 0 HD2 PRO A 197 3.162 -18.660 -9.520 1.00 18.30 H new ATOM 0 HD3 PRO A 197 2.241 -17.745 -8.656 1.00 18.30 H new ATOM 1492 N GLY A 198 5.774 -20.919 -5.843 1.00 15.52 N ATOM 1493 CA GLY A 198 7.062 -21.613 -5.906 1.00 14.58 C ATOM 1494 C GLY A 198 8.228 -20.701 -5.508 1.00 15.25 C ATOM 1495 O GLY A 198 9.395 -21.104 -5.407 1.00 20.66 O ATOM 0 H GLY A 198 5.384 -20.935 -5.077 1.00 15.52 H new ATOM 0 HA2 GLY A 198 7.041 -22.385 -5.319 1.00 14.58 H new ATOM 0 HA3 GLY A 198 7.205 -21.945 -6.806 1.00 14.58 H new ATOM 1496 N MET A 199 7.949 -19.421 -5.310 1.00 10.69 N ATOM 1497 CA MET A 199 9.044 -18.579 -4.865 1.00 10.02 C ATOM 1498 C MET A 199 9.197 -18.802 -3.324 1.00 21.97 C ATOM 1499 O MET A 199 8.210 -18.967 -2.591 1.00 16.17 O ATOM 1500 CB MET A 199 8.736 -17.103 -5.052 1.00 10.57 C ATOM 1501 CG MET A 199 8.796 -16.656 -6.481 1.00 17.26 C ATOM 1502 SD MET A 199 8.505 -14.877 -6.549 1.00 25.02 S ATOM 1503 CE MET A 199 8.954 -14.567 -8.270 1.00 34.26 C ATOM 0 H MET A 199 7.186 -19.040 -5.419 1.00 10.69 H new ATOM 0 HA MET A 199 9.836 -18.808 -5.376 1.00 10.02 H new ATOM 0 HB2 MET A 199 7.852 -16.917 -4.699 1.00 10.57 H new ATOM 0 HB3 MET A 199 9.365 -16.580 -4.530 1.00 10.57 H new ATOM 0 HG2 MET A 199 9.662 -16.869 -6.863 1.00 17.26 H new ATOM 0 HG3 MET A 199 8.130 -17.125 -7.008 1.00 17.26 H new ATOM 0 HE1 MET A 199 9.669 -13.913 -8.305 1.00 34.26 H new ATOM 0 HE2 MET A 199 9.252 -15.394 -8.681 1.00 34.26 H new ATOM 0 HE3 MET A 199 8.182 -14.228 -8.750 1.00 34.26 H new ATOM 1504 N THR A 200 10.429 -18.810 -2.819 1.00 17.01 N ATOM 1505 CA THR A 200 10.645 -19.012 -1.383 1.00 14.63 C ATOM 1506 C THR A 200 11.498 -17.852 -0.904 1.00 18.06 C ATOM 1507 O THR A 200 12.523 -17.504 -1.517 1.00 17.45 O ATOM 1508 CB THR A 200 11.380 -20.347 -1.095 1.00 10.33 C ATOM 1509 OG1 THR A 200 12.501 -20.413 -1.967 1.00 14.93 O ATOM 1510 CG2 THR A 200 10.460 -21.502 -1.405 1.00 11.18 C ATOM 0 H THR A 200 11.146 -18.702 -3.282 1.00 17.01 H new ATOM 0 HA THR A 200 9.791 -19.052 -0.924 1.00 14.63 H new ATOM 0 HB THR A 200 11.653 -20.392 -0.165 1.00 10.33 H new ATOM 0 HG1 THR A 200 13.206 -20.287 -1.528 1.00 14.93 H new ATOM 0 HG21 THR A 200 10.918 -22.338 -1.225 1.00 11.18 H new ATOM 0 HG22 THR A 200 9.667 -21.442 -0.849 1.00 11.18 H new ATOM 0 HG23 THR A 200 10.203 -21.469 -2.340 1.00 11.18 H new ATOM 1511 N PHE A 201 11.066 -17.220 0.175 1.00 8.76 N ATOM 1512 CA PHE A 201 11.837 -16.090 0.673 1.00 11.52 C ATOM 1513 C PHE A 201 11.506 -15.870 2.133 1.00 8.77 C ATOM 1514 O PHE A 201 10.534 -16.465 2.663 1.00 10.99 O ATOM 1515 CB PHE A 201 11.682 -14.787 -0.177 1.00 12.56 C ATOM 1516 CG PHE A 201 10.227 -14.289 -0.261 1.00 18.19 C ATOM 1517 CD1 PHE A 201 9.381 -14.710 -1.293 1.00 23.99 C ATOM 1518 CD2 PHE A 201 9.698 -13.393 0.673 1.00 16.85 C ATOM 1519 CE1 PHE A 201 8.055 -14.276 -1.378 1.00 19.79 C ATOM 1520 CE2 PHE A 201 8.377 -12.949 0.606 1.00 16.03 C ATOM 1521 CZ PHE A 201 7.541 -13.399 -0.421 1.00 14.00 C ATOM 0 H PHE A 201 10.357 -17.417 0.620 1.00 8.76 H new ATOM 0 HA PHE A 201 12.777 -16.315 0.585 1.00 11.52 H new ATOM 0 HB2 PHE A 201 12.235 -14.089 0.207 1.00 12.56 H new ATOM 0 HB3 PHE A 201 12.014 -14.951 -1.073 1.00 12.56 H new ATOM 0 HD1 PHE A 201 9.709 -15.293 -1.939 1.00 23.99 H new ATOM 0 HD2 PHE A 201 10.243 -13.084 1.360 1.00 16.85 H new ATOM 0 HE1 PHE A 201 7.514 -14.572 -2.074 1.00 19.79 H new ATOM 0 HE2 PHE A 201 8.053 -12.355 1.243 1.00 16.03 H new ATOM 0 HZ PHE A 201 6.656 -13.118 -0.466 1.00 14.00 H new ATOM 1522 N THR A 202 12.304 -14.988 2.735 1.00 10.84 N ATOM 1523 CA THR A 202 12.108 -14.597 4.125 1.00 7.13 C ATOM 1524 C THR A 202 11.583 -13.163 4.210 1.00 13.29 C ATOM 1525 O THR A 202 11.800 -12.359 3.318 1.00 11.17 O ATOM 1526 CB THR A 202 13.432 -14.642 4.954 1.00 6.31 C ATOM 1527 OG1 THR A 202 14.236 -13.529 4.645 1.00 9.92 O ATOM 1528 CG2 THR A 202 14.215 -15.915 4.757 1.00 6.94 C ATOM 0 H THR A 202 12.969 -14.603 2.349 1.00 10.84 H new ATOM 0 HA THR A 202 11.474 -15.233 4.490 1.00 7.13 H new ATOM 0 HB THR A 202 13.174 -14.616 5.889 1.00 6.31 H new ATOM 0 HG1 THR A 202 14.720 -13.341 5.305 1.00 9.92 H new ATOM 0 HG21 THR A 202 15.022 -15.885 5.294 1.00 6.94 H new ATOM 0 HG22 THR A 202 13.674 -16.673 5.029 1.00 6.94 H new ATOM 0 HG23 THR A 202 14.453 -16.007 3.821 1.00 6.94 H new ATOM 1529 N ILE A 203 10.871 -12.866 5.294 1.00 7.06 N ATOM 1530 CA ILE A 203 10.412 -11.532 5.659 1.00 7.34 C ATOM 1531 C ILE A 203 11.008 -11.400 7.075 1.00 11.05 C ATOM 1532 O ILE A 203 10.840 -12.342 7.850 1.00 11.31 O ATOM 1533 CB ILE A 203 8.887 -11.343 5.674 1.00 12.31 C ATOM 1534 CG1 ILE A 203 8.318 -11.882 4.359 1.00 11.40 C ATOM 1535 CG2 ILE A 203 8.601 -9.835 5.832 1.00 14.34 C ATOM 1536 CD1 ILE A 203 6.836 -11.611 4.181 1.00 17.60 C ATOM 0 H ILE A 203 10.632 -13.466 5.862 1.00 7.06 H new ATOM 0 HA ILE A 203 10.688 -10.861 5.016 1.00 7.34 H new ATOM 0 HB ILE A 203 8.471 -11.823 6.407 1.00 12.31 H new ATOM 0 HG12 ILE A 203 8.803 -11.485 3.619 1.00 11.40 H new ATOM 0 HG13 ILE A 203 8.471 -12.839 4.317 1.00 11.40 H new ATOM 0 HG21 ILE A 203 7.642 -9.687 5.845 1.00 14.34 H new ATOM 0 HG22 ILE A 203 8.988 -9.517 6.663 1.00 14.34 H new ATOM 0 HG23 ILE A 203 8.993 -9.351 5.088 1.00 14.34 H new ATOM 0 HD11 ILE A 203 6.540 -11.976 3.333 1.00 17.60 H new ATOM 0 HD12 ILE A 203 6.341 -12.029 4.903 1.00 17.60 H new ATOM 0 HD13 ILE A 203 6.678 -10.654 4.194 1.00 17.60 H new ATOM 1537 N GLU A 204 11.733 -10.311 7.417 1.00 11.40 N ATOM 1538 CA GLU A 204 12.396 -10.206 8.721 1.00 4.17 C ATOM 1539 C GLU A 204 12.660 -8.756 9.107 1.00 6.95 C ATOM 1540 O GLU A 204 13.773 -8.242 9.264 1.00 9.43 O ATOM 1541 CB GLU A 204 13.736 -10.982 8.610 1.00 5.43 C ATOM 1542 CG GLU A 204 14.676 -10.593 7.421 1.00 11.85 C ATOM 1543 CD GLU A 204 15.993 -11.349 7.495 1.00 19.01 C ATOM 1544 OE1 GLU A 204 16.684 -11.339 8.514 1.00 15.44 O ATOM 1545 OE2 GLU A 204 16.305 -12.073 6.429 1.00 12.17 O ATOM 0 H GLU A 204 11.847 -9.630 6.904 1.00 11.40 H new ATOM 0 HA GLU A 204 11.825 -10.577 9.412 1.00 4.17 H new ATOM 0 HB2 GLU A 204 14.227 -10.858 9.437 1.00 5.43 H new ATOM 0 HB3 GLU A 204 13.533 -11.928 8.539 1.00 5.43 H new ATOM 0 HG2 GLU A 204 14.235 -10.787 6.579 1.00 11.85 H new ATOM 0 HG3 GLU A 204 14.846 -9.638 7.438 1.00 11.85 H new ATOM 1546 N PRO A 205 11.568 -8.077 9.283 1.00 10.28 N ATOM 1547 CA PRO A 205 11.574 -6.678 9.624 1.00 14.18 C ATOM 1548 C PRO A 205 12.326 -6.379 10.926 1.00 14.76 C ATOM 1549 O PRO A 205 12.158 -7.067 11.949 1.00 13.31 O ATOM 1550 CB PRO A 205 10.098 -6.351 9.854 1.00 14.02 C ATOM 1551 CG PRO A 205 9.397 -7.664 10.127 1.00 18.59 C ATOM 1552 CD PRO A 205 10.262 -8.743 9.518 1.00 12.40 C ATOM 0 HA PRO A 205 12.011 -6.164 8.927 1.00 14.18 H new ATOM 0 HB2 PRO A 205 9.993 -5.743 10.602 1.00 14.02 H new ATOM 0 HB3 PRO A 205 9.717 -5.913 9.077 1.00 14.02 H new ATOM 0 HG2 PRO A 205 9.287 -7.806 11.080 1.00 18.59 H new ATOM 0 HG3 PRO A 205 8.510 -7.670 9.735 1.00 18.59 H new ATOM 0 HD2 PRO A 205 10.354 -9.502 10.115 1.00 12.40 H new ATOM 0 HD3 PRO A 205 9.881 -9.077 8.691 1.00 12.40 H new ATOM 1553 N MET A 206 13.123 -5.325 10.881 1.00 12.51 N ATOM 1554 CA MET A 206 13.843 -4.880 12.052 1.00 10.37 C ATOM 1555 C MET A 206 13.246 -3.560 12.397 1.00 15.86 C ATOM 1556 O MET A 206 13.235 -2.650 11.569 1.00 16.15 O ATOM 1557 CB MET A 206 15.326 -4.709 11.762 1.00 12.44 C ATOM 1558 CG MET A 206 15.961 -6.056 11.562 1.00 18.43 C ATOM 1559 SD MET A 206 17.321 -6.002 10.369 1.00 23.68 S ATOM 1560 CE MET A 206 16.273 -6.191 8.894 1.00 29.81 C ATOM 0 H MET A 206 13.259 -4.852 10.176 1.00 12.51 H new ATOM 0 HA MET A 206 13.772 -5.526 12.772 1.00 10.37 H new ATOM 0 HB2 MET A 206 15.449 -4.163 10.970 1.00 12.44 H new ATOM 0 HB3 MET A 206 15.757 -4.244 12.496 1.00 12.44 H new ATOM 0 HG2 MET A 206 16.292 -6.385 12.412 1.00 18.43 H new ATOM 0 HG3 MET A 206 15.290 -6.686 11.256 1.00 18.43 H new ATOM 0 HE1 MET A 206 16.510 -7.010 8.431 1.00 29.81 H new ATOM 0 HE2 MET A 206 15.341 -6.230 9.161 1.00 29.81 H new ATOM 0 HE3 MET A 206 16.408 -5.435 8.302 1.00 29.81 H new ATOM 1561 N VAL A 207 12.746 -3.455 13.619 1.00 10.21 N ATOM 1562 CA VAL A 207 12.082 -2.242 14.072 1.00 5.89 C ATOM 1563 C VAL A 207 12.799 -1.637 15.238 1.00 14.17 C ATOM 1564 O VAL A 207 13.192 -2.372 16.147 1.00 15.15 O ATOM 1565 CB VAL A 207 10.664 -2.604 14.497 1.00 13.51 C ATOM 1566 CG1 VAL A 207 9.898 -1.332 14.901 1.00 12.33 C ATOM 1567 CG2 VAL A 207 9.971 -3.310 13.315 1.00 15.20 C ATOM 0 H VAL A 207 12.781 -4.081 14.207 1.00 10.21 H new ATOM 0 HA VAL A 207 12.077 -1.596 13.349 1.00 5.89 H new ATOM 0 HB VAL A 207 10.681 -3.198 15.264 1.00 13.51 H new ATOM 0 HG11 VAL A 207 8.997 -1.569 15.170 1.00 12.33 H new ATOM 0 HG12 VAL A 207 10.354 -0.901 15.641 1.00 12.33 H new ATOM 0 HG13 VAL A 207 9.860 -0.723 14.147 1.00 12.33 H new ATOM 0 HG21 VAL A 207 9.065 -3.549 13.567 1.00 15.20 H new ATOM 0 HG22 VAL A 207 9.947 -2.714 12.550 1.00 15.20 H new ATOM 0 HG23 VAL A 207 10.464 -4.113 13.083 1.00 15.20 H new ATOM 1568 N ASN A 208 12.933 -0.317 15.193 1.00 11.98 N ATOM 1569 CA ASN A 208 13.587 0.428 16.251 1.00 12.82 C ATOM 1570 C ASN A 208 12.612 1.262 17.032 1.00 14.96 C ATOM 1571 O ASN A 208 11.705 1.903 16.463 1.00 9.97 O ATOM 1572 CB ASN A 208 14.583 1.420 15.696 1.00 15.53 C ATOM 1573 CG ASN A 208 15.691 0.789 14.927 1.00 16.45 C ATOM 1574 OD1 ASN A 208 15.936 -0.429 14.991 1.00 13.82 O ATOM 1575 ND2 ASN A 208 16.402 1.665 14.241 1.00 14.71 N ATOM 0 H ASN A 208 12.645 0.170 14.545 1.00 11.98 H new ATOM 0 HA ASN A 208 14.012 -0.244 16.807 1.00 12.82 H new ATOM 0 HB2 ASN A 208 14.117 2.047 15.121 1.00 15.53 H new ATOM 0 HB3 ASN A 208 14.959 1.933 16.428 1.00 15.53 H new ATOM 0 HD21 ASN A 208 17.090 1.406 13.796 1.00 14.71 H new ATOM 0 HD22 ASN A 208 16.177 2.495 14.240 1.00 14.71 H new ATOM 1576 N ALA A 209 12.828 1.254 18.352 1.00 12.63 N ATOM 1577 CA ALA A 209 11.993 2.046 19.239 1.00 16.22 C ATOM 1578 C ALA A 209 12.251 3.516 18.979 1.00 19.80 C ATOM 1579 O ALA A 209 11.368 4.316 19.144 1.00 20.35 O ATOM 1580 CB ALA A 209 12.246 1.779 20.715 1.00 18.83 C ATOM 0 H ALA A 209 13.446 0.801 18.743 1.00 12.63 H new ATOM 0 HA ALA A 209 11.076 1.795 19.049 1.00 16.22 H new ATOM 0 HB1 ALA A 209 11.660 2.337 21.250 1.00 18.83 H new ATOM 0 HB2 ALA A 209 12.070 0.845 20.910 1.00 18.83 H new ATOM 0 HB3 ALA A 209 13.170 1.985 20.928 1.00 18.83 H new ATOM 1581 N GLY A 210 13.471 3.851 18.572 1.00 14.84 N ATOM 1582 CA GLY A 210 13.821 5.217 18.308 1.00 12.85 C ATOM 1583 C GLY A 210 13.829 5.527 16.835 1.00 22.11 C ATOM 1584 O GLY A 210 12.867 5.248 16.142 1.00 19.66 O ATOM 0 H GLY A 210 14.108 3.288 18.445 1.00 14.84 H new ATOM 0 HA2 GLY A 210 13.192 5.803 18.757 1.00 12.85 H new ATOM 0 HA3 GLY A 210 14.697 5.403 18.681 1.00 12.85 H new ATOM 1585 N LYS A 211 14.935 6.106 16.379 1.00 17.71 N ATOM 1586 CA LYS A 211 15.119 6.528 15.012 1.00 14.60 C ATOM 1587 C LYS A 211 15.643 5.390 14.165 1.00 20.89 C ATOM 1588 O LYS A 211 16.239 4.428 14.654 1.00 19.44 O ATOM 1589 CB LYS A 211 16.015 7.766 14.925 1.00 21.36 C ATOM 1590 CG LYS A 211 15.384 9.057 15.471 1.00 23.83 C ATOM 1591 CD LYS A 211 15.002 9.041 16.945 1.00 89.27 C ATOM 1592 CE LYS A 211 14.108 10.217 17.356 1.00100.00 C ATOM 1593 NZ LYS A 211 13.206 9.922 18.493 1.00100.00 N ATOM 0 H LYS A 211 15.616 6.266 16.879 1.00 17.71 H new ATOM 0 HA LYS A 211 14.253 6.782 14.656 1.00 14.60 H new ATOM 0 HB2 LYS A 211 16.836 7.591 15.412 1.00 21.36 H new ATOM 0 HB3 LYS A 211 16.260 7.908 13.997 1.00 21.36 H new ATOM 0 HG2 LYS A 211 16.006 9.787 15.324 1.00 23.83 H new ATOM 0 HG3 LYS A 211 14.589 9.252 14.951 1.00 23.83 H new ATOM 0 HD2 LYS A 211 14.543 8.210 17.144 1.00 89.27 H new ATOM 0 HD3 LYS A 211 15.810 9.055 17.482 1.00 89.27 H new ATOM 0 HE2 LYS A 211 14.670 10.972 17.589 1.00100.00 H new ATOM 0 HE3 LYS A 211 13.573 10.486 16.593 1.00100.00 H new ATOM 0 HZ1 LYS A 211 12.718 10.642 18.679 1.00100.00 H new ATOM 0 HZ2 LYS A 211 12.668 9.247 18.278 1.00100.00 H new ATOM 0 HZ3 LYS A 211 13.690 9.699 19.206 1.00100.00 H new ATOM 1594 N LYS A 212 15.411 5.512 12.872 1.00 13.97 N ATOM 1595 CA LYS A 212 15.771 4.466 11.931 1.00 13.59 C ATOM 1596 C LYS A 212 17.255 4.228 11.697 1.00 22.56 C ATOM 1597 O LYS A 212 17.649 3.132 11.264 1.00 18.20 O ATOM 1598 CB LYS A 212 15.093 4.725 10.588 1.00 14.42 C ATOM 1599 CG LYS A 212 15.818 5.812 9.802 1.00 15.29 C ATOM 1600 CD LYS A 212 15.083 6.251 8.556 1.00 27.20 C ATOM 1601 CE LYS A 212 15.466 7.672 8.173 1.00 45.40 C ATOM 1602 NZ LYS A 212 16.879 7.789 7.794 1.00 68.29 N ATOM 0 H LYS A 212 15.041 6.201 12.513 1.00 13.97 H new ATOM 0 HA LYS A 212 15.457 3.654 12.358 1.00 13.59 H new ATOM 0 HB2 LYS A 212 15.075 3.906 10.069 1.00 14.42 H new ATOM 0 HB3 LYS A 212 14.171 4.989 10.734 1.00 14.42 H new ATOM 0 HG2 LYS A 212 15.952 6.581 10.377 1.00 15.29 H new ATOM 0 HG3 LYS A 212 16.697 5.488 9.552 1.00 15.29 H new ATOM 0 HD2 LYS A 212 15.289 5.648 7.825 1.00 27.20 H new ATOM 0 HD3 LYS A 212 14.126 6.199 8.705 1.00 27.20 H new ATOM 0 HE2 LYS A 212 14.910 7.966 7.434 1.00 45.40 H new ATOM 0 HE3 LYS A 212 15.284 8.265 8.918 1.00 45.40 H new ATOM 0 HZ1 LYS A 212 16.957 8.349 7.107 1.00 68.29 H new ATOM 0 HZ2 LYS A 212 17.347 8.100 8.484 1.00 68.29 H new ATOM 0 HZ3 LYS A 212 17.191 6.989 7.561 1.00 68.29 H new ATOM 1603 N GLU A 213 18.073 5.247 11.920 1.00 20.78 N ATOM 1604 CA GLU A 213 19.488 5.132 11.626 1.00 21.24 C ATOM 1605 C GLU A 213 20.261 4.034 12.330 1.00 17.14 C ATOM 1606 O GLU A 213 20.042 3.777 13.488 1.00 16.68 O ATOM 1607 CB GLU A 213 20.203 6.484 11.587 1.00 23.26 C ATOM 1608 CG GLU A 213 19.668 7.388 10.448 1.00 25.95 C ATOM 1609 CD GLU A 213 18.377 8.061 10.807 1.00 31.83 C ATOM 1610 OE1 GLU A 213 17.981 8.137 11.954 1.00 32.92 O ATOM 1611 OE2 GLU A 213 17.739 8.559 9.778 1.00 42.16 O ATOM 0 H GLU A 213 17.829 6.008 12.239 1.00 20.78 H new ATOM 0 HA GLU A 213 19.486 4.794 10.717 1.00 21.24 H new ATOM 0 HB2 GLU A 213 20.088 6.935 12.438 1.00 23.26 H new ATOM 0 HB3 GLU A 213 21.155 6.343 11.467 1.00 23.26 H new ATOM 0 HG2 GLU A 213 20.332 8.062 10.235 1.00 25.95 H new ATOM 0 HG3 GLU A 213 19.539 6.854 9.649 1.00 25.95 H new ATOM 1612 N ILE A 214 21.178 3.400 11.604 1.00 13.39 N ATOM 1613 CA ILE A 214 21.988 2.320 12.174 1.00 16.32 C ATOM 1614 C ILE A 214 23.466 2.532 11.949 1.00 18.65 C ATOM 1615 O ILE A 214 23.905 3.390 11.182 1.00 19.67 O ATOM 1616 CB ILE A 214 21.552 0.944 11.648 1.00 19.63 C ATOM 1617 CG1 ILE A 214 21.547 0.960 10.126 1.00 24.77 C ATOM 1618 CG2 ILE A 214 20.129 0.650 12.084 1.00 18.95 C ATOM 1619 CD1 ILE A 214 22.266 -0.236 9.532 1.00 27.77 C ATOM 0 H ILE A 214 21.348 3.578 10.780 1.00 13.39 H new ATOM 0 HA ILE A 214 21.833 2.340 13.131 1.00 16.32 H new ATOM 0 HB ILE A 214 22.167 0.278 11.994 1.00 19.63 H new ATOM 0 HG12 ILE A 214 20.631 0.974 9.808 1.00 24.77 H new ATOM 0 HG13 ILE A 214 21.968 1.776 9.812 1.00 24.77 H new ATOM 0 HG21 ILE A 214 19.861 -0.220 11.749 1.00 18.95 H new ATOM 0 HG22 ILE A 214 20.080 0.651 13.053 1.00 18.95 H new ATOM 0 HG23 ILE A 214 19.535 1.330 11.730 1.00 18.95 H new ATOM 0 HD11 ILE A 214 22.237 -0.183 8.564 1.00 27.77 H new ATOM 0 HD12 ILE A 214 23.190 -0.238 9.828 1.00 27.77 H new ATOM 0 HD13 ILE A 214 21.832 -1.053 9.824 1.00 27.77 H new ATOM 1620 N ARG A 215 24.250 1.728 12.638 1.00 17.40 N ATOM 1621 CA ARG A 215 25.700 1.778 12.516 1.00 19.91 C ATOM 1622 C ARG A 215 26.322 0.385 12.670 1.00 26.05 C ATOM 1623 O ARG A 215 25.964 -0.368 13.591 1.00 22.61 O ATOM 1624 CB ARG A 215 26.346 2.762 13.502 1.00 20.51 C ATOM 0 H ARG A 215 23.962 1.136 13.191 1.00 17.40 H new ATOM 0 HA ARG A 215 25.884 2.105 11.621 1.00 19.91 H new ATOM 1625 N THR A 216 27.297 0.093 11.789 1.00 18.31 N ATOM 1626 CA THR A 216 28.044 -1.161 11.804 1.00 18.11 C ATOM 1627 C THR A 216 29.266 -1.083 12.691 1.00 17.84 C ATOM 1628 O THR A 216 30.041 -0.154 12.588 1.00 23.39 O ATOM 1629 CB THR A 216 28.430 -1.572 10.401 1.00 33.37 C ATOM 1630 OG1 THR A 216 27.238 -1.706 9.649 1.00 38.41 O ATOM 1631 CG2 THR A 216 29.198 -2.886 10.448 1.00 27.59 C ATOM 0 H THR A 216 27.539 0.630 11.162 1.00 18.31 H new ATOM 0 HA THR A 216 27.459 -1.839 12.177 1.00 18.11 H new ATOM 0 HB THR A 216 29.004 -0.908 9.987 1.00 33.37 H new ATOM 0 HG1 THR A 216 27.427 -1.933 8.863 1.00 38.41 H new ATOM 0 HG21 THR A 216 29.445 -3.149 9.548 1.00 27.59 H new ATOM 0 HG22 THR A 216 29.999 -2.774 10.983 1.00 27.59 H new ATOM 0 HG23 THR A 216 28.639 -3.574 10.843 1.00 27.59 H new ATOM 1632 N MET A 217 29.420 -2.057 13.583 1.00 16.74 N ATOM 1633 CA MET A 217 30.521 -2.069 14.514 1.00 16.34 C ATOM 1634 C MET A 217 31.809 -2.464 13.818 1.00 29.57 C ATOM 1635 O MET A 217 31.784 -2.934 12.683 1.00 27.20 O ATOM 1636 CB MET A 217 30.237 -3.011 15.697 1.00 21.73 C ATOM 1637 CG MET A 217 29.034 -2.607 16.545 1.00 26.24 C ATOM 1638 SD MET A 217 29.245 -0.997 17.384 1.00 33.21 S ATOM 1639 CE MET A 217 28.579 0.166 16.165 1.00 30.08 C ATOM 0 H MET A 217 28.885 -2.726 13.659 1.00 16.74 H new ATOM 0 HA MET A 217 30.624 -1.170 14.863 1.00 16.34 H new ATOM 0 HB2 MET A 217 30.093 -3.908 15.356 1.00 21.73 H new ATOM 0 HB3 MET A 217 31.023 -3.046 16.265 1.00 21.73 H new ATOM 0 HG2 MET A 217 28.247 -2.569 15.980 1.00 26.24 H new ATOM 0 HG3 MET A 217 28.872 -3.293 17.212 1.00 26.24 H new ATOM 0 HE1 MET A 217 29.306 0.670 15.767 1.00 30.08 H new ATOM 0 HE2 MET A 217 28.109 -0.325 15.472 1.00 30.08 H new ATOM 0 HE3 MET A 217 27.964 0.776 16.602 1.00 30.08 H new ATOM 1640 N LYS A 218 32.933 -2.249 14.521 1.00 30.44 N ATOM 1641 CA LYS A 218 34.250 -2.577 13.999 1.00 33.20 C ATOM 1642 C LYS A 218 34.460 -4.077 13.754 1.00 34.66 C ATOM 1643 O LYS A 218 35.364 -4.452 13.017 1.00 38.90 O ATOM 1644 CB LYS A 218 35.385 -1.968 14.815 1.00 33.98 C ATOM 0 H LYS A 218 32.943 -1.909 15.311 1.00 30.44 H new ATOM 0 HA LYS A 218 34.279 -2.157 13.125 1.00 33.20 H new ATOM 1645 N ASP A 219 33.634 -4.937 14.359 1.00 28.28 N ATOM 1646 CA ASP A 219 33.765 -6.374 14.153 1.00 28.44 C ATOM 1647 C ASP A 219 33.323 -6.774 12.759 1.00 32.05 C ATOM 1648 O ASP A 219 33.571 -7.880 12.287 1.00 37.50 O ATOM 1649 CB ASP A 219 33.031 -7.208 15.207 1.00 27.53 C ATOM 1650 CG ASP A 219 31.556 -6.949 15.191 1.00 16.62 C ATOM 1651 OD1 ASP A 219 30.972 -6.510 14.219 1.00 25.16 O ATOM 1652 OD2 ASP A 219 30.997 -7.212 16.347 1.00 32.74 O ATOM 0 H ASP A 219 32.997 -4.706 14.888 1.00 28.28 H new ATOM 0 HA ASP A 219 34.710 -6.569 14.252 1.00 28.44 H new ATOM 0 HB2 ASP A 219 33.196 -8.150 15.047 1.00 27.53 H new ATOM 0 HB3 ASP A 219 33.386 -7.004 16.086 1.00 27.53 H new ATOM 1653 N GLY A 220 32.637 -5.848 12.109 1.00 25.43 N ATOM 1654 CA GLY A 220 32.189 -6.056 10.763 1.00 23.63 C ATOM 1655 C GLY A 220 30.884 -6.823 10.622 1.00 31.96 C ATOM 1656 O GLY A 220 30.493 -7.177 9.504 1.00 35.24 O ATOM 0 H GLY A 220 32.422 -5.085 12.442 1.00 25.43 H new ATOM 0 HA2 GLY A 220 32.086 -5.192 10.335 1.00 23.63 H new ATOM 0 HA3 GLY A 220 32.881 -6.532 10.278 1.00 23.63 H new ATOM 1657 N TRP A 221 30.204 -7.075 11.730 1.00 18.24 N ATOM 1658 CA TRP A 221 28.968 -7.823 11.664 1.00 17.23 C ATOM 1659 C TRP A 221 27.878 -7.163 12.469 1.00 21.20 C ATOM 1660 O TRP A 221 26.750 -6.914 12.008 1.00 17.39 O ATOM 1661 CB TRP A 221 29.190 -9.234 12.249 1.00 19.13 C ATOM 1662 CG TRP A 221 29.946 -10.126 11.308 1.00 21.95 C ATOM 1663 CD1 TRP A 221 31.271 -10.479 11.373 1.00 22.83 C ATOM 1664 CD2 TRP A 221 29.407 -10.760 10.151 1.00 21.72 C ATOM 1665 NE1 TRP A 221 31.597 -11.294 10.326 1.00 26.43 N ATOM 1666 CE2 TRP A 221 30.464 -11.495 9.564 1.00 22.26 C ATOM 1667 CE3 TRP A 221 28.130 -10.754 9.583 1.00 22.08 C ATOM 1668 CZ2 TRP A 221 30.266 -12.264 8.436 1.00 22.76 C ATOM 1669 CZ3 TRP A 221 27.932 -11.503 8.450 1.00 30.21 C ATOM 1670 CH2 TRP A 221 28.985 -12.256 7.885 1.00 31.39 C ATOM 0 H TRP A 221 30.439 -6.825 12.518 1.00 18.24 H new ATOM 0 HA TRP A 221 28.701 -7.863 10.732 1.00 17.23 H new ATOM 0 HB2 TRP A 221 29.676 -9.163 13.085 1.00 19.13 H new ATOM 0 HB3 TRP A 221 28.331 -9.636 12.454 1.00 19.13 H new ATOM 0 HD1 TRP A 221 31.862 -10.203 12.035 1.00 22.83 H new ATOM 0 HE1 TRP A 221 32.375 -11.625 10.169 1.00 26.43 H new ATOM 0 HE3 TRP A 221 27.438 -10.260 9.960 1.00 22.08 H new ATOM 0 HZ2 TRP A 221 30.954 -12.764 8.061 1.00 22.76 H new ATOM 0 HZ3 TRP A 221 27.093 -11.515 8.049 1.00 30.21 H new ATOM 0 HH2 TRP A 221 28.819 -12.762 7.122 1.00 31.39 H new ATOM 1671 N THR A 222 28.230 -6.903 13.709 1.00 14.97 N ATOM 1672 CA THR A 222 27.280 -6.305 14.623 1.00 17.53 C ATOM 1673 C THR A 222 26.669 -4.977 14.146 1.00 23.00 C ATOM 1674 O THR A 222 27.349 -4.020 13.768 1.00 20.93 O ATOM 1675 CB THR A 222 27.894 -6.214 16.032 1.00 21.30 C ATOM 1676 OG1 THR A 222 28.346 -7.513 16.378 1.00 22.31 O ATOM 1677 CG2 THR A 222 26.836 -5.741 17.026 1.00 16.68 C ATOM 0 H THR A 222 29.007 -7.062 14.042 1.00 14.97 H new ATOM 0 HA THR A 222 26.514 -6.899 14.654 1.00 17.53 H new ATOM 0 HB THR A 222 28.629 -5.581 16.051 1.00 21.30 H new ATOM 0 HG1 THR A 222 29.186 -7.523 16.394 1.00 22.31 H new ATOM 0 HG21 THR A 222 27.226 -5.685 17.912 1.00 16.68 H new ATOM 0 HG22 THR A 222 26.510 -4.867 16.761 1.00 16.68 H new ATOM 0 HG23 THR A 222 26.098 -6.371 17.037 1.00 16.68 H new ATOM 1678 N VAL A 223 25.349 -4.907 14.194 1.00 14.65 N ATOM 1679 CA VAL A 223 24.702 -3.692 13.775 1.00 16.13 C ATOM 1680 C VAL A 223 23.956 -3.123 14.974 1.00 12.20 C ATOM 1681 O VAL A 223 23.283 -3.869 15.687 1.00 19.72 O ATOM 1682 CB VAL A 223 23.786 -3.926 12.543 1.00 17.36 C ATOM 1683 CG1 VAL A 223 23.108 -2.624 12.144 1.00 17.14 C ATOM 1684 CG2 VAL A 223 24.573 -4.453 11.328 1.00 19.30 C ATOM 0 H VAL A 223 24.826 -5.536 14.459 1.00 14.65 H new ATOM 0 HA VAL A 223 25.359 -3.044 13.477 1.00 16.13 H new ATOM 0 HB VAL A 223 23.130 -4.592 12.801 1.00 17.36 H new ATOM 0 HG11 VAL A 223 22.538 -2.778 11.374 1.00 17.14 H new ATOM 0 HG12 VAL A 223 22.571 -2.299 12.883 1.00 17.14 H new ATOM 0 HG13 VAL A 223 23.782 -1.964 11.919 1.00 17.14 H new ATOM 0 HG21 VAL A 223 23.967 -4.586 10.582 1.00 19.30 H new ATOM 0 HG22 VAL A 223 25.255 -3.809 11.080 1.00 19.30 H new ATOM 0 HG23 VAL A 223 24.994 -5.297 11.556 1.00 19.30 H new ATOM 1685 N LYS A 224 24.102 -1.813 15.211 1.00 11.32 N ATOM 1686 CA LYS A 224 23.411 -1.177 16.330 1.00 12.40 C ATOM 1687 C LYS A 224 22.638 0.025 15.897 1.00 15.92 C ATOM 1688 O LYS A 224 22.921 0.604 14.860 1.00 16.23 O ATOM 1689 CB LYS A 224 24.383 -0.752 17.410 1.00 16.51 C ATOM 1690 CG LYS A 224 24.917 -1.950 18.187 1.00 26.48 C ATOM 1691 CD LYS A 224 25.899 -1.530 19.270 1.00 22.07 C ATOM 1692 CE LYS A 224 25.534 -1.980 20.679 1.00100.00 C ATOM 1693 NZ LYS A 224 26.714 -2.176 21.546 1.00100.00 N ATOM 0 H LYS A 224 24.591 -1.285 14.740 1.00 11.32 H new ATOM 0 HA LYS A 224 22.799 -1.843 16.681 1.00 12.40 H new ATOM 0 HB2 LYS A 224 25.123 -0.270 17.009 1.00 16.51 H new ATOM 0 HB3 LYS A 224 23.943 -0.140 18.020 1.00 16.51 H new ATOM 0 HG2 LYS A 224 24.177 -2.430 18.590 1.00 26.48 H new ATOM 0 HG3 LYS A 224 25.353 -2.564 17.575 1.00 26.48 H new ATOM 0 HD2 LYS A 224 26.775 -1.884 19.049 1.00 22.07 H new ATOM 0 HD3 LYS A 224 25.974 -0.563 19.263 1.00 22.07 H new ATOM 0 HE2 LYS A 224 24.948 -1.320 21.082 1.00100.00 H new ATOM 0 HE3 LYS A 224 25.034 -2.810 20.629 1.00100.00 H new ATOM 0 HZ1 LYS A 224 26.449 -2.437 22.354 1.00100.00 H new ATOM 0 HZ2 LYS A 224 27.243 -2.798 21.192 1.00100.00 H new ATOM 0 HZ3 LYS A 224 27.163 -1.410 21.615 1.00100.00 H new ATOM 1694 N THR A 225 21.682 0.437 16.701 1.00 13.51 N ATOM 1695 CA THR A 225 20.937 1.622 16.330 1.00 12.60 C ATOM 1696 C THR A 225 21.835 2.833 16.552 1.00 18.57 C ATOM 1697 O THR A 225 22.647 2.821 17.479 1.00 15.96 O ATOM 1698 CB THR A 225 19.688 1.701 17.236 1.00 20.97 C ATOM 1699 OG1 THR A 225 20.104 1.707 18.569 1.00 14.90 O ATOM 1700 CG2 THR A 225 18.763 0.488 17.013 1.00 15.26 C ATOM 0 H THR A 225 21.452 0.063 17.441 1.00 13.51 H new ATOM 0 HA THR A 225 20.659 1.596 15.401 1.00 12.60 H new ATOM 0 HB THR A 225 19.197 2.509 17.019 1.00 20.97 H new ATOM 0 HG1 THR A 225 19.490 1.405 19.056 1.00 14.90 H new ATOM 0 HG21 THR A 225 17.988 0.561 17.592 1.00 15.26 H new ATOM 0 HG22 THR A 225 18.474 0.467 16.087 1.00 15.26 H new ATOM 0 HG23 THR A 225 19.244 -0.328 17.219 1.00 15.26 H new ATOM 1701 N LYS A 226 21.725 3.878 15.749 1.00 18.36 N ATOM 1702 CA LYS A 226 22.571 5.047 15.990 1.00 20.60 C ATOM 1703 C LYS A 226 22.199 5.750 17.290 1.00 24.24 C ATOM 1704 O LYS A 226 23.049 6.258 18.015 1.00 21.70 O ATOM 1705 CB LYS A 226 22.687 6.052 14.841 1.00 20.75 C ATOM 0 H LYS A 226 21.188 3.937 15.080 1.00 18.36 H new ATOM 0 HA LYS A 226 23.461 4.667 16.064 1.00 20.60 H new ATOM 1706 N ASP A 227 20.923 5.757 17.627 1.00 18.36 N ATOM 1707 CA ASP A 227 20.574 6.423 18.851 1.00 19.93 C ATOM 1708 C ASP A 227 20.546 5.552 20.092 1.00 21.78 C ATOM 1709 O ASP A 227 20.079 5.996 21.139 1.00 22.49 O ATOM 1710 CB ASP A 227 19.219 7.091 18.686 1.00 23.47 C ATOM 1711 CG ASP A 227 18.175 6.072 18.386 1.00 20.04 C ATOM 1712 OD1 ASP A 227 18.416 4.870 18.326 1.00 20.12 O ATOM 1713 OD2 ASP A 227 17.009 6.644 18.182 1.00 20.16 O ATOM 0 H ASP A 227 20.277 5.401 17.185 1.00 18.36 H new ATOM 0 HA ASP A 227 21.287 7.063 19.003 1.00 19.93 H new ATOM 0 HB2 ASP A 227 18.987 7.572 19.496 1.00 23.47 H new ATOM 0 HB3 ASP A 227 19.258 7.744 17.970 1.00 23.47 H new ATOM 1714 N ARG A 228 20.996 4.312 19.970 1.00 19.84 N ATOM 1715 CA ARG A 228 21.011 3.410 21.099 1.00 16.01 C ATOM 1716 C ARG A 228 19.637 2.983 21.592 1.00 21.63 C ATOM 1717 O ARG A 228 19.473 2.397 22.672 1.00 25.06 O ATOM 1718 CB ARG A 228 21.920 3.881 22.242 1.00 25.61 C ATOM 1719 CG ARG A 228 23.339 4.224 21.808 1.00 53.65 C ATOM 0 H ARG A 228 21.297 3.976 19.238 1.00 19.84 H new ATOM 0 HA ARG A 228 21.410 2.602 20.741 1.00 16.01 H new ATOM 0 HB2 ARG A 228 21.522 4.662 22.658 1.00 25.61 H new ATOM 0 HB3 ARG A 228 21.958 3.187 22.919 1.00 25.61 H new ATOM 1720 N SER A 229 18.607 3.246 20.804 1.00 17.82 N ATOM 1721 CA SER A 229 17.294 2.783 21.217 1.00 13.63 C ATOM 1722 C SER A 229 17.219 1.248 20.996 1.00 15.02 C ATOM 1723 O SER A 229 18.057 0.631 20.306 1.00 18.25 O ATOM 1724 CB SER A 229 16.190 3.507 20.430 1.00 18.36 C ATOM 1725 OG SER A 229 16.281 3.204 19.025 1.00 21.03 O ATOM 0 H SER A 229 18.641 3.672 20.058 1.00 17.82 H new ATOM 0 HA SER A 229 17.156 2.982 22.156 1.00 13.63 H new ATOM 0 HB2 SER A 229 15.320 3.242 20.767 1.00 18.36 H new ATOM 0 HB3 SER A 229 16.266 4.465 20.564 1.00 18.36 H new ATOM 0 HG SER A 229 16.902 3.652 18.681 1.00 21.03 H new ATOM 1726 N LEU A 230 16.204 0.605 21.578 1.00 13.83 N ATOM 1727 CA LEU A 230 16.045 -0.826 21.425 1.00 13.83 C ATOM 1728 C LEU A 230 15.613 -1.178 20.006 1.00 16.17 C ATOM 1729 O LEU A 230 14.924 -0.425 19.334 1.00 13.96 O ATOM 1730 CB LEU A 230 14.934 -1.351 22.372 1.00 13.06 C ATOM 1731 CG LEU A 230 15.204 -1.200 23.865 1.00 18.33 C ATOM 1732 CD1 LEU A 230 13.966 -1.645 24.646 1.00 22.07 C ATOM 1733 CD2 LEU A 230 16.385 -2.078 24.249 1.00 21.28 C ATOM 0 H LEU A 230 15.603 0.985 22.062 1.00 13.83 H new ATOM 0 HA LEU A 230 16.902 -1.230 21.632 1.00 13.83 H new ATOM 0 HB2 LEU A 230 14.108 -0.887 22.162 1.00 13.06 H new ATOM 0 HB3 LEU A 230 14.788 -2.291 22.181 1.00 13.06 H new ATOM 0 HG LEU A 230 15.405 -0.274 24.072 1.00 18.33 H new ATOM 0 HD11 LEU A 230 14.132 -1.551 25.597 1.00 22.07 H new ATOM 0 HD12 LEU A 230 13.209 -1.093 24.394 1.00 22.07 H new ATOM 0 HD13 LEU A 230 13.771 -2.573 24.442 1.00 22.07 H new ATOM 0 HD21 LEU A 230 16.562 -1.986 25.198 1.00 21.28 H new ATOM 0 HD22 LEU A 230 16.179 -3.004 24.047 1.00 21.28 H new ATOM 0 HD23 LEU A 230 17.169 -1.805 23.747 1.00 21.28 H new ATOM 1734 N SER A 231 15.998 -2.357 19.556 1.00 14.08 N ATOM 1735 CA SER A 231 15.602 -2.782 18.245 1.00 10.40 C ATOM 1736 C SER A 231 15.122 -4.219 18.324 1.00 16.74 C ATOM 1737 O SER A 231 15.686 -5.068 19.038 1.00 17.70 O ATOM 1738 CB SER A 231 16.758 -2.696 17.267 1.00 16.02 C ATOM 1739 OG SER A 231 16.286 -3.084 15.988 1.00 14.27 O ATOM 0 H SER A 231 16.483 -2.916 19.993 1.00 14.08 H new ATOM 0 HA SER A 231 14.894 -2.199 17.930 1.00 10.40 H new ATOM 0 HB2 SER A 231 17.110 -1.793 17.238 1.00 16.02 H new ATOM 0 HB3 SER A 231 17.484 -3.274 17.549 1.00 16.02 H new ATOM 0 HG SER A 231 16.121 -2.399 15.531 1.00 14.27 H new ATOM 1740 N ALA A 232 14.064 -4.510 17.603 1.00 9.22 N ATOM 1741 CA ALA A 232 13.515 -5.863 17.600 1.00 8.72 C ATOM 1742 C ALA A 232 13.336 -6.422 16.171 1.00 13.96 C ATOM 1743 O ALA A 232 13.160 -5.665 15.200 1.00 11.13 O ATOM 1744 CB ALA A 232 12.202 -5.935 18.390 1.00 7.67 C ATOM 0 H ALA A 232 13.643 -3.947 17.107 1.00 9.22 H new ATOM 0 HA ALA A 232 14.165 -6.428 18.045 1.00 8.72 H new ATOM 0 HB1 ALA A 232 11.862 -6.843 18.371 1.00 7.67 H new ATOM 0 HB2 ALA A 232 12.362 -5.670 19.309 1.00 7.67 H new ATOM 0 HB3 ALA A 232 11.551 -5.338 17.990 1.00 7.67 H new ATOM 1745 N GLN A 233 13.345 -7.753 16.061 1.00 13.46 N ATOM 1746 CA GLN A 233 13.205 -8.416 14.788 1.00 10.43 C ATOM 1747 C GLN A 233 12.608 -9.810 14.906 1.00 13.60 C ATOM 1748 O GLN A 233 12.791 -10.530 15.882 1.00 9.24 O ATOM 1749 CB GLN A 233 14.619 -8.529 14.174 1.00 10.78 C ATOM 1750 CG GLN A 233 14.574 -9.240 12.813 1.00 12.60 C ATOM 1751 CD GLN A 233 15.919 -9.399 12.155 1.00 25.40 C ATOM 1752 OE1 GLN A 233 16.883 -9.791 12.813 1.00 22.92 O ATOM 1753 NE2 GLN A 233 15.987 -9.123 10.844 1.00 17.42 N ATOM 0 H GLN A 233 13.433 -8.287 16.729 1.00 13.46 H new ATOM 0 HA GLN A 233 12.599 -7.897 14.237 1.00 10.43 H new ATOM 0 HB2 GLN A 233 15.001 -7.644 14.067 1.00 10.78 H new ATOM 0 HB3 GLN A 233 15.200 -9.017 14.779 1.00 10.78 H new ATOM 0 HG2 GLN A 233 14.177 -10.117 12.931 1.00 12.60 H new ATOM 0 HG3 GLN A 233 13.991 -8.742 12.219 1.00 12.60 H new ATOM 0 HE21 GLN A 233 15.287 -8.851 10.425 1.00 17.42 H new ATOM 0 HE22 GLN A 233 16.731 -9.218 10.423 1.00 17.42 H new ATOM 1754 N TYR A 234 11.866 -10.208 13.889 1.00 11.92 N ATOM 1755 CA TYR A 234 11.311 -11.561 13.822 1.00 8.84 C ATOM 1756 C TYR A 234 11.475 -11.961 12.359 1.00 11.11 C ATOM 1757 O TYR A 234 11.386 -11.101 11.490 1.00 10.60 O ATOM 1758 CB TYR A 234 9.823 -11.686 14.180 1.00 17.41 C ATOM 1759 CG TYR A 234 9.478 -11.614 15.642 1.00 10.73 C ATOM 1760 CD1 TYR A 234 9.276 -12.788 16.369 1.00 9.21 C ATOM 1761 CD2 TYR A 234 9.323 -10.377 16.262 1.00 11.08 C ATOM 1762 CE1 TYR A 234 8.933 -12.748 17.721 1.00 9.30 C ATOM 1763 CE2 TYR A 234 8.993 -10.321 17.617 1.00 10.64 C ATOM 1764 CZ TYR A 234 8.787 -11.500 18.329 1.00 14.59 C ATOM 1765 OH TYR A 234 8.450 -11.429 19.646 1.00 11.27 O ATOM 0 H TYR A 234 11.666 -9.709 13.217 1.00 11.92 H new ATOM 0 HA TYR A 234 11.772 -12.115 14.471 1.00 8.84 H new ATOM 0 HB2 TYR A 234 9.339 -10.983 13.719 1.00 17.41 H new ATOM 0 HB3 TYR A 234 9.497 -12.531 13.832 1.00 17.41 H new ATOM 0 HD1 TYR A 234 9.372 -13.610 15.945 1.00 9.21 H new ATOM 0 HD2 TYR A 234 9.439 -9.593 15.776 1.00 11.08 H new ATOM 0 HE1 TYR A 234 8.805 -13.532 18.204 1.00 9.30 H new ATOM 0 HE2 TYR A 234 8.911 -9.499 18.043 1.00 10.64 H new ATOM 0 HH TYR A 234 8.557 -12.181 20.004 1.00 11.27 H new ATOM 1766 N GLU A 235 11.680 -13.249 12.116 1.00 5.90 N ATOM 1767 CA GLU A 235 11.872 -13.738 10.783 1.00 9.07 C ATOM 1768 C GLU A 235 11.227 -15.096 10.551 1.00 11.34 C ATOM 1769 O GLU A 235 11.230 -16.004 11.388 1.00 10.43 O ATOM 1770 CB GLU A 235 13.383 -13.805 10.453 1.00 10.10 C ATOM 1771 CG GLU A 235 13.722 -14.441 9.083 1.00 9.86 C ATOM 1772 CD GLU A 235 15.200 -14.451 8.748 1.00 14.29 C ATOM 1773 OE1 GLU A 235 15.639 -14.428 7.601 1.00 14.66 O ATOM 1774 OE2 GLU A 235 15.982 -14.520 9.782 1.00 11.88 O ATOM 0 H GLU A 235 11.710 -13.855 12.726 1.00 5.90 H new ATOM 0 HA GLU A 235 11.431 -13.111 10.188 1.00 9.07 H new ATOM 0 HB2 GLU A 235 13.746 -12.906 10.476 1.00 10.10 H new ATOM 0 HB3 GLU A 235 13.831 -14.310 11.149 1.00 10.10 H new ATOM 0 HG2 GLU A 235 13.392 -15.353 9.071 1.00 9.86 H new ATOM 0 HG3 GLU A 235 13.247 -13.959 8.388 1.00 9.86 H new ATOM 1775 N HIS A 236 10.611 -15.218 9.381 1.00 8.78 N ATOM 1776 CA HIS A 236 10.059 -16.492 8.962 1.00 3.99 C ATOM 1777 C HIS A 236 10.466 -16.742 7.485 1.00 12.54 C ATOM 1778 O HIS A 236 10.616 -15.790 6.723 1.00 9.26 O ATOM 1779 CB HIS A 236 8.518 -16.594 9.107 1.00 5.79 C ATOM 1780 CG HIS A 236 8.036 -17.122 10.415 1.00 9.14 C ATOM 1781 ND1 HIS A 236 8.581 -18.243 10.987 1.00 13.05 N ATOM 1782 CD2 HIS A 236 7.049 -16.665 11.233 1.00 13.62 C ATOM 1783 CE1 HIS A 236 7.937 -18.436 12.130 1.00 13.82 C ATOM 1784 NE2 HIS A 236 7.015 -17.510 12.309 1.00 13.63 N ATOM 0 H HIS A 236 10.504 -14.576 8.819 1.00 8.78 H new ATOM 0 HA HIS A 236 10.423 -17.169 9.553 1.00 3.99 H new ATOM 0 HB2 HIS A 236 8.136 -15.713 8.970 1.00 5.79 H new ATOM 0 HB3 HIS A 236 8.178 -17.164 8.400 1.00 5.79 H new ATOM 0 HD2 HIS A 236 6.505 -15.925 11.089 1.00 13.62 H new ATOM 0 HE1 HIS A 236 8.112 -19.130 12.724 1.00 13.82 H new ATOM 0 HE2 HIS A 236 6.485 -17.448 12.984 1.00 13.63 H new ATOM 1785 N THR A 237 10.598 -18.008 7.090 1.00 11.15 N ATOM 1786 CA THR A 237 10.870 -18.413 5.694 1.00 10.55 C ATOM 1787 C THR A 237 9.527 -18.950 5.155 1.00 13.61 C ATOM 1788 O THR A 237 8.836 -19.724 5.814 1.00 11.45 O ATOM 1789 CB THR A 237 11.884 -19.575 5.629 1.00 15.46 C ATOM 1790 OG1 THR A 237 13.168 -19.124 6.065 1.00 17.13 O ATOM 1791 CG2 THR A 237 11.961 -20.100 4.191 1.00 13.08 C ATOM 0 H THR A 237 10.532 -18.673 7.631 1.00 11.15 H new ATOM 0 HA THR A 237 11.230 -17.664 5.193 1.00 10.55 H new ATOM 0 HB THR A 237 11.595 -20.293 6.214 1.00 15.46 H new ATOM 0 HG1 THR A 237 13.127 -18.901 6.874 1.00 17.13 H new ATOM 0 HG21 THR A 237 12.598 -20.831 4.147 1.00 13.08 H new ATOM 0 HG22 THR A 237 11.087 -20.416 3.915 1.00 13.08 H new ATOM 0 HG23 THR A 237 12.248 -19.386 3.600 1.00 13.08 H new ATOM 1792 N ILE A 238 9.117 -18.510 3.984 1.00 12.36 N ATOM 1793 CA ILE A 238 7.835 -18.951 3.452 1.00 12.16 C ATOM 1794 C ILE A 238 7.965 -19.361 1.978 1.00 12.95 C ATOM 1795 O ILE A 238 8.966 -19.120 1.329 1.00 11.31 O ATOM 1796 CB ILE A 238 6.828 -17.782 3.484 1.00 16.19 C ATOM 1797 CG1 ILE A 238 7.344 -16.704 2.541 1.00 21.05 C ATOM 1798 CG2 ILE A 238 6.616 -17.144 4.870 1.00 9.14 C ATOM 1799 CD1 ILE A 238 6.328 -15.602 2.270 1.00 21.65 C ATOM 0 H ILE A 238 9.554 -17.964 3.483 1.00 12.36 H new ATOM 0 HA ILE A 238 7.540 -19.700 3.994 1.00 12.16 H new ATOM 0 HB ILE A 238 5.969 -18.149 3.223 1.00 16.19 H new ATOM 0 HG12 ILE A 238 8.146 -16.310 2.919 1.00 21.05 H new ATOM 0 HG13 ILE A 238 7.599 -17.114 1.700 1.00 21.05 H new ATOM 0 HG21 ILE A 238 5.972 -16.422 4.799 1.00 9.14 H new ATOM 0 HG22 ILE A 238 6.283 -17.814 5.487 1.00 9.14 H new ATOM 0 HG23 ILE A 238 7.459 -16.793 5.197 1.00 9.14 H new ATOM 0 HD11 ILE A 238 6.713 -14.948 1.666 1.00 21.65 H new ATOM 0 HD12 ILE A 238 5.534 -15.986 1.867 1.00 21.65 H new ATOM 0 HD13 ILE A 238 6.089 -15.169 3.105 1.00 21.65 H new ATOM 1800 N VAL A 239 6.916 -19.989 1.477 1.00 13.14 N ATOM 1801 CA VAL A 239 6.804 -20.378 0.092 1.00 11.00 C ATOM 1802 C VAL A 239 5.472 -19.793 -0.417 1.00 17.05 C ATOM 1803 O VAL A 239 4.453 -19.857 0.295 1.00 12.58 O ATOM 1804 CB VAL A 239 6.866 -21.894 -0.161 1.00 9.19 C ATOM 1805 CG1 VAL A 239 5.748 -22.592 0.604 1.00 11.97 C ATOM 1806 CG2 VAL A 239 6.661 -22.127 -1.664 1.00 11.36 C ATOM 0 H VAL A 239 6.231 -20.206 1.950 1.00 13.14 H new ATOM 0 HA VAL A 239 7.573 -20.031 -0.387 1.00 11.00 H new ATOM 0 HB VAL A 239 7.720 -22.248 0.133 1.00 9.19 H new ATOM 0 HG11 VAL A 239 5.792 -23.547 0.441 1.00 11.97 H new ATOM 0 HG12 VAL A 239 5.850 -22.421 1.553 1.00 11.97 H new ATOM 0 HG13 VAL A 239 4.890 -22.252 0.305 1.00 11.97 H new ATOM 0 HG21 VAL A 239 6.696 -23.078 -1.852 1.00 11.36 H new ATOM 0 HG22 VAL A 239 5.797 -21.776 -1.931 1.00 11.36 H new ATOM 0 HG23 VAL A 239 7.361 -21.674 -2.160 1.00 11.36 H new ATOM 1807 N VAL A 240 5.490 -19.161 -1.603 1.00 11.23 N ATOM 1808 CA VAL A 240 4.261 -18.629 -2.187 1.00 12.16 C ATOM 1809 C VAL A 240 3.498 -19.813 -2.768 1.00 20.02 C ATOM 1810 O VAL A 240 4.059 -20.636 -3.486 1.00 16.47 O ATOM 1811 CB VAL A 240 4.507 -17.639 -3.316 1.00 13.75 C ATOM 1812 CG1 VAL A 240 3.174 -17.106 -3.801 1.00 11.43 C ATOM 1813 CG2 VAL A 240 5.336 -16.450 -2.817 1.00 13.62 C ATOM 0 H VAL A 240 6.198 -19.034 -2.075 1.00 11.23 H new ATOM 0 HA VAL A 240 3.778 -18.157 -1.491 1.00 12.16 H new ATOM 0 HB VAL A 240 4.984 -18.093 -4.028 1.00 13.75 H new ATOM 0 HG11 VAL A 240 3.321 -16.473 -4.522 1.00 11.43 H new ATOM 0 HG12 VAL A 240 2.629 -17.841 -4.123 1.00 11.43 H new ATOM 0 HG13 VAL A 240 2.717 -16.662 -3.070 1.00 11.43 H new ATOM 0 HG21 VAL A 240 5.484 -15.829 -3.547 1.00 13.62 H new ATOM 0 HG22 VAL A 240 4.859 -16.000 -2.102 1.00 13.62 H new ATOM 0 HG23 VAL A 240 6.190 -16.768 -2.485 1.00 13.62 H new ATOM 1814 N THR A 241 2.233 -19.950 -2.424 1.00 13.02 N ATOM 1815 CA THR A 241 1.465 -21.062 -2.954 1.00 13.08 C ATOM 1816 C THR A 241 0.498 -20.541 -4.003 1.00 18.24 C ATOM 1817 O THR A 241 0.525 -19.368 -4.325 1.00 18.12 O ATOM 1818 CB THR A 241 0.662 -21.742 -1.832 1.00 19.47 C ATOM 1819 OG1 THR A 241 -0.366 -20.867 -1.367 1.00 14.96 O ATOM 1820 CG2 THR A 241 1.593 -22.178 -0.699 1.00 18.97 C ATOM 0 H THR A 241 1.805 -19.423 -1.896 1.00 13.02 H new ATOM 0 HA THR A 241 2.074 -21.708 -3.345 1.00 13.08 H new ATOM 0 HB THR A 241 0.236 -22.540 -2.181 1.00 19.47 H new ATOM 0 HG1 THR A 241 -0.740 -21.206 -0.696 1.00 14.96 H new ATOM 0 HG21 THR A 241 1.074 -22.605 0.001 1.00 18.97 H new ATOM 0 HG22 THR A 241 2.249 -22.805 -1.042 1.00 18.97 H new ATOM 0 HG23 THR A 241 2.047 -21.401 -0.336 1.00 18.97 H new ATOM 1821 N ASP A 242 -0.378 -21.402 -4.507 1.00 18.32 N ATOM 1822 CA ASP A 242 -1.370 -21.014 -5.518 1.00 20.48 C ATOM 1823 C ASP A 242 -2.383 -19.991 -5.027 1.00 22.33 C ATOM 1824 O ASP A 242 -2.900 -19.209 -5.793 1.00 19.64 O ATOM 1825 CB ASP A 242 -2.149 -22.242 -6.043 1.00 28.88 C ATOM 1826 CG ASP A 242 -1.313 -23.172 -6.885 1.00 64.72 C ATOM 1827 OD1 ASP A 242 -1.307 -24.381 -6.738 1.00 66.73 O ATOM 1828 OD2 ASP A 242 -0.607 -22.551 -7.801 1.00 80.08 O ATOM 0 H ASP A 242 -0.418 -22.229 -4.276 1.00 18.32 H new ATOM 0 HA ASP A 242 -0.848 -20.607 -6.227 1.00 20.48 H new ATOM 0 HB2 ASP A 242 -2.507 -22.735 -5.288 1.00 28.88 H new ATOM 0 HB3 ASP A 242 -2.906 -21.936 -6.567 1.00 28.88 H new ATOM 1829 N ASN A 243 -2.724 -19.992 -3.741 1.00 19.99 N ATOM 1830 CA ASN A 243 -3.701 -19.030 -3.268 1.00 22.65 C ATOM 1831 C ASN A 243 -3.249 -18.326 -2.009 1.00 23.31 C ATOM 1832 O ASN A 243 -4.058 -17.854 -1.234 1.00 23.77 O ATOM 1833 CB ASN A 243 -5.048 -19.698 -3.047 1.00 18.35 C ATOM 1834 CG ASN A 243 -4.908 -20.677 -1.920 1.00 37.47 C ATOM 1835 OD1 ASN A 243 -3.877 -21.345 -1.791 1.00 42.02 O ATOM 1836 ND2 ASN A 243 -5.916 -20.725 -1.057 1.00 84.52 N ATOM 0 H ASN A 243 -2.410 -20.526 -3.145 1.00 19.99 H new ATOM 0 HA ASN A 243 -3.792 -18.355 -3.959 1.00 22.65 H new ATOM 0 HB2 ASN A 243 -5.724 -19.035 -2.837 1.00 18.35 H new ATOM 0 HB3 ASN A 243 -5.337 -20.151 -3.854 1.00 18.35 H new ATOM 0 HD21 ASN A 243 -5.869 -21.239 -0.369 1.00 84.52 H new ATOM 0 HD22 ASN A 243 -6.616 -20.242 -1.186 1.00 84.52 H new ATOM 1837 N GLY A 244 -1.944 -18.254 -1.802 1.00 20.66 N ATOM 1838 CA GLY A 244 -1.496 -17.600 -0.595 1.00 20.95 C ATOM 1839 C GLY A 244 -0.051 -17.949 -0.274 1.00 20.90 C ATOM 1840 O GLY A 244 0.865 -17.748 -1.096 1.00 15.33 O ATOM 0 H GLY A 244 -1.331 -18.561 -2.321 1.00 20.66 H new ATOM 0 HA2 GLY A 244 -1.583 -16.639 -0.695 1.00 20.95 H new ATOM 0 HA3 GLY A 244 -2.065 -17.861 0.146 1.00 20.95 H new ATOM 1841 N CYS A 245 0.150 -18.454 0.944 1.00 15.34 N ATOM 1842 CA CYS A 245 1.492 -18.826 1.354 1.00 11.49 C ATOM 1843 C CYS A 245 1.515 -19.889 2.436 1.00 17.80 C ATOM 1844 O CYS A 245 0.502 -20.175 3.092 1.00 18.42 O ATOM 1845 CB CYS A 245 2.373 -17.602 1.683 1.00 18.37 C ATOM 1846 SG CYS A 245 2.184 -16.995 3.383 1.00 23.38 S ATOM 0 H CYS A 245 -0.464 -18.585 1.531 1.00 15.34 H new ATOM 0 HA CYS A 245 1.899 -19.245 0.580 1.00 11.49 H new ATOM 0 HB2 CYS A 245 3.303 -17.834 1.533 1.00 18.37 H new ATOM 0 HB3 CYS A 245 2.157 -16.884 1.067 1.00 18.37 H new ATOM 0 HG CYS A 245 2.902 -16.049 3.553 1.00 23.38 H new ATOM 1847 N GLU A 246 2.698 -20.476 2.612 1.00 13.65 N ATOM 1848 CA GLU A 246 2.891 -21.466 3.630 1.00 13.00 C ATOM 1849 C GLU A 246 4.133 -21.061 4.422 1.00 16.45 C ATOM 1850 O GLU A 246 5.184 -20.758 3.861 1.00 11.75 O ATOM 1851 CB GLU A 246 3.019 -22.885 3.056 1.00 14.20 C ATOM 1852 CG GLU A 246 3.142 -23.981 4.125 1.00 24.09 C ATOM 1853 CD GLU A 246 3.379 -25.318 3.485 1.00 42.28 C ATOM 1854 OE1 GLU A 246 3.181 -25.540 2.314 1.00 25.22 O ATOM 1855 OE2 GLU A 246 3.872 -26.200 4.297 1.00 33.34 O ATOM 0 H GLU A 246 3.397 -20.304 2.142 1.00 13.65 H new ATOM 0 HA GLU A 246 2.113 -21.499 4.208 1.00 13.00 H new ATOM 0 HB2 GLU A 246 2.245 -23.071 2.502 1.00 14.20 H new ATOM 0 HB3 GLU A 246 3.797 -22.921 2.477 1.00 14.20 H new ATOM 0 HG2 GLU A 246 3.872 -23.771 4.728 1.00 24.09 H new ATOM 0 HG3 GLU A 246 2.333 -24.011 4.659 1.00 24.09 H new ATOM 1856 N ILE A 247 3.982 -21.046 5.737 1.00 11.39 N ATOM 1857 CA ILE A 247 5.077 -20.671 6.605 1.00 11.41 C ATOM 1858 C ILE A 247 5.811 -21.908 7.002 1.00 13.19 C ATOM 1859 O ILE A 247 5.324 -22.688 7.828 1.00 17.03 O ATOM 1860 CB ILE A 247 4.601 -19.916 7.836 1.00 14.42 C ATOM 1861 CG1 ILE A 247 3.806 -18.696 7.320 1.00 9.85 C ATOM 1862 CG2 ILE A 247 5.785 -19.494 8.755 1.00 9.86 C ATOM 1863 CD1 ILE A 247 2.609 -18.386 8.188 1.00 14.88 C ATOM 0 H ILE A 247 3.253 -21.250 6.144 1.00 11.39 H new ATOM 0 HA ILE A 247 5.665 -20.070 6.121 1.00 11.41 H new ATOM 0 HB ILE A 247 4.041 -20.481 8.391 1.00 14.42 H new ATOM 0 HG12 ILE A 247 4.390 -17.922 7.288 1.00 9.85 H new ATOM 0 HG13 ILE A 247 3.510 -18.866 6.412 1.00 9.85 H new ATOM 0 HG21 ILE A 247 5.442 -19.017 9.527 1.00 9.86 H new ATOM 0 HG22 ILE A 247 6.263 -20.285 9.051 1.00 9.86 H new ATOM 0 HG23 ILE A 247 6.389 -18.918 8.261 1.00 9.86 H new ATOM 0 HD11 ILE A 247 2.140 -17.616 7.830 1.00 14.88 H new ATOM 0 HD12 ILE A 247 2.012 -19.150 8.201 1.00 14.88 H new ATOM 0 HD13 ILE A 247 2.905 -18.192 9.091 1.00 14.88 H new ATOM 1864 N LEU A 248 6.993 -22.003 6.400 1.00 11.64 N ATOM 1865 CA LEU A 248 7.931 -23.099 6.573 1.00 11.02 C ATOM 1866 C LEU A 248 8.572 -23.153 7.984 1.00 16.49 C ATOM 1867 O LEU A 248 8.877 -24.216 8.494 1.00 12.65 O ATOM 1868 CB LEU A 248 8.993 -23.067 5.455 1.00 10.26 C ATOM 1869 CG LEU A 248 8.366 -23.132 4.057 1.00 16.29 C ATOM 1870 CD1 LEU A 248 9.448 -23.210 2.970 1.00 16.73 C ATOM 1871 CD2 LEU A 248 7.457 -24.351 4.004 1.00 11.86 C ATOM 0 H LEU A 248 7.280 -21.402 5.856 1.00 11.64 H new ATOM 0 HA LEU A 248 7.423 -23.922 6.500 1.00 11.02 H new ATOM 0 HB2 LEU A 248 9.519 -22.256 5.534 1.00 10.26 H new ATOM 0 HB3 LEU A 248 9.603 -23.813 5.569 1.00 10.26 H new ATOM 0 HG LEU A 248 7.853 -22.326 3.889 1.00 16.29 H new ATOM 0 HD11 LEU A 248 9.027 -23.250 2.097 1.00 16.73 H new ATOM 0 HD12 LEU A 248 10.014 -22.424 3.020 1.00 16.73 H new ATOM 0 HD13 LEU A 248 9.987 -24.005 3.106 1.00 16.73 H new ATOM 0 HD21 LEU A 248 7.048 -24.412 3.126 1.00 11.86 H new ATOM 0 HD22 LEU A 248 7.978 -25.151 4.174 1.00 11.86 H new ATOM 0 HD23 LEU A 248 6.764 -24.268 4.678 1.00 11.86 H new ATOM 1872 N THR A 249 8.749 -22.023 8.646 1.00 14.39 N ATOM 1873 CA THR A 249 9.397 -22.047 9.951 1.00 13.58 C ATOM 1874 C THR A 249 8.480 -21.804 11.147 1.00 12.55 C ATOM 1875 O THR A 249 8.932 -21.338 12.179 1.00 12.35 O ATOM 1876 CB THR A 249 10.503 -20.968 9.909 1.00 20.88 C ATOM 1877 OG1 THR A 249 9.928 -19.768 9.440 1.00 9.50 O ATOM 1878 CG2 THR A 249 11.704 -21.380 9.020 1.00 11.31 C ATOM 0 H THR A 249 8.508 -21.246 8.368 1.00 14.39 H new ATOM 0 HA THR A 249 9.736 -22.945 10.094 1.00 13.58 H new ATOM 0 HB THR A 249 10.858 -20.853 10.804 1.00 20.88 H new ATOM 0 HG1 THR A 249 9.360 -19.494 9.994 1.00 9.50 H new ATOM 0 HG21 THR A 249 12.369 -20.673 9.026 1.00 11.31 H new ATOM 0 HG22 THR A 249 12.098 -22.196 9.366 1.00 11.31 H new ATOM 0 HG23 THR A 249 11.398 -21.528 8.111 1.00 11.31 H new ATOM 1879 N LEU A 250 7.202 -22.105 11.015 1.00 7.97 N ATOM 1880 CA LEU A 250 6.249 -21.910 12.080 1.00 12.77 C ATOM 1881 C LEU A 250 6.617 -22.683 13.354 1.00 17.10 C ATOM 1882 O LEU A 250 7.059 -23.830 13.292 1.00 15.21 O ATOM 1883 CB LEU A 250 4.860 -22.390 11.610 1.00 15.05 C ATOM 1884 CG LEU A 250 3.693 -21.773 12.386 1.00 19.72 C ATOM 1885 CD1 LEU A 250 3.409 -20.368 11.874 1.00 19.10 C ATOM 1886 CD2 LEU A 250 2.459 -22.623 12.192 1.00 24.66 C ATOM 0 H LEU A 250 6.862 -22.432 10.296 1.00 7.97 H new ATOM 0 HA LEU A 250 6.249 -20.963 12.292 1.00 12.77 H new ATOM 0 HB2 LEU A 250 4.757 -22.181 10.668 1.00 15.05 H new ATOM 0 HB3 LEU A 250 4.817 -23.356 11.692 1.00 15.05 H new ATOM 0 HG LEU A 250 3.926 -21.732 13.327 1.00 19.72 H new ATOM 0 HD11 LEU A 250 2.669 -19.986 12.371 1.00 19.10 H new ATOM 0 HD12 LEU A 250 4.197 -19.815 11.992 1.00 19.10 H new ATOM 0 HD13 LEU A 250 3.180 -20.407 10.932 1.00 19.10 H new ATOM 0 HD21 LEU A 250 1.718 -22.235 12.683 1.00 24.66 H new ATOM 0 HD22 LEU A 250 2.237 -22.661 11.248 1.00 24.66 H new ATOM 0 HD23 LEU A 250 2.629 -23.520 12.520 1.00 24.66 H new ATOM 1887 N ARG A 251 6.416 -22.056 14.519 1.00 12.83 N ATOM 1888 CA ARG A 251 6.728 -22.695 15.805 1.00 15.16 C ATOM 1889 C ARG A 251 5.458 -22.887 16.567 1.00 20.60 C ATOM 1890 O ARG A 251 4.426 -22.286 16.202 1.00 14.12 O ATOM 1891 CB ARG A 251 7.520 -21.737 16.702 1.00 11.53 C ATOM 1892 CG ARG A 251 8.962 -21.555 16.288 1.00 13.92 C ATOM 1893 CD ARG A 251 9.681 -20.576 17.220 1.00 13.53 C ATOM 1894 NE ARG A 251 8.900 -19.352 17.542 1.00 14.84 N ATOM 1895 CZ ARG A 251 8.749 -18.245 16.797 1.00 16.74 C ATOM 1896 NH1 ARG A 251 9.303 -18.070 15.581 1.00 15.94 N ATOM 1897 NH2 ARG A 251 7.996 -17.263 17.287 1.00 14.85 N ATOM 0 H ARG A 251 6.099 -21.259 14.586 1.00 12.83 H new ATOM 0 HA ARG A 251 7.209 -23.515 15.611 1.00 15.16 H new ATOM 0 HB2 ARG A 251 7.082 -20.872 16.701 1.00 11.53 H new ATOM 0 HB3 ARG A 251 7.494 -22.067 17.614 1.00 11.53 H new ATOM 0 HG2 ARG A 251 9.416 -22.412 16.301 1.00 13.92 H new ATOM 0 HG3 ARG A 251 9.001 -21.227 15.376 1.00 13.92 H new ATOM 0 HD2 ARG A 251 9.900 -21.034 18.047 1.00 13.53 H new ATOM 0 HD3 ARG A 251 10.520 -20.313 16.811 1.00 13.53 H new ATOM 0 HE ARG A 251 8.494 -19.353 18.300 1.00 14.84 H new ATOM 0 HH11 ARG A 251 9.789 -18.690 15.236 1.00 15.94 H new ATOM 0 HH12 ARG A 251 9.171 -17.338 15.150 1.00 15.94 H new ATOM 0 HH21 ARG A 251 7.625 -17.350 18.058 1.00 14.85 H new ATOM 0 HH22 ARG A 251 7.881 -16.542 16.833 1.00 14.85 H new ATOM 1898 N LYS A 252 5.548 -23.667 17.655 1.00 17.06 N ATOM 1899 CA LYS A 252 4.392 -23.899 18.511 1.00 14.30 C ATOM 1900 C LYS A 252 3.813 -22.600 19.059 1.00 14.50 C ATOM 1901 O LYS A 252 2.639 -22.506 19.313 1.00 16.51 O ATOM 1902 CB LYS A 252 4.761 -24.763 19.725 1.00 23.17 C ATOM 1903 CG LYS A 252 5.062 -26.213 19.391 1.00 35.12 C ATOM 0 H LYS A 252 6.267 -24.065 17.907 1.00 17.06 H new ATOM 0 HA LYS A 252 3.740 -24.347 17.950 1.00 14.30 H new ATOM 0 HB2 LYS A 252 5.536 -24.375 20.161 1.00 23.17 H new ATOM 0 HB3 LYS A 252 4.031 -24.734 20.363 1.00 23.17 H new ATOM 1904 N ASP A 253 4.649 -21.596 19.316 1.00 9.10 N ATOM 1905 CA ASP A 253 4.212 -20.351 19.896 1.00 9.29 C ATOM 1906 C ASP A 253 3.739 -19.322 18.881 1.00 13.15 C ATOM 1907 O ASP A 253 3.329 -18.239 19.270 1.00 15.65 O ATOM 1908 CB ASP A 253 5.342 -19.774 20.772 1.00 17.29 C ATOM 1909 CG ASP A 253 6.636 -19.538 19.997 1.00 16.97 C ATOM 1910 OD1 ASP A 253 7.286 -20.424 19.482 1.00 24.37 O ATOM 1911 OD2 ASP A 253 6.958 -18.272 19.922 1.00 26.54 O ATOM 0 H ASP A 253 5.493 -21.628 19.153 1.00 9.10 H new ATOM 0 HA ASP A 253 3.432 -20.552 20.436 1.00 9.29 H new ATOM 0 HB2 ASP A 253 5.047 -18.936 21.161 1.00 17.29 H new ATOM 0 HB3 ASP A 253 5.517 -20.382 21.507 1.00 17.29 H new ATOM 1912 N ASP A 254 3.803 -19.631 17.589 1.00 13.70 N ATOM 1913 CA ASP A 254 3.311 -18.687 16.598 1.00 13.01 C ATOM 1914 C ASP A 254 1.798 -18.718 16.719 1.00 16.37 C ATOM 1915 O ASP A 254 1.272 -19.778 17.052 1.00 12.67 O ATOM 1916 CB ASP A 254 3.704 -19.082 15.158 1.00 7.99 C ATOM 1917 CG ASP A 254 5.015 -18.433 14.754 1.00 17.04 C ATOM 1918 OD1 ASP A 254 5.143 -17.226 14.635 1.00 10.22 O ATOM 1919 OD2 ASP A 254 6.003 -19.281 14.602 1.00 11.29 O ATOM 0 H ASP A 254 4.120 -20.365 17.273 1.00 13.70 H new ATOM 0 HA ASP A 254 3.693 -17.811 16.760 1.00 13.01 H new ATOM 0 HB2 ASP A 254 3.784 -20.047 15.094 1.00 7.99 H new ATOM 0 HB3 ASP A 254 3.004 -18.814 14.543 1.00 7.99 H new ATOM 1920 N THR A 255 1.133 -17.575 16.501 1.00 16.52 N ATOM 1921 CA THR A 255 -0.322 -17.529 16.591 1.00 22.43 C ATOM 1922 C THR A 255 -0.966 -17.290 15.250 1.00 27.34 C ATOM 1923 O THR A 255 -2.098 -16.843 15.139 1.00 31.82 O ATOM 1924 CB THR A 255 -0.793 -16.455 17.559 1.00 19.49 C ATOM 1925 OG1 THR A 255 -0.189 -15.257 17.157 1.00 20.01 O ATOM 1926 CG2 THR A 255 -0.341 -16.859 18.962 1.00 12.80 C ATOM 0 H THR A 255 1.506 -16.826 16.302 1.00 16.52 H new ATOM 0 HA THR A 255 -0.594 -18.400 16.920 1.00 22.43 H new ATOM 0 HB THR A 255 -1.757 -16.348 17.564 1.00 19.49 H new ATOM 0 HG1 THR A 255 -0.428 -14.636 17.670 1.00 20.01 H new ATOM 0 HG21 THR A 255 -0.630 -16.189 19.601 1.00 12.80 H new ATOM 0 HG22 THR A 255 -0.732 -17.716 19.194 1.00 12.80 H new ATOM 0 HG23 THR A 255 0.626 -16.930 18.983 1.00 12.80 H new ATOM 1927 N ILE A 256 -0.213 -17.562 14.219 1.00 18.61 N ATOM 1928 CA ILE A 256 -0.727 -17.383 12.884 1.00 19.01 C ATOM 1929 C ILE A 256 -0.815 -18.786 12.326 1.00 20.00 C ATOM 1930 O ILE A 256 -0.018 -19.623 12.729 1.00 14.41 O ATOM 1931 CB ILE A 256 0.198 -16.440 12.088 1.00 20.93 C ATOM 1932 CG1 ILE A 256 -0.433 -15.986 10.798 1.00 24.61 C ATOM 1933 CG2 ILE A 256 1.544 -17.078 11.779 1.00 14.20 C ATOM 1934 CD1 ILE A 256 0.221 -14.715 10.275 1.00 49.54 C ATOM 0 H ILE A 256 0.596 -17.850 14.264 1.00 18.61 H new ATOM 0 HA ILE A 256 -1.597 -16.956 12.844 1.00 19.01 H new ATOM 0 HB ILE A 256 0.339 -15.670 12.661 1.00 20.93 H new ATOM 0 HG12 ILE A 256 -0.355 -16.688 10.134 1.00 24.61 H new ATOM 0 HG13 ILE A 256 -1.380 -15.830 10.937 1.00 24.61 H new ATOM 0 HG21 ILE A 256 2.092 -16.453 11.279 1.00 14.20 H new ATOM 0 HG22 ILE A 256 1.991 -17.308 12.608 1.00 14.20 H new ATOM 0 HG23 ILE A 256 1.408 -17.881 11.252 1.00 14.20 H new ATOM 0 HD11 ILE A 256 -0.206 -14.449 9.446 1.00 49.54 H new ATOM 0 HD12 ILE A 256 0.123 -14.007 10.931 1.00 49.54 H new ATOM 0 HD13 ILE A 256 1.164 -14.878 10.115 1.00 49.54 H new ATOM 1935 N PRO A 257 -1.782 -19.084 11.458 1.00 23.08 N ATOM 1936 CA PRO A 257 -1.857 -20.431 10.916 1.00 18.53 C ATOM 1937 C PRO A 257 -0.733 -20.606 9.930 1.00 16.93 C ATOM 1938 O PRO A 257 -0.273 -19.640 9.336 1.00 17.65 O ATOM 1939 CB PRO A 257 -3.224 -20.592 10.216 1.00 21.25 C ATOM 1940 CG PRO A 257 -4.018 -19.350 10.579 1.00 26.70 C ATOM 1941 CD PRO A 257 -3.041 -18.333 11.178 1.00 20.38 C ATOM 0 HA PRO A 257 -1.775 -21.100 11.613 1.00 18.53 H new ATOM 0 HB2 PRO A 257 -3.117 -20.669 9.255 1.00 21.25 H new ATOM 0 HB3 PRO A 257 -3.677 -21.396 10.516 1.00 21.25 H new ATOM 0 HG2 PRO A 257 -4.453 -18.983 9.794 1.00 26.70 H new ATOM 0 HG3 PRO A 257 -4.717 -19.567 11.216 1.00 26.70 H new ATOM 0 HD2 PRO A 257 -2.879 -17.602 10.561 1.00 20.38 H new ATOM 0 HD3 PRO A 257 -3.401 -17.944 11.990 1.00 20.38 H new ATOM 1942 N ALA A 258 -0.317 -21.848 9.771 1.00 14.82 N ATOM 1943 CA ALA A 258 0.758 -22.253 8.902 1.00 15.98 C ATOM 1944 C ALA A 258 0.483 -22.046 7.418 1.00 17.31 C ATOM 1945 O ALA A 258 1.383 -21.738 6.647 1.00 15.04 O ATOM 1946 CB ALA A 258 1.009 -23.729 9.168 1.00 18.44 C ATOM 0 H ALA A 258 -0.674 -22.509 10.190 1.00 14.82 H new ATOM 0 HA ALA A 258 1.526 -21.695 9.100 1.00 15.98 H new ATOM 0 HB1 ALA A 258 1.730 -24.042 8.600 1.00 18.44 H new ATOM 0 HB2 ALA A 258 1.254 -23.853 10.098 1.00 18.44 H new ATOM 0 HB3 ALA A 258 0.203 -24.234 8.976 1.00 18.44 H new ATOM 1947 N ILE A 259 -0.752 -22.257 7.028 1.00 12.91 N ATOM 1948 CA ILE A 259 -1.162 -22.089 5.646 1.00 14.74 C ATOM 1949 C ILE A 259 -2.145 -20.948 5.600 1.00 16.02 C ATOM 1950 O ILE A 259 -3.145 -20.969 6.315 1.00 17.25 O ATOM 1951 CB ILE A 259 -1.846 -23.352 5.101 1.00 20.72 C ATOM 1952 CG1 ILE A 259 -0.944 -24.591 5.185 1.00 22.92 C ATOM 1953 CG2 ILE A 259 -2.344 -23.138 3.676 1.00 19.50 C ATOM 1954 CD1 ILE A 259 0.097 -24.651 4.073 1.00 40.45 C ATOM 0 H ILE A 259 -1.384 -22.503 7.556 1.00 12.91 H new ATOM 0 HA ILE A 259 -0.379 -21.915 5.101 1.00 14.74 H new ATOM 0 HB ILE A 259 -2.613 -23.521 5.671 1.00 20.72 H new ATOM 0 HG12 ILE A 259 -0.493 -24.598 6.044 1.00 22.92 H new ATOM 0 HG13 ILE A 259 -1.495 -25.388 5.148 1.00 22.92 H new ATOM 0 HG21 ILE A 259 -2.771 -23.949 3.357 1.00 19.50 H new ATOM 0 HG22 ILE A 259 -2.984 -22.409 3.663 1.00 19.50 H new ATOM 0 HG23 ILE A 259 -1.594 -22.920 3.100 1.00 19.50 H new ATOM 0 HD11 ILE A 259 0.636 -25.451 4.176 1.00 40.45 H new ATOM 0 HD12 ILE A 259 -0.350 -24.671 3.212 1.00 40.45 H new ATOM 0 HD13 ILE A 259 0.668 -23.869 4.122 1.00 40.45 H new ATOM 1955 N ILE A 260 -1.844 -19.920 4.810 1.00 13.01 N ATOM 1956 CA ILE A 260 -2.757 -18.808 4.698 1.00 12.50 C ATOM 1957 C ILE A 260 -3.413 -18.860 3.320 1.00 24.86 C ATOM 1958 O ILE A 260 -2.731 -18.883 2.320 1.00 18.37 O ATOM 1959 CB ILE A 260 -2.116 -17.480 4.969 1.00 17.08 C ATOM 1960 CG1 ILE A 260 -1.647 -17.500 6.409 1.00 17.88 C ATOM 1961 CG2 ILE A 260 -3.120 -16.368 4.769 1.00 15.72 C ATOM 1962 CD1 ILE A 260 -0.442 -16.590 6.606 1.00 22.22 C ATOM 0 H ILE A 260 -1.126 -19.854 4.341 1.00 13.01 H new ATOM 0 HA ILE A 260 -3.433 -18.895 5.388 1.00 12.50 H new ATOM 0 HB ILE A 260 -1.374 -17.325 4.364 1.00 17.08 H new ATOM 0 HG12 ILE A 260 -2.369 -17.216 6.991 1.00 17.88 H new ATOM 0 HG13 ILE A 260 -1.416 -18.407 6.665 1.00 17.88 H new ATOM 0 HG21 ILE A 260 -2.696 -15.514 4.946 1.00 15.72 H new ATOM 0 HG22 ILE A 260 -3.443 -16.384 3.855 1.00 15.72 H new ATOM 0 HG23 ILE A 260 -3.865 -16.491 5.377 1.00 15.72 H new ATOM 0 HD11 ILE A 260 -0.162 -16.620 7.534 1.00 22.22 H new ATOM 0 HD12 ILE A 260 0.286 -16.889 6.039 1.00 22.22 H new ATOM 0 HD13 ILE A 260 -0.682 -15.680 6.371 1.00 22.22 H new ATOM 1963 N SER A 261 -4.737 -18.921 3.266 1.00 25.96 N ATOM 1964 CA SER A 261 -5.419 -19.023 1.981 1.00 27.63 C ATOM 1965 C SER A 261 -6.288 -17.836 1.638 1.00 20.87 C ATOM 1966 O SER A 261 -7.009 -17.304 2.460 1.00 15.59 O ATOM 1967 CB SER A 261 -6.264 -20.295 1.891 1.00 37.20 C ATOM 1968 OG SER A 261 -6.901 -20.539 3.135 1.00 88.85 O ATOM 0 H SER A 261 -5.255 -18.905 3.952 1.00 25.96 H new ATOM 0 HA SER A 261 -4.699 -19.049 1.332 1.00 27.63 H new ATOM 0 HB2 SER A 261 -6.929 -20.203 1.191 1.00 37.20 H new ATOM 0 HB3 SER A 261 -5.703 -21.049 1.652 1.00 37.20 H new ATOM 0 HG SER A 261 -7.365 -21.237 3.080 1.00 88.85 H new ATOM 1969 N HIS A 262 -6.238 -17.444 0.384 1.00 15.22 N ATOM 1970 CA HIS A 262 -7.063 -16.329 -0.039 1.00 19.56 C ATOM 1971 C HIS A 262 -8.269 -16.772 -0.924 1.00 32.49 C ATOM 1972 O HIS A 262 -8.228 -17.802 -1.584 1.00 38.73 O ATOM 1973 CB HIS A 262 -6.190 -15.232 -0.672 1.00 19.20 C ATOM 1974 CG HIS A 262 -5.156 -14.681 0.261 1.00 23.41 C ATOM 1975 ND1 HIS A 262 -5.457 -13.682 1.162 1.00 29.11 N ATOM 1976 CD2 HIS A 262 -3.852 -15.011 0.417 1.00 21.95 C ATOM 1977 CE1 HIS A 262 -4.344 -13.422 1.845 1.00 24.49 C ATOM 1978 NE2 HIS A 262 -3.370 -14.206 1.418 1.00 22.15 N ATOM 0 H HIS A 262 -5.747 -17.797 -0.228 1.00 15.22 H new ATOM 0 HA HIS A 262 -7.479 -15.941 0.747 1.00 19.56 H new ATOM 0 HB2 HIS A 262 -5.748 -15.592 -1.457 1.00 19.20 H new ATOM 0 HB3 HIS A 262 -6.761 -14.509 -0.975 1.00 19.20 H new ATOM 0 HD2 HIS A 262 -3.378 -15.654 -0.059 1.00 21.95 H new ATOM 0 HE1 HIS A 262 -4.264 -12.786 2.519 1.00 24.49 H new ATOM 0 HE2 HIS A 262 -2.564 -14.211 1.719 1.00 22.15 H new ATOM 1979 N ASP A 263 -9.363 -16.014 -0.934 1.00 39.60 N ATOM 1980 CA ASP A 263 -10.540 -16.366 -1.728 1.00 41.36 C ATOM 1981 C ASP A 263 -11.668 -15.393 -1.409 1.00100.00 C ATOM 1982 O ASP A 263 -12.483 -15.633 -0.511 1.00 55.26 O ATOM 1983 CB ASP A 263 -11.014 -17.801 -1.419 1.00 41.64 C ATOM 0 H ASP A 263 -9.445 -15.286 -0.484 1.00 39.60 H new ATOM 0 HA ASP A 263 -10.300 -16.316 -2.667 1.00 41.36 H new TER 1984 ASP A 263 HETATM 1985 CO CO A 401 17.469 -14.117 6.694 1.00 15.55 CO HETATM 1986 CO CO A 402 18.089 -15.021 9.776 1.00 15.59 CO HETATM 1987 NA NA A 501 17.860 -6.341 19.522 1.00 12.11 NA HETATM 1988 N MPH A 300 20.241 -15.409 9.201 1.00 9.69 N HETATM 1989 CA MPH A 300 20.790 -14.069 8.949 1.00 10.70 C HETATM 1990 CB MPH A 300 22.207 -14.105 8.327 1.00 15.11 C HETATM 1991 CG MPH A 300 23.285 -14.520 9.333 1.00 23.84 C HETATM 1992 SD MPH A 300 24.836 -14.573 8.425 1.00 28.52 S HETATM 1993 CE MPH A 300 25.971 -14.363 9.806 1.00 31.81 C HETATM 1994 O1 MPH A 300 18.310 -13.357 8.465 1.00 16.77 O HETATM 1995 O2 MPH A 300 19.916 -13.736 6.400 1.00 15.44 O HETATM 1996 O3 MPH A 300 20.080 -11.615 7.951 1.00 11.05 O HETATM 1997 P MPH A 300 19.764 -13.157 7.865 1.00 13.44 P HETATM 0 HG2 MPH A 300 23.335 -13.887 10.066 1.00 23.84 H new HETATM 0 HG1 MPH A 300 23.081 -15.386 9.720 1.00 23.84 H new HETATM 0 HE3 MPH A 300 26.884 -14.369 9.479 1.00 31.81 H new HETATM 0 HE2 MPH A 300 25.792 -13.518 10.247 1.00 31.81 H new HETATM 0 HE1 MPH A 300 25.850 -15.089 10.438 1.00 31.81 H new HETATM 0 HB2 MPH A 300 22.212 -14.723 7.580 1.00 15.11 H new HETATM 0 HB1 MPH A 300 22.422 -13.229 7.971 1.00 15.11 H new HETATM 0 HA MPH A 300 20.836 -13.645 9.820 1.00 10.70 H new HETATM 0 H MPH A 300 20.703 -16.107 9.004 1.00 9.69 H new HETATM 1998 O HOH A 502 15.983 -12.362 11.803 1.00 15.71 O HETATM 1999 O HOH A 503 20.265 -11.970 16.005 1.00 16.48 O HETATM 2000 O HOH A 504 18.071 -9.090 15.263 1.00 12.34 O HETATM 2001 O HOH A 505 21.370 -16.869 11.529 1.00 22.64 O HETATM 2002 O HOH A 506 20.733 -11.444 13.453 1.00 18.44 O HETATM 2003 O HOH A 507 16.298 -5.814 15.518 1.00 15.30 O HETATM 2004 O HOH A 508 22.295 -21.162 12.569 1.00 23.21 O HETATM 2005 O HOH A 509 9.518 -15.845 13.802 1.00 8.49 O HETATM 2006 O HOH A 510 7.006 -15.498 15.283 1.00 16.08 O HETATM 2007 O HOH A 511 10.748 -20.017 13.900 1.00 8.79 O HETATM 2008 O HOH A 512 1.791 -22.606 15.957 1.00 31.16 O HETATM 2009 O HOH A 513 7.851 -25.452 11.161 1.00 30.15 O HETATM 2010 O HOH A 514 13.208 -23.460 4.567 1.00 23.59 O HETATM 2011 O HOH A 515 18.875 -11.146 -1.823 1.00 34.97 O HETATM 2012 O HOH A 516 27.145 -21.457 4.747 1.00 27.06 O HETATM 2013 O HOH A 517 25.113 -21.511 2.735 1.00 21.07 O HETATM 2014 O HOH A 518 27.244 -26.401 12.298 1.00 19.90 O HETATM 2015 O HOH A 519 29.473 -22.131 17.371 1.00 24.71 O HETATM 2016 O HOH A 520 29.832 -20.147 21.345 1.00 21.00 O HETATM 2017 O HOH A 521 26.879 -11.688 22.094 1.00 29.42 O HETATM 2018 O HOH A 522 28.102 -8.599 18.877 1.00 27.83 O HETATM 2019 O HOH A 523 26.009 -7.450 9.656 1.00 23.83 O HETATM 2020 O HOH A 524 25.969 -32.642 11.268 1.00 32.54 O HETATM 2021 O HOH A 525 12.490 -18.344 -4.784 1.00 21.48 O HETATM 2022 O HOH A 526 17.474 -22.665 -4.502 1.00 27.51 O HETATM 2023 O HOH A 527 -1.120 -14.898 2.483 1.00 18.61 O HETATM 2024 O HOH A 528 9.032 -4.708 -0.302 1.00 21.93 O HETATM 2025 O HOH A 529 9.453 -1.727 -1.101 1.00 21.04 O HETATM 2026 O HOH A 530 -0.143 -1.150 7.134 1.00 24.49 O HETATM 2027 O HOH A 531 17.870 -37.070 18.435 1.00 33.55 O HETATM 2028 O HOH A 532 12.938 -5.671 34.101 1.00 34.56 O HETATM 2029 O HOH A 533 9.874 0.424 29.473 1.00 19.23 O HETATM 2030 O HOH A 534 20.699 -21.244 30.867 1.00 29.74 O HETATM 2031 O HOH A 535 10.638 4.358 9.604 1.00 16.80 O HETATM 2032 O HOH A 536 15.619 9.335 11.551 1.00 35.03 O HETATM 2033 O HOH A 537 18.992 5.251 15.461 1.00 20.13 O HETATM 2034 O HOH A 538 14.114 -3.132 4.928 1.00 24.87 O HETATM 2035 O HOH A 539 13.908 -4.043 8.391 1.00 30.66 O HETATM 2036 O HOH A 540 17.749 2.359 8.561 1.00 15.87 O HETATM 2037 O HOH A 541 18.271 4.906 7.287 1.00 26.76 O HETATM 2038 O HOH A 542 21.414 4.252 8.837 1.00 27.87 O HETATM 2039 O HOH A 543 24.967 2.915 8.053 1.00 23.72 O HETATM 2040 O HOH A 544 -2.105 -21.378 0.572 1.00 30.15 O HETATM 2041 O HOH A 545 8.316 -22.025 21.631 1.00 49.08 O HETATM 2042 O HOH A 546 10.791 -20.527 21.763 1.00 18.62 O HETATM 2043 O HOH A 547 23.232 -8.077 28.580 1.00 29.48 O HETATM 2044 O HOH A 548 18.220 -4.982 30.554 1.00 34.68 O HETATM 2045 O HOH A 549 29.896 -9.837 20.605 1.00 39.91 O HETATM 2046 O HOH A 550 32.756 -13.434 20.132 1.00 35.22 O HETATM 2047 O HOH A 551 15.853 -4.093 27.483 1.00 33.76 O HETATM 2048 O HOH A 552 19.299 -9.494 36.119 1.00 27.04 O HETATM 2049 O HOH A 553 -0.803 -8.233 12.768 1.00 29.98 O HETATM 2050 O HOH A 554 0.492 -1.738 0.759 1.00 29.20 O HETATM 2051 O HOH A 555 15.399 -16.928 -5.572 1.00 32.48 O HETATM 2052 O HOH A 556 12.121 -32.103 -9.203 1.00 45.12 O HETATM 2053 O HOH A 557 15.925 -30.686 3.832 1.00 21.51 O HETATM 2054 O HOH A 558 15.646 -33.427 4.100 1.00 31.09 O HETATM 2055 O HOH A 559 14.280 -27.584 25.349 1.00 26.22 O HETATM 2056 O HOH A 560 11.191 -27.387 29.097 1.00 28.46 O HETATM 2057 O HOH A 561 11.989 -5.831 28.414 1.00 22.65 O HETATM 2058 O HOH A 562 32.221 -8.923 18.421 1.00 44.32 O HETATM 2059 O HOH A 563 24.858 -19.783 0.114 1.00 27.79 O HETATM 2060 O HOH A 564 24.116 -16.651 -0.257 1.00 40.48 O HETATM 2061 O HOH A 565 22.017 -2.931 26.134 1.00 49.80 O HETATM 2062 O HOH A 566 7.949 -26.672 7.972 1.00 33.60 O HETATM 2063 O HOH A 567 5.637 3.909 20.417 1.00 30.79 O HETATM 2064 O HOH A 568 5.910 -10.461 21.110 1.00 38.27 O HETATM 2065 O HOH A 569 8.181 -13.815 20.722 1.00 31.92 O HETATM 2066 O HOH A 570 10.182 -14.146 25.987 1.00 35.10 O HETATM 2067 O HOH A 571 10.187 -29.862 15.092 1.00 42.48 O HETATM 2068 O HOH A 572 15.490 -30.670 -5.084 1.00 35.47 O HETATM 2069 O HOH A 573 6.161 -30.155 -2.082 1.00 43.43 O HETATM 2070 O HOH A 574 1.033 -26.022 0.744 1.00 57.25 O HETATM 2071 O HOH A 575 -2.569 -9.656 -0.722 1.00 46.95 O HETATM 2072 O HOH A 576 -1.763 -0.132 9.300 1.00 41.84 O HETATM 2073 O HOH A 577 10.069 7.439 7.787 1.00 45.92 O HETATM 2074 O HOH A 578 13.862 7.572 12.430 1.00 39.30 O HETATM 2075 O HOH A 579 19.463 7.901 14.574 1.00 34.86 O HETATM 2076 O HOH A 580 13.967 -15.540 31.219 1.00 30.81 O HETATM 2077 O HOH A 581 6.237 -9.056 23.536 1.00 36.79 O HETATM 2078 O HOH A 582 19.275 -9.791 6.154 1.00 37.31 O HETATM 2079 O HOH A 583 19.065 -11.048 11.170 1.00 26.67 O HETATM 2080 O HOH A 584 1.902 5.424 8.966 1.00 30.90 O HETATM 2081 O HOH A 585 3.870 -23.561 -3.984 1.00 35.51 O HETATM 2082 O HOH A 586 16.723 -7.667 17.272 1.00 16.87 O HETATM 2083 O HOH A 587 -0.339 -21.386 14.169 1.00 32.58 O HETATM 2084 O HOH A 588 0.013 -20.588 19.187 1.00 41.38 O HETATM 2085 O HOH A 589 3.852 5.827 7.075 1.00 46.55 O HETATM 2086 O HOH A 590 11.266 6.815 10.549 1.00 39.91 O HETATM 2087 O HOH A 591 24.074 -8.835 21.022 1.00 19.66 O HETATM 2088 O HOH A 592 23.456 -5.171 23.657 1.00 33.90 O HETATM 2089 O HOH A 593 13.196 -1.040 28.325 1.00 43.00 O HETATM 2090 O HOH A 594 21.303 -18.312 34.976 1.00 31.33 O HETATM 2091 O HOH A 595 14.792 2.340 23.357 1.00 25.82 O HETATM 2092 O HOH A 596 0.822 -6.812 -9.115 1.00 41.49 O HETATM 2093 O HOH A 597 9.647 5.272 20.990 1.00 34.09 O CONECT 552 1987 CONECT 569 1987 CONECT 719 1986 CONECT 720 1986 CONECT 802 1985 CONECT 803 1986 CONECT 1288 1985 CONECT 1545 1985 CONECT 1737 1987 CONECT 1773 1985 CONECT 1774 1986 CONECT 1985 802 1288 1545 1773 CONECT 1985 1994 1995 CONECT 1986 719 720 803 1774 CONECT 1986 1988 1994 CONECT 1987 552 569 1737 2082 CONECT 1988 1986 1989 CONECT 1989 1988 1990 1997 CONECT 1990 1989 1991 CONECT 1991 1990 1992 CONECT 1992 1991 1993 CONECT 1993 1992 CONECT 1994 1985 1986 1997 CONECT 1995 1985 1997 CONECT 1996 1997 CONECT 1997 1989 1994 1995 1996 CONECT 2082 1987 END